data_1ruu_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 1ruu _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.214 -0.811 0 CA-C-O 118.819 -0.61 . . . . 0.0 111.532 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.65 -43.21 99.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.666 1.187 . . . . 0.0 112.404 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -65.93 -51.01 62.35 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 124.166 0.986 . . . . 0.0 111.325 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.9 tp -60.94 -37.09 81.12 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.406 0.682 . . . . 0.0 111.077 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -58.6 -34.16 70.81 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 125.77 1.628 . . . . 0.0 111.831 173.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -58.48 -59.63 5.07 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.492 1.042 . . . . 0.0 111.068 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -55.27 -48.94 73.28 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.373 0.669 . . . . 0.0 111.092 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.272 0.1 OUTLIER -59.26 -20.34 53.42 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 175.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.79 -55.18 5.72 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.711 -1.868 . . . . 0.0 111.16 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.25 -17.76 64.38 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.4 t -83.08 -36.12 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.789 1.636 . . . . 0.0 112.937 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 CA--C 1.515 -0.39 0 CA-C-O 117.821 -1.085 . . . . 0.0 110.823 175.257 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 119.402 -0.333 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.67 85.56 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.693 1.197 . . . . 0.0 112.303 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 t -71.92 -50.2 31.16 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 123.053 0.541 . . . . 0.0 111.325 174.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.3 tp -56.99 -37.9 72.31 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.934 0.893 . . . . 0.0 111.171 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -54.95 -36.46 65.34 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 125.772 1.629 . . . . 0.0 111.9 172.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -60.23 -55.57 32.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.171 1.351 . . . . 0.0 111.477 -178.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -57.01 -50.18 73.51 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.104 0.561 . . . . 0.0 110.643 174.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.277 0.1 OUTLIER -58.4 -21.1 49.37 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 175.511 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -76.2 -56.54 4.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.036 1.734 . . . . 0.0 110.982 176.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 pp -67.04 -19.35 65.67 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 176.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.0 t -82.48 -31.27 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.098 1.759 . . . . 0.0 112.908 173.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 N--CA 1.467 0.415 0 O-C-N 121.196 -0.94 . . . . 0.0 112.035 176.912 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.216 -0.688 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.64 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.12 -40.09 96.59 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.166 2.187 . . . . 0.0 112.379 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 t -69.87 -51.7 31.04 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 123.318 0.386 . . . . 0.0 110.881 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.49 -34.41 72.54 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.841 -0.537 . . . . 0.0 112.194 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -57.4 -31.67 66.07 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 125.62 1.568 . . . . 0.0 111.973 172.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -58.96 -60.07 4.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 120.317 1.417 . . . . 0.0 111.112 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -54.81 -49.18 71.64 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.362 0.665 . . . . 0.0 111.271 174.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.299 0.1 OUTLIER -57.18 -28.62 62.97 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 121.67 -0.643 . . . . 0.0 112.554 175.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -67.83 -60.1 2.78 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 126.142 1.777 . . . . 0.0 110.35 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.55 -11.82 58.93 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 118.472 -0.775 . . . . 0.0 113.024 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -84.85 -40.16 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.152 1.381 . . . . 0.0 111.66 171.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 CA--C 1.518 -0.271 0 C-N-CA 123.496 0.718 . . . . 0.0 111.281 175.235 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.95 -28.04 69.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.714 1.206 . . . . 0.0 113.069 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.98 -47.02 19.49 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.873 0.869 . . . . 0.0 111.189 172.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.15 -32.22 73.71 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 0.0 112.539 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.15 -28.28 25.28 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.492 1.517 . . . . 0.0 112.325 169.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -68.07 -63.05 1.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.836 1.198 . . . . 0.0 111.242 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -54.42 -48.47 71.62 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.23 0.612 . . . . 0.0 110.752 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.291 0.1 OUTLIER -57.91 -23.94 55.58 Favored 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 176.411 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -74.32 -51.13 16.11 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.911 1.684 . . . . 0.0 112.11 175.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 -8.18 55.4 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -89.16 -38.85 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 126.14 1.776 . . . . 0.0 111.84 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 124.404 1.082 . . . . 0.0 113.823 -179.913 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.216 -0.693 0 CA-C-O 118.927 -0.559 . . . . 0.0 112.335 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.85 -37.1 85.51 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.164 1.786 . . . . 0.0 111.445 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t -72.82 -48.28 39.26 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 124.001 0.92 . . . . 0.0 111.041 174.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.84 -32.06 73.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.191 0.596 . . . . 0.0 111.297 177.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -24.79 67.9 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.333 1.853 . . . . 0.0 112.042 173.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -67.31 -59.2 3.61 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.674 1.125 . . . . 0.0 110.923 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -54.78 -49.78 70.08 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.549 0.74 . . . . 0.0 110.496 173.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.284 0.1 OUTLIER -57.91 -23.72 54.61 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.45 177.139 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -75.72 -48.07 23.44 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.116 1.766 . . . . 0.0 112.453 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -76.26 -6.39 51.22 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.66 -0.65 . . . . 0.0 112.689 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 75.1 t -95.06 -29.14 4.05 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 126.988 2.115 . . . . 0.0 112.799 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p . . . . . 0 CA--C 1.519 -0.218 0 O-C-N 120.918 -1.114 . . . . 0.0 112.224 176.777 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.3 t80 . . . . . 0 C--O 1.22 -0.46 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.2 89.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.169 1.788 . . . . 0.0 112.099 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.5 t -67.88 -52.0 41.55 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.984 0.356 . . . . 0.0 111.244 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -36.46 73.53 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.708 -0.62 . . . . 0.0 112.02 176.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -28.51 36.95 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.277 1.831 . . . . 0.0 112.663 171.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -67.32 -62.06 1.61 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.785 1.175 . . . . 0.0 111.115 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.46 -48.34 74.67 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 123.131 0.572 . . . . 0.0 110.876 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.308 0.1 OUTLIER -57.08 -27.12 61.46 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 176.248 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.02 -60.42 2.51 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.471 1.508 . . . . 0.0 111.063 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.4 -19.24 65.75 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.634 0.774 . . . . 0.0 112.756 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 72.5 t -78.27 -40.29 25.26 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 126.354 1.862 . . . . 0.0 111.628 169.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p . . . . . 0 CA--C 1.513 -0.447 0 CA-C-O 118.066 -0.969 . . . . 0.0 112.945 176.921 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.99 -30.85 71.91 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.637 1.975 . . . . 0.0 112.129 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -43.42 62.91 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.231 0.612 . . . . 0.0 110.742 170.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.88 -33.72 76.68 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.266 -0.397 . . . . 0.0 112.011 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.2 tpm_? -48.2 -36.09 13.06 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.952 1.701 . . . . 0.0 111.803 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -64.1 -59.78 4.03 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.317 1.847 . . . . 0.0 112.174 177.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -55.4 -50.21 70.35 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.12 0.568 . . . . 0.0 110.513 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.264 0.0 OUTLIER -59.64 -18.69 43.79 Favored 'General case' 0 CA--C 1.556 1.198 0 O-C-N 121.583 -0.698 . . . . 0.0 112.4 175.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -77.75 -52.79 8.37 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.1 1.76 . . . . 0.0 112.743 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.96 -16.83 62.67 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.34 -0.85 . . . . 0.0 113.062 176.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.7 t -81.9 -39.65 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 126.433 1.893 . . . . 0.0 112.372 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 CA--C 1.512 -0.491 0 CA-C-O 117.524 -1.226 . . . . 0.0 111.388 176.654 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.2 t80 . . . . . 0 C--O 1.22 -0.454 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.54 -33.17 71.07 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.842 1.257 . . . . 0.0 112.628 173.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.54 -45.37 46.02 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.199 0.454 . . . . 0.0 111.229 173.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -28.96 69.83 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.81 0.844 . . . . 0.0 112.518 177.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -50.05 -37.27 32.53 Favored 'General case' 0 C--O 1.207 -1.168 0 C-N-CA 125.247 1.419 . . . . 0.0 111.471 171.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -61.39 -59.27 5.53 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.881 0.872 . . . . 0.0 111.816 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.43 -49.09 73.32 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 123.4 0.68 . . . . 0.0 111.08 174.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.269 0.0 OUTLIER -60.65 -17.38 47.01 Favored 'General case' 0 CA--C 1.563 1.463 0 O-C-N 121.177 -0.952 . . . . 0.0 112.906 175.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.14 -54.03 6.71 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.435 -2.041 . . . . 0.0 111.408 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 pp -71.12 -14.84 62.43 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 176.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.1 t -84.64 -38.44 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.482 1.513 . . . . 0.0 112.171 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 p . . . . . 0 CA--C 1.508 -0.64 0 CA-C-O 116.682 -1.628 . . . . 0.0 110.913 175.909 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 . . . . . 0 C--O 1.22 -0.464 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.37 -36.49 80.37 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.44 2.296 . . . . 0.0 112.491 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.4 t -68.08 -54.64 16.75 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.2 1.0 . . . . 0.0 110.89 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -34.44 75.26 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.971 0.508 . . . . 0.0 111.309 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -35.5 63.42 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 125.995 1.718 . . . . 0.0 112.166 171.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -61.0 -56.64 18.74 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.036 1.289 . . . . 0.0 111.758 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -56.2 -50.44 71.22 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 123.576 0.75 . . . . 0.0 110.347 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.279 0.1 OUTLIER -57.47 -23.01 47.34 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 119.065 -0.493 . . . . 0.0 112.218 176.028 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.66 -49.19 16.77 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.32 1.848 . . . . 0.0 112.5 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -75.46 -12.58 60.27 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.55 -35.31 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 126.017 1.727 . . . . 0.0 112.402 172.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 p . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.52 -1.228 . . . . 0.0 111.556 175.528 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--O 1.22 -0.456 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.94 -41.22 95.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.993 2.117 . . . . 0.0 112.125 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -47.43 67.85 Favored 'General case' 0 C--N 1.343 0.304 0 O-C-N 122.126 -0.359 . . . . 0.0 111.299 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.2 tp -60.48 -34.94 74.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.872 -0.518 . . . . 0.0 111.663 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -60.17 -17.5 41.34 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.087 2.155 . . . . 0.0 113.188 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -75.85 -59.02 2.94 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.316 0.962 . . . . 0.0 111.402 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.25 -49.15 76.96 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 122.886 0.474 . . . . 0.0 110.538 175.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.266 0.1 OUTLIER -58.92 -18.67 35.5 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 175.652 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.12 -57.04 4.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.694 -1.879 . . . . 0.0 111.722 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.57 -15.13 63.16 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -84.22 -37.48 12.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 C-N-CA 126.554 1.942 . . . . 0.0 112.265 170.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.87 -1.062 . . . . 0.0 111.339 177.3 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.222 -0.353 0 CA-C-O 119.479 -0.296 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -35.35 79.41 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.59 1.156 . . . . 0.0 112.487 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -48.82 27.68 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.346 0.521 . . . . 0.0 112.122 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.31 -33.11 73.05 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.555 0.616 . . . . 0.0 111.349 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -26.11 32.03 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 125.881 1.673 . . . . 0.0 113.153 169.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -68.97 -62.16 1.49 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 120.36 1.436 . . . . 0.0 111.706 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -55.8 -48.44 75.38 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.358 0.663 . . . . 0.0 110.629 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.287 0.1 OUTLIER -57.07 -27.05 61.37 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 176.343 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -68.53 -59.74 2.93 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.352 1.461 . . . . 0.0 111.003 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.89 -17.0 64.69 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.939 0.896 . . . . 0.0 113.048 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.1 t -81.77 -37.71 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 126.107 1.763 . . . . 0.0 111.962 169.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.8 p . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 117.726 -1.13 . . . . 0.0 112.302 175.609 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--O 1.223 -0.316 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.72 -33.65 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.407 1.883 . . . . 0.0 112.385 174.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.0 t -69.01 -50.36 49.53 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 122.548 0.339 . . . . 0.0 111.84 173.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.7 -32.07 73.15 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.012 0.369 . . . . 0.0 111.774 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -55.23 -31.35 61.42 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 125.815 1.646 . . . . 0.0 112.097 170.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.14 -59.82 4.73 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.886 1.221 . . . . 0.0 111.604 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -56.24 -49.46 74.09 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.71 0.804 . . . . 0.0 110.592 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.266 0.1 OUTLIER -56.93 -26.78 60.08 Favored 'General case' 0 CA--C 1.557 1.244 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 177.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -68.8 -55.23 11.87 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.924 1.689 . . . . 0.0 111.035 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.98 -16.66 61.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.0 t -75.26 -40.03 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 126.078 1.751 . . . . 0.0 112.144 172.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 CA--C 1.522 -0.133 0 C-N-CA 123.837 0.855 . . . . 0.0 111.964 177.932 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--O 1.219 -0.531 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.72 77.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.293 1.437 . . . . 0.0 113.282 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -55.05 17.55 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.332 0.653 . . . . 0.0 111.202 174.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.13 -33.9 75.35 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.588 0.355 . . . . 0.0 111.487 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -56.12 -34.12 65.78 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 126.212 1.805 . . . . 0.0 111.857 171.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -59.66 -60.3 4.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 120.19 1.359 . . . . 0.0 110.956 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -55.57 -49.03 73.79 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.365 0.666 . . . . 0.0 110.932 175.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.297 0.1 OUTLIER -56.11 -28.71 58.91 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.391 176.112 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.07 -58.76 3.96 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 125.681 1.592 . . . . 0.0 111.358 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.67 -17.69 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.838 0.855 . . . . 0.0 112.822 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 62.1 t -76.69 -41.17 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 C-N-CA 125.492 1.517 . . . . 0.0 111.501 168.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.5 p . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 179.44 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.217 -0.641 0 CA-C-O 118.726 -0.654 . . . . 0.0 110.62 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.09 -38.2 73.01 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.094 1.357 . . . . 0.0 112.421 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 t -65.19 -55.55 17.93 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.546 0.738 . . . . 0.0 111.245 175.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 tt -62.88 -31.25 72.26 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.928 -0.482 . . . . 0.0 111.503 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 39.2 ttt180 -61.41 -28.56 69.34 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 126.189 1.796 . . . . 0.0 111.766 172.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -63.6 -61.36 2.37 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 120.061 1.3 . . . . 0.0 111.009 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -53.81 -49.53 68.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.293 0.637 . . . . 0.0 110.989 174.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.92 -22.34 48.24 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 121.179 -0.95 . . . . 0.0 113.39 177.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.97 -52.58 12.37 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.357 1.863 . . . . 0.0 111.062 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -74.45 -12.02 60.39 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 177.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -83.16 -33.58 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 C-N-CA 125.536 1.535 . . . . 0.0 112.451 172.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.512 -0.488 0 C-N-CA 124.592 1.157 . . . . 0.0 111.806 178.523 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 N--CA 1.465 0.301 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.8 76.87 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.02 0.928 . . . . 0.0 112.66 177.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -45.78 54.23 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.929 0.892 . . . . 0.0 111.64 174.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.26 -34.19 76.05 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.9 1.28 . . . . 0.0 111.333 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -21.01 53.86 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 125.343 1.457 . . . . 0.0 112.711 170.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.74 -59.08 3.17 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.572 1.533 . . . . 0.0 111.146 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -55.9 -47.91 76.58 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.213 0.605 . . . . 0.0 111.048 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.279 0.1 OUTLIER -60.61 -18.66 54.49 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 175.819 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.76 -56.09 4.91 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 119.904 -1.748 . . . . 0.0 111.313 175.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.21 -11.75 61.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 177.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.8 t -86.96 -37.77 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.74 1.616 . . . . 0.0 112.539 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.234 0.281 0 CA-C-N 118.795 0.725 . . . . 0.0 111.915 175.142 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.1 t80 . . . . . 0 C--O 1.219 -0.544 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.72 -39.71 85.6 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.065 1.346 . . . . 0.0 112.569 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.0 -49.03 55.58 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.952 0.501 . . . . 0.0 111.356 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -63.22 -34.11 76.95 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.126 0.57 . . . . 0.0 111.497 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.33 -32.97 69.01 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.031 1.733 . . . . 0.0 111.625 172.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -59.37 -61.87 2.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 119.725 1.148 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -54.55 -48.99 71.35 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.273 0.629 . . . . 0.0 111.025 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.285 0.1 OUTLIER -56.33 -26.95 54.16 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.413 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -69.03 -60.0 2.65 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.425 1.89 . . . . 0.0 111.148 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.54 -14.53 63.02 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -84.38 -34.4 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 126.3 1.84 . . . . 0.0 112.092 170.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 CA--C 1.511 -0.538 0 CA-C-O 118.141 -0.933 . . . . 0.0 112.92 176.362 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--O 1.221 -0.431 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.18 -38.89 91.94 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.726 2.011 . . . . 0.0 111.705 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 t -68.06 -49.1 63.43 Favored 'General case' 0 C--N 1.346 0.45 0 O-C-N 122.046 -0.409 . . . . 0.0 110.622 172.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tt -61.62 -34.39 75.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.312 0.505 . . . . 0.0 112.095 177.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -29.75 53.52 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 126.126 1.771 . . . . 0.0 112.093 171.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -67.51 -59.83 3.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 120.112 1.324 . . . . 0.0 111.967 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -56.55 -48.83 76.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 110.853 175.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.301 0.1 OUTLIER -56.61 -26.11 54.83 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 118.547 -0.739 . . . . 0.0 112.691 175.735 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -54.75 9.51 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.996 1.718 . . . . 0.0 112.64 178.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -71.63 -14.55 62.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.837 0.855 . . . . 0.0 112.935 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.9 t -83.63 -38.51 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 126.1 1.76 . . . . 0.0 111.816 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.446 -0.664 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.173 175.579 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.222 -0.365 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.54 82.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.13 0.877 . . . . 0.0 112.835 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 t -71.59 -51.46 23.22 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 122.871 0.468 . . . . 0.0 111.398 175.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.73 -31.59 72.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.901 0.88 . . . . 0.0 111.938 178.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.33 -30.63 29.41 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 126.27 1.828 . . . . 0.0 111.84 169.108 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -64.92 -64.26 0.91 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.994 1.27 . . . . 0.0 110.986 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -54.0 -48.36 70.51 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.615 0.766 . . . . 0.0 110.969 176.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.283 0.1 OUTLIER -57.69 -27.4 62.87 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.329 177.044 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -68.42 -55.21 12.67 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.707 1.603 . . . . 0.0 111.345 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.36 -10.93 60.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 76.9 t -88.02 -35.6 8.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 125.823 1.649 . . . . 0.0 111.624 170.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.7 p . . . . . 0 N--CA 1.464 0.266 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 177.024 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 . . . . . 0 C--O 1.226 -0.156 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.01 92.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.782 0.833 . . . . 0.0 112.402 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -48.41 75.22 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.342 0.519 . . . . 0.0 111.641 174.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -34.02 77.06 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.614 0.765 . . . . 0.0 111.5 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.5 ttm-85 -56.4 -32.82 65.18 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 125.28 1.432 . . . . 0.0 112.495 168.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -59.33 -60.79 3.3 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.994 1.27 . . . . 0.0 111.11 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -54.57 -48.88 71.53 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.452 0.701 . . . . 0.0 111.102 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.276 0.1 OUTLIER -58.55 -21.89 54.04 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 176.201 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -74.98 -54.77 6.61 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.651 1.58 . . . . 0.0 112.179 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -68.44 -18.59 64.45 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.166 -0.959 . . . . 0.0 112.415 176.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.6 t -84.25 -28.26 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.2 1.8 . . . . 0.0 113.729 172.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.4 p . . . . . 0 CA--C 1.51 -0.595 0 CA-C-O 117.629 -1.176 . . . . 0.0 111.709 172.399 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 . . . . . 0 C--O 1.222 -0.381 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.14 -37.86 81.36 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.646 1.578 . . . . 0.0 112.623 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -69.9 -50.78 38.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.975 0.51 . . . . 0.0 111.423 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -36.6 77.07 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.334 0.516 . . . . 0.0 111.705 175.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -35.24 62.75 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.74 1.616 . . . . 0.0 111.778 171.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -59.8 -57.98 10.55 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 119.834 1.197 . . . . 0.0 111.825 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -56.66 -49.65 74.42 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.04 0.536 . . . . 0.0 110.579 174.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.293 0.1 OUTLIER -55.55 -27.97 52.09 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.2 176.946 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -68.93 -56.94 6.3 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 127.057 2.143 . . . . 0.0 112.242 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.63 -17.63 63.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.71 0.804 . . . . 0.0 112.37 178.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -78.49 -41.58 25.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 126.1 1.76 . . . . 0.0 111.444 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 p . . . . . 0 N--CA 1.466 0.356 0 C-N-CA 124.416 1.086 . . . . 0.0 113.27 178.378 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.67 64.01 4.75 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 124.552 3.501 . . . . 0.0 112.013 176.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.54 120.73 2.83 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 125.627 1.571 . . . . 0.0 110.541 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 mttp 162.04 -57.57 0.0 OUTLIER Pre-proline 0 N--CA 1.482 1.159 0 C-N-CA 129.384 3.073 . . . . 0.0 112.776 -172.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -75.86 72.0 5.33 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.875 2.384 . . . . 0.0 111.013 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -79.1 65.89 4.4 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.549 1.14 . . . . 0.0 111.365 177.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -160.0 155.43 22.01 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.063 0.945 . . . . 0.0 112.009 176.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -73.97 124.65 9.29 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.118 2.545 . . . . 0.0 111.279 175.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.63 -67.39 0.08 OUTLIER Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.998 1.285 . . . . 0.0 110.404 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -151.78 116.26 5.07 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.395 1.078 . . . . 0.0 111.355 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -118.57 88.15 2.87 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 126.913 2.085 . . . . 0.0 110.486 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -149.36 152.56 36.0 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 t -101.54 145.84 31.17 Favored Pre-proline 0 N--CA 1.473 0.724 0 C-N-CA 122.987 0.515 . . . . 0.0 110.345 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.73 -171.31 0.63 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.691 1.594 . . . . 0.0 111.191 174.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 79.84 102.24 0.06 Allowed 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.58 1.552 . . . . 0.0 108.609 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 75.18 -49.5 0.64 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.827 1.651 . . . . 0.0 112.415 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.22 -63.62 1.14 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.63 1.172 . . . . 0.0 110.486 174.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.34 -15.25 56.82 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.583 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -28.12 67.95 Favored 'General case' 0 C--O 1.215 -0.723 0 C-N-CA 124.705 1.202 . . . . 0.0 112.036 172.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -71.2 -52.89 16.58 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.221 0.608 . . . . 0.0 109.969 172.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -63.46 -48.37 78.0 Favored 'General case' 0 C--O 1.214 -0.811 0 C-N-CA 123.415 0.686 . . . . 0.0 111.532 -178.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.65 -43.21 99.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.666 1.187 . . . . 0.0 112.404 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -65.93 -51.01 62.35 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 124.166 0.986 . . . . 0.0 111.325 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.9 tp -60.94 -37.09 81.12 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.406 0.682 . . . . 0.0 111.077 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -58.6 -34.16 70.81 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 125.77 1.628 . . . . 0.0 111.831 173.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -58.48 -59.63 5.07 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.492 1.042 . . . . 0.0 111.068 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -55.27 -48.94 73.28 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.373 0.669 . . . . 0.0 111.092 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.272 0.1 OUTLIER -59.26 -20.34 53.42 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 175.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.79 -55.18 5.72 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.711 -1.868 . . . . 0.0 111.16 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.25 -17.76 64.38 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.4 t -83.08 -36.12 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.789 1.636 . . . . 0.0 112.937 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p -70.55 -46.83 62.81 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 117.821 -1.085 . . . . 0.0 110.823 175.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -44.55 -41.97 6.89 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.522 1.129 . . . . 0.0 113.708 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -47.53 -37.82 12.9 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.1 1.36 . . . . 0.0 113.151 175.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.18 67.08 1.33 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.323 1.849 . . . . 0.0 111.192 172.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -112.05 57.58 0.64 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 123.136 1.446 . . . . 0.0 109.905 175.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.648 0 O-C-N 118.825 -2.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.446 ' H3 ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 117.496 -1.24 . . . . 0.0 111.391 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.446 ' HD2' ' H3 ' ' A' ' 1' ' ' TYR . 40.2 Cg_endo -74.52 -176.51 2.8 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.072 1.848 . . . . 0.0 111.108 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.83 -25.67 65.18 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.23 1.012 . . . . 0.0 113.078 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.87 157.37 13.99 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 126.565 1.946 . . . . 0.0 110.878 174.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -75.23 -177.33 3.44 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 124.161 3.24 . . . . 0.0 112.484 174.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -107.7 76.68 1.08 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.109 1.364 . . . . 0.0 110.922 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -162.19 92.2 1.33 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.82 0.848 . . . . 0.0 110.002 172.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -70.48 164.15 36.27 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 121.32 1.347 . . . . 0.0 111.495 175.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 139.87 -123.35 2.43 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.04 1.305 . . . . 0.0 110.917 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -147.09 110.53 4.88 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.044 0.938 . . . . 0.0 111.305 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -129.83 84.39 2.21 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 124.88 1.272 . . . . 0.0 109.745 179.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.9 79.33 0.89 Allowed 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.159 -0.963 . . . . 0.0 111.423 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.4 t -100.28 141.89 23.59 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.945 1.298 . . . . 0.0 111.346 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -70.21 -179.02 2.81 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.237 2.625 . . . . 0.0 111.924 174.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 64.72 16.5 10.43 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.741 1.216 . . . . 0.0 113.406 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -157.6 -52.46 0.07 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.97 1.708 . . . . 0.0 110.689 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.91 -62.85 1.51 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 119.29 0.95 . . . . 0.0 111.422 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.8 t -66.87 -17.97 65.15 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.771 -0.58 . . . . 0.0 111.766 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.64 -36.75 77.0 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.355 1.462 . . . . 0.0 111.562 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -67.0 -48.39 68.59 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.472 0.709 . . . . 0.0 110.766 173.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -60.49 -47.54 85.68 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 124.218 1.007 . . . . 0.0 111.399 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.67 85.56 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.693 1.197 . . . . 0.0 112.303 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 t -71.92 -50.2 31.16 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 123.053 0.541 . . . . 0.0 111.325 174.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.3 tp -56.99 -37.9 72.31 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.934 0.893 . . . . 0.0 111.171 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -54.95 -36.46 65.34 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 125.772 1.629 . . . . 0.0 111.9 172.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -60.23 -55.57 32.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.171 1.351 . . . . 0.0 111.477 -178.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -57.01 -50.18 73.51 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.104 0.561 . . . . 0.0 110.643 174.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.277 0.1 OUTLIER -58.4 -21.1 49.37 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 175.511 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -76.2 -56.54 4.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.036 1.734 . . . . 0.0 110.982 176.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 pp -67.04 -19.35 65.67 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 176.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.0 t -82.48 -31.27 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.098 1.759 . . . . 0.0 112.908 173.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.1 p -79.71 -39.34 31.4 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.196 -0.94 . . . . 0.0 112.035 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -55.15 -39.85 69.93 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 118.499 0.591 . . . . 0.0 112.53 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -79.67 10.82 3.6 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.411 1.484 . . . . 0.0 114.116 174.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -127.3 -56.37 1.33 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.505 1.522 . . . . 0.0 111.165 -176.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -84.52 12.84 6.27 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.137 2.575 . . . . 0.0 112.903 177.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.593 0 O-C-N 118.846 -2.409 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 9.3 t80 . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.63 78.5 2.4 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.326 2.017 . . . . 0.0 109.281 176.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.64 160.08 5.94 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.54 170.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.59 84.25 0.18 Allowed Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.826 1.65 . . . . 0.0 110.774 -175.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -70.92 89.49 0.65 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.519 2.813 . . . . 0.0 111.056 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -114.96 153.99 29.57 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 126.352 1.861 . . . . 0.0 110.279 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.57 162.49 0.09 OUTLIER Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 125.979 1.711 . . . . 0.0 114.421 -170.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -76.96 84.63 1.9 Allowed 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.056 2.504 . . . . 0.0 111.487 177.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -168.71 48.48 0.22 Allowed Glycine 0 CA--C 1.529 0.923 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.696 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -69.79 41.2 0.05 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 126.119 1.768 . . . . 0.0 113.617 176.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -107.31 85.16 2.08 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 122.825 1.297 . . . . 0.0 110.736 -175.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.01 71.64 1.43 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.158 1.383 . . . . 0.0 109.881 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -113.34 83.82 6.99 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 124.493 1.117 . . . . 0.0 109.84 176.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -73.87 45.92 1.2 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.588 3.526 . . . . 0.0 112.757 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -83.51 3.97 29.99 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.837 2.055 . . . . 0.0 113.439 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -134.01 -45.37 0.79 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.743 1.217 . . . . 0.0 112.703 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.33 -60.96 2.42 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.704 0.802 . . . . 0.0 109.051 179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -17.96 62.17 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-O 117.754 -1.117 . . . . 0.0 110.858 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -58.09 -34.14 69.84 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 125.014 1.326 . . . . 0.0 112.117 172.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -68.1 -46.62 70.44 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.497 0.719 . . . . 0.0 110.957 174.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -45.76 64.43 Favored 'General case' 0 C--O 1.216 -0.688 0 C-N-CA 124.307 1.043 . . . . 0.0 111.64 -179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.12 -40.09 96.59 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.166 2.187 . . . . 0.0 112.379 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 t -69.87 -51.7 31.04 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 123.318 0.386 . . . . 0.0 110.881 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.49 -34.41 72.54 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.841 -0.537 . . . . 0.0 112.194 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -57.4 -31.67 66.07 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 125.62 1.568 . . . . 0.0 111.973 172.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -58.96 -60.07 4.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 120.317 1.417 . . . . 0.0 111.112 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -54.81 -49.18 71.64 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.362 0.665 . . . . 0.0 111.271 174.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.299 0.1 OUTLIER -57.18 -28.62 62.97 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 121.67 -0.643 . . . . 0.0 112.554 175.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -67.83 -60.1 2.78 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 126.142 1.777 . . . . 0.0 110.35 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.55 -11.82 58.93 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 118.472 -0.775 . . . . 0.0 113.024 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -84.85 -40.16 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.152 1.381 . . . . 0.0 111.66 171.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.3 p -61.48 -54.13 47.39 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 123.496 0.718 . . . . 0.0 111.281 175.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.68 30.02 0.37 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.409 1.084 . . . . 0.0 113.29 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.68 -45.84 1.75 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 125.542 1.537 . . . . 0.0 111.952 178.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -128.52 46.5 2.59 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 122.107 0.956 . . . . 0.0 112.095 -177.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -89.66 -55.04 3.8 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.662 1.185 . . . . 0.0 112.668 178.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 O-C-N 120.301 -1.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 119.259 -0.401 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -72.52 129.77 15.17 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.305 2.004 . . . . 0.0 110.842 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -68.61 97.18 0.77 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.181 1.392 . . . . 0.0 110.883 177.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.36 160.8 30.56 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 124.089 0.955 . . . . 0.0 111.523 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -74.34 131.79 15.56 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.449 2.1 . . . . 0.0 110.561 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -165.89 156.87 13.46 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.63 1.572 . . . . 0.0 108.987 173.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.55 164.26 0.1 OUTLIER Pre-proline 0 CA--C 1.556 1.188 0 C-N-CA 126.945 2.098 . . . . 0.0 113.053 -173.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -71.9 -176.86 2.26 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 121.897 1.731 . . . . 0.0 111.789 172.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -56.0 162.92 5.61 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 123.275 0.464 . . . . 0.0 112.979 172.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -159.1 128.47 5.49 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.835 0.854 . . . . 0.0 109.442 -177.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -91.64 90.85 7.75 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.716 1.206 . . . . 0.0 109.316 170.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -113.65 -179.1 3.54 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.726 1.211 . . . . 0.0 111.492 173.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.1 t -50.81 143.57 14.73 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.619 1.168 . . . . 0.0 111.905 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -72.67 71.38 3.27 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 123.733 2.955 . . . . 0.0 112.1 -176.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -124.42 18.37 8.94 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.752 1.621 . . . . 0.0 112.41 -175.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -164.7 -60.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.792 1.637 . . . . 0.0 109.925 175.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -64.37 0.85 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.237 1.015 . . . . 0.0 110.843 -178.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.14 -21.68 65.82 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.453 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.39 -29.95 69.27 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 125.549 1.54 . . . . 0.0 112.27 175.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -71.32 -52.26 19.79 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.902 1.281 . . . . 0.0 110.051 172.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -61.76 -44.3 97.15 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 124.846 1.258 . . . . 0.0 112.607 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.95 -28.04 69.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.714 1.206 . . . . 0.0 113.069 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.98 -47.02 19.49 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.873 0.869 . . . . 0.0 111.189 172.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.15 -32.22 73.71 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 0.0 112.539 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.15 -28.28 25.28 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.492 1.517 . . . . 0.0 112.325 169.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -68.07 -63.05 1.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.836 1.198 . . . . 0.0 111.242 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -54.42 -48.47 71.62 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.23 0.612 . . . . 0.0 110.752 176.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.291 0.1 OUTLIER -57.91 -23.94 55.58 Favored 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 176.411 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -74.32 -51.13 16.11 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.911 1.684 . . . . 0.0 112.11 175.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 -8.18 55.4 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -89.16 -38.85 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 126.14 1.776 . . . . 0.0 111.84 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p -69.91 -35.85 74.92 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.404 1.082 . . . . 0.0 113.823 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -24.24 2.93 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.822 1.249 . . . . 0.0 113.99 172.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -119.97 33.21 5.7 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.839 2.056 . . . . 0.0 110.536 179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -146.74 -54.5 0.24 Allowed 'General case' 0 C--N 1.343 0.304 0 C-N-CA 124.861 1.264 . . . . 0.0 112.348 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.84 27.44 0.75 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.072 2.149 . . . . 0.0 112.535 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.532 0 O-C-N 118.884 -2.385 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.433 ' H2 ' ' HD2' ' A' ' 2' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 116.803 -1.57 . . . . 0.0 111.783 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.433 ' HD2' ' H2 ' ' A' ' 1' ' ' TYR . 24.5 Cg_endo -68.44 176.55 5.58 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.458 2.106 . . . . 0.0 112.011 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.57 162.31 1.69 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.862 0.865 . . . . 0.0 111.557 170.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.41 157.23 31.61 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.482 0.713 . . . . 0.0 110.397 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -74.57 75.59 3.45 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 123.484 2.789 . . . . 0.0 110.517 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -70.01 113.71 7.48 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.696 0.798 . . . . 0.0 109.327 175.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.42 74.29 8.22 Favored Pre-proline 0 C--O 1.244 0.787 0 C-N-CA 124.693 1.197 . . . . 0.0 109.876 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.81 126.71 15.77 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.896 2.398 . . . . 0.0 109.314 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.5 -93.11 0.07 OUTLIER Glycine 0 CA--C 1.53 0.989 0 C-N-CA 123.731 0.681 . . . . 0.0 112.366 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -157.09 111.64 2.73 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.573 0.749 . . . . 0.0 110.458 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.95 96.59 4.8 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.53 1.532 . . . . 0.0 109.034 -178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -157.92 78.46 0.83 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.376 1.07 . . . . 0.0 109.351 178.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 t -64.69 146.37 98.44 Favored Pre-proline 0 CA--C 1.547 0.86 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.34 178.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -76.78 125.46 8.15 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 122.561 2.174 . . . . 0.0 111.038 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -171.17 95.12 0.18 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.82 2.048 . . . . 0.0 106.906 -176.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 75.47 -44.88 0.53 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.756 0.823 . . . . 0.0 112.212 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.52 -55.78 17.07 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.534 1.534 . . . . 0.0 109.85 174.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.5 p -57.61 -32.53 67.3 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.286 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -20.31 64.18 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.853 1.261 . . . . 0.0 112.785 175.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -82.29 -49.1 10.43 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.097 1.359 . . . . 0.0 108.736 174.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -70.28 -45.19 66.84 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 123.942 0.897 . . . . 0.0 112.335 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.85 -37.1 85.51 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.164 1.786 . . . . 0.0 111.445 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t -72.82 -48.28 39.26 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 124.001 0.92 . . . . 0.0 111.041 174.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.84 -32.06 73.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.191 0.596 . . . . 0.0 111.297 177.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -24.79 67.9 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.333 1.853 . . . . 0.0 112.042 173.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -67.31 -59.2 3.61 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.674 1.125 . . . . 0.0 110.923 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -54.78 -49.78 70.08 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.549 0.74 . . . . 0.0 110.496 173.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.284 0.1 OUTLIER -57.91 -23.72 54.61 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.45 177.139 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -75.72 -48.07 23.44 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.116 1.766 . . . . 0.0 112.453 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -76.26 -6.39 51.22 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.66 -0.65 . . . . 0.0 112.689 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 75.1 t -95.06 -29.14 4.05 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 126.988 2.115 . . . . 0.0 112.799 172.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -76.03 -38.22 57.47 Favored 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 120.918 -1.114 . . . . 0.0 112.224 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.13 -23.43 1.25 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 175.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -62.28 -64.54 0.9 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.644 1.578 . . . . 0.0 110.446 174.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.49 -30.05 67.83 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.18 0.592 . . . . 0.0 112.501 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -104.28 40.53 1.45 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.397 2.279 . . . . 0.0 110.534 -174.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.594 0 O-C-N 120.409 -1.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 N--CA 1.476 0.842 0 CA-C-O 117.464 -1.255 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.93 58.01 4.7 Favored 'Trans proline' 0 CA--C 1.547 1.157 0 C-N-CA 122.752 2.301 . . . . 0.0 111.731 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.69 139.58 48.18 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.934 1.694 . . . . 0.0 109.691 177.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -60.75 -53.88 59.98 Favored Pre-proline 0 CA--C 1.542 0.646 0 CA-C-O 118.093 -0.956 . . . . 0.0 112.466 171.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -77.44 88.25 1.43 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.982 2.455 . . . . 0.0 111.074 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -161.7 104.68 1.21 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.742 0.817 . . . . 0.0 109.459 175.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.37 161.63 37.89 Favored Pre-proline 0 CA--C 1.54 0.559 0 O-C-N 121.11 -0.994 . . . . 0.0 110.744 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -78.8 173.56 13.43 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.456 2.771 . . . . 0.0 112.244 172.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.4 -144.95 16.08 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.431 1.015 . . . . 0.0 110.789 -173.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 44.5 72.09 0.22 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.427 1.891 . . . . 0.0 113.178 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.6 t0 46.2 63.82 1.72 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.094 0.958 . . . . 0.0 111.447 -177.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.87 167.84 7.09 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.938 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.05 156.51 3.55 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 124.42 1.088 . . . . 0.0 112.102 176.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.53 -170.0 0.35 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.463 2.775 . . . . 0.0 111.132 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 78.78 89.04 0.06 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.585 1.954 . . . . 0.0 109.645 -177.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 54.8 35.94 25.3 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.32 -65.07 0.63 Allowed 'General case' 0 C--N 1.348 0.512 0 O-C-N 120.208 -1.558 . . . . 0.0 110.574 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.94 -22.99 67.17 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 117.924 -1.036 . . . . 0.0 110.043 -177.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -32.82 70.48 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 125.273 1.429 . . . . 0.0 112.183 176.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -66.98 -45.58 77.24 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.5 0.72 . . . . 0.0 110.682 172.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -71.5 -47.74 53.43 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 124.7 1.2 . . . . 0.0 112.664 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.2 89.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.169 1.788 . . . . 0.0 112.099 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.5 t -67.88 -52.0 41.55 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.984 0.356 . . . . 0.0 111.244 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -36.46 73.53 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.708 -0.62 . . . . 0.0 112.02 176.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.89 -28.51 36.95 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.277 1.831 . . . . 0.0 112.663 171.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -67.32 -62.06 1.61 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.785 1.175 . . . . 0.0 111.115 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.46 -48.34 74.67 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 123.131 0.572 . . . . 0.0 110.876 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.308 0.1 OUTLIER -57.08 -27.12 61.46 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 176.248 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.02 -60.42 2.51 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.471 1.508 . . . . 0.0 111.063 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.4 -19.24 65.75 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.634 0.774 . . . . 0.0 112.756 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 72.5 t -78.27 -40.29 25.26 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 126.354 1.862 . . . . 0.0 111.628 169.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p -65.95 -44.68 84.32 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 118.066 -0.969 . . . . 0.0 112.945 176.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.3 mtp85 -44.23 -39.38 4.39 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.271 1.428 . . . . 0.0 113.478 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.6 mm-40 -52.87 -43.2 65.93 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.479 1.112 . . . . 0.0 113.363 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.25 53.41 2.0 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.242 1.417 . . . . 0.0 112.131 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -92.87 -51.52 5.04 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.039 1.336 . . . . 0.0 110.801 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 O-C-N 118.701 -2.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.478 ' H2 ' ' HD3' ' A' ' 2' ' ' PRO . 0.1 OUTLIER . . . . . 0 CA--C 1.549 0.927 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.478 ' HD3' ' H2 ' ' A' ' 1' ' ' TYR . 37.1 Cg_endo -69.89 151.07 68.21 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 120.979 1.119 . . . . 0.0 111.134 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.84 78.42 1.74 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.656 1.182 . . . . 0.0 109.686 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.99 153.58 81.03 Favored Pre-proline 0 N--CA 1.468 0.471 0 C-N-CA 124.231 1.013 . . . . 0.0 110.42 -178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -69.26 173.76 10.06 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.72 2.28 . . . . 0.0 111.439 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.08 111.83 0.54 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.112 0.965 . . . . 0.0 112.495 176.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.28 149.91 36.49 Favored Pre-proline 0 CA--C 1.539 0.551 0 O-C-N 121.528 -0.733 . . . . 0.0 110.679 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -70.92 165.12 33.31 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.517 2.145 . . . . 0.0 111.423 175.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.79 155.43 16.82 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.222 0.915 . . . . 0.0 111.666 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -164.28 76.62 0.34 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.49 0.716 . . . . 0.0 111.152 -178.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.4 t0 48.5 82.98 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.414 1.485 . . . . 0.0 113.903 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -146.41 143.83 29.3 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.397 -0.814 . . . . 0.0 110.693 177.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.5 146.69 72.0 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.777 0.831 . . . . 0.0 111.198 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -72.87 118.67 5.67 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.61 2.207 . . . . 0.0 111.863 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -130.11 72.07 1.47 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.632 1.973 . . . . 0.0 108.936 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 67.18 -4.51 0.83 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.238 1.415 . . . . 0.0 113.316 -178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -60.31 3.99 Favored 'General case' 0 C--N 1.343 0.294 0 O-C-N 120.416 -1.428 . . . . 0.0 110.343 174.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.84 -18.98 62.02 Favored 'General case' 0 C--O 1.217 -0.639 0 O-C-N 122.08 -0.388 . . . . 0.0 110.836 -179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -24.16 65.07 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.438 1.095 . . . . 0.0 112.743 173.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -76.32 -47.76 22.42 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.415 1.086 . . . . 0.0 110.506 172.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -72.41 -46.76 53.73 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.478 1.111 . . . . 0.0 112.167 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.99 -30.85 71.91 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.637 1.975 . . . . 0.0 112.129 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -43.42 62.91 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.231 0.612 . . . . 0.0 110.742 170.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.88 -33.72 76.68 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.266 -0.397 . . . . 0.0 112.011 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 6.2 tpm_? -48.2 -36.09 13.06 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.952 1.701 . . . . 0.0 111.803 176.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -64.1 -59.78 4.03 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.317 1.847 . . . . 0.0 112.174 177.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -55.4 -50.21 70.35 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.12 0.568 . . . . 0.0 110.513 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.264 0.0 OUTLIER -59.64 -18.69 43.79 Favored 'General case' 0 CA--C 1.556 1.198 0 O-C-N 121.583 -0.698 . . . . 0.0 112.4 175.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -77.75 -52.79 8.37 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.1 1.76 . . . . 0.0 112.743 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.96 -16.83 62.67 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.34 -0.85 . . . . 0.0 113.062 176.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.7 t -81.9 -39.65 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 126.433 1.893 . . . . 0.0 112.372 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.0 p -68.66 -43.08 76.96 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 117.524 -1.226 . . . . 0.0 111.388 176.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.2 ttt-85 -45.36 -44.97 12.22 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.453 1.101 . . . . 0.0 112.231 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -50.95 -43.97 60.42 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.713 1.605 . . . . 0.0 112.462 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.36 47.45 2.19 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.471 1.908 . . . . 0.0 111.98 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -88.65 50.36 1.95 Allowed 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 123.74 1.733 . . . . 0.0 111.361 -178.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.435 0 O-C-N 118.741 -2.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 . . . . . 0 N--CA 1.475 0.805 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -73.96 168.62 24.35 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 121.855 1.703 . . . . 0.0 110.943 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -144.03 140.02 29.31 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.098 1.759 . . . . 0.0 106.798 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -51.51 79.22 Favored Pre-proline 0 N--CA 1.47 0.538 0 CA-C-O 117.419 -1.277 . . . . 0.0 112.9 169.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -75.99 167.17 26.62 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.563 2.175 . . . . 0.0 110.813 172.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 60.18 178.74 0.09 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.534 1.534 . . . . 0.0 112.331 -171.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 55.06 74.73 0.69 Allowed Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 124.403 1.081 . . . . 0.0 112.313 -178.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.14 173.62 10.15 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.617 2.212 . . . . 0.0 112.233 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.59 82.58 0.09 OUTLIER Glycine 0 C--N 1.34 0.78 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.179 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.19 32.04 0.08 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.136 1.375 . . . . 0.0 114.132 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.08 80.4 9.19 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.905 1.682 . . . . 0.0 109.976 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.86 59.1 3.05 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.186 -0.946 . . . . 0.0 111.33 174.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.49 84.95 61.25 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 124.456 1.103 . . . . 0.0 110.377 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -73.62 54.69 3.02 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 124.415 3.41 . . . . 0.0 112.3 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -128.4 8.97 6.03 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.346 1.458 . . . . 0.0 111.81 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -154.25 -39.5 0.09 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.527 1.131 . . . . 0.0 112.225 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.8 -62.0 2.03 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 119.242 0.928 . . . . 0.0 110.395 173.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.07 -18.9 50.13 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -177.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -32.7 68.83 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 126.19 1.796 . . . . 0.0 112.186 173.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -70.4 -48.54 55.65 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.981 1.312 . . . . 0.0 109.472 174.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -63.26 -46.64 85.92 Favored 'General case' 0 C--O 1.22 -0.454 0 C-N-CA 124.936 1.294 . . . . 0.0 112.181 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.54 -33.17 71.07 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.842 1.257 . . . . 0.0 112.628 173.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.54 -45.37 46.02 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.199 0.454 . . . . 0.0 111.229 173.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.07 -28.96 69.83 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.81 0.844 . . . . 0.0 112.518 177.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -50.05 -37.27 32.53 Favored 'General case' 0 C--O 1.207 -1.168 0 C-N-CA 125.247 1.419 . . . . 0.0 111.471 171.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -61.39 -59.27 5.53 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.881 0.872 . . . . 0.0 111.816 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.43 -49.09 73.32 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 123.4 0.68 . . . . 0.0 111.08 174.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.269 0.0 OUTLIER -60.65 -17.38 47.01 Favored 'General case' 0 CA--C 1.563 1.463 0 O-C-N 121.177 -0.952 . . . . 0.0 112.906 175.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.14 -54.03 6.71 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.435 -2.041 . . . . 0.0 111.408 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 pp -71.12 -14.84 62.43 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 176.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.1 t -84.64 -38.44 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.482 1.513 . . . . 0.0 112.171 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 p -67.25 -47.96 69.19 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 116.682 -1.628 . . . . 0.0 110.913 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -40.12 -47.06 2.3 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 120.22 1.373 . . . . 0.0 113.348 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.6 tm0? -49.63 -44.39 47.44 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.855 1.662 . . . . 0.0 112.551 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.7 mmm180 -135.23 54.55 1.93 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.148 1.779 . . . . 0.0 111.676 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -85.31 -51.55 6.5 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 122.171 0.986 . . . . 0.0 110.378 -177.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.591 0 O-C-N 120.059 -1.65 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 119.406 -0.331 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.62 0.81 8.72 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.091 2.527 . . . . 0.0 114.486 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.85 -93.01 0.07 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.704 1.601 . . . . 0.0 111.133 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.8 mttt -126.31 162.77 44.29 Favored Pre-proline 0 N--CA 1.468 0.467 0 C-N-CA 125.577 1.551 . . . . 0.0 110.805 178.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -69.72 152.89 69.61 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.316 2.011 . . . . 0.0 110.659 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -67.85 162.58 23.78 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.489 0.662 . . . . 0.0 110.785 175.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -116.11 86.69 17.51 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 124.48 1.112 . . . . 0.0 109.23 178.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -69.78 158.32 57.32 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.095 1.863 . . . . 0.0 111.094 177.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.8 176.16 46.38 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.094 173.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -158.05 131.9 7.91 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.869 0.867 . . . . 0.0 108.973 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -126.24 93.65 3.87 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.2 1.4 . . . . 0.0 109.09 178.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.48 163.34 33.0 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.287 0.635 . . . . 0.0 109.867 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 40.3 t -56.44 145.65 57.8 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 123.914 0.886 . . . . 0.0 111.231 175.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.77 69.2 3.69 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.004 3.136 . . . . 0.0 112.183 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -121.85 10.47 10.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.253 1.421 . . . . 0.0 112.493 -177.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -168.36 -52.27 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.036 1.734 . . . . 0.0 111.039 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -63.17 1.4 Allowed 'General case' 0 C--N 1.344 0.338 0 CA-C-N 119.211 0.914 . . . . 0.0 110.137 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.5 t -63.33 -17.82 62.97 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 121.799 -0.563 . . . . 0.0 110.915 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -26.36 67.25 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.814 1.246 . . . . 0.0 112.59 172.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -75.35 -49.25 19.69 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.019 0.928 . . . . 0.0 109.77 172.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -66.4 -50.43 63.48 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 125.005 1.322 . . . . 0.0 112.009 -178.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.37 -36.49 80.37 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.44 2.296 . . . . 0.0 112.491 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.4 t -68.08 -54.64 16.75 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.2 1.0 . . . . 0.0 110.89 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -34.44 75.26 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.971 0.508 . . . . 0.0 111.309 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -35.5 63.42 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 125.995 1.718 . . . . 0.0 112.166 171.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -61.0 -56.64 18.74 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.036 1.289 . . . . 0.0 111.758 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -56.2 -50.44 71.22 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 123.576 0.75 . . . . 0.0 110.347 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.279 0.1 OUTLIER -57.47 -23.01 47.34 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 119.065 -0.493 . . . . 0.0 112.218 176.028 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.66 -49.19 16.77 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.32 1.848 . . . . 0.0 112.5 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -75.46 -12.58 60.27 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.55 -35.31 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 126.017 1.727 . . . . 0.0 112.402 172.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 p -69.23 -44.96 70.95 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-O 117.52 -1.228 . . . . 0.0 111.556 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -44.1 -41.48 5.62 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.312 1.445 . . . . 0.0 114.213 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -50.7 -32.59 19.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.49 1.516 . . . . 0.0 112.97 174.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -154.73 67.87 0.7 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.338 2.255 . . . . 0.0 111.513 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -107.71 50.53 0.77 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 122.982 1.373 . . . . 0.0 111.993 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.606 0 O-C-N 119.261 -2.15 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 118.374 -0.822 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -71.89 -166.67 0.27 Allowed 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.122 2.548 . . . . 0.0 111.697 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -39.62 119.69 1.0 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.353 1.461 . . . . 0.0 111.613 175.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -51.91 77.74 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-O 117.632 -1.175 . . . . 0.0 112.194 175.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -76.23 59.92 6.15 Favored 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.291 2.661 . . . . 0.0 111.947 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -151.88 40.84 0.65 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.542 1.537 . . . . 0.0 111.302 177.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -127.86 76.2 77.59 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.402 1.081 . . . . 0.0 109.817 174.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -74.52 165.17 32.28 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.503 2.135 . . . . 0.0 111.453 174.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.21 -176.23 39.62 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.861 1.22 . . . . 0.0 110.882 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -74.31 36.99 0.1 Allowed 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -83.68 82.4 8.33 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.328 1.451 . . . . 0.0 110.34 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.53 112.5 13.14 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 121.593 -0.692 . . . . 0.0 110.239 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 t -124.44 143.59 43.54 Favored Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 123.791 0.836 . . . . 0.0 110.836 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -69.38 178.18 4.59 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.758 2.305 . . . . 0.0 111.647 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 63.82 23.5 13.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.019 1.328 . . . . 0.0 114.265 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -167.43 -53.11 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.338 1.855 . . . . 0.0 110.381 -176.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.69 -65.49 0.68 Allowed 'General case' 0 C--N 1.346 0.432 0 CA-C-N 119.527 1.058 . . . . 0.0 110.52 177.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.79 -16.83 63.57 Favored 'General case' 0 C--O 1.218 -0.557 0 O-C-N 121.876 -0.515 . . . . 0.0 110.539 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -27.7 66.99 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.121 1.368 . . . . 0.0 112.059 173.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -72.05 -49.26 38.18 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.157 0.983 . . . . 0.0 110.633 173.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -72.33 -44.19 63.03 Favored 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 124.576 1.15 . . . . 0.0 112.351 -177.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.94 -41.22 95.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.993 2.117 . . . . 0.0 112.125 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -47.43 67.85 Favored 'General case' 0 C--N 1.343 0.304 0 O-C-N 122.126 -0.359 . . . . 0.0 111.299 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.2 tp -60.48 -34.94 74.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.872 -0.518 . . . . 0.0 111.663 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -60.17 -17.5 41.34 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.087 2.155 . . . . 0.0 113.188 173.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -75.85 -59.02 2.94 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.316 0.962 . . . . 0.0 111.402 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.25 -49.15 76.96 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 122.886 0.474 . . . . 0.0 110.538 175.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.266 0.1 OUTLIER -58.92 -18.67 35.5 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 175.652 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.12 -57.04 4.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.694 -1.879 . . . . 0.0 111.722 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.57 -15.13 63.16 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -84.22 -37.48 12.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 C-N-CA 126.554 1.942 . . . . 0.0 112.265 170.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 p -71.05 -41.4 70.81 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 117.87 -1.062 . . . . 0.0 111.339 177.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.62 -45.43 6.79 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 119.644 1.111 . . . . 0.0 113.8 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -47.55 -42.27 23.13 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.771 1.628 . . . . 0.0 112.908 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -136.47 54.53 1.88 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.759 1.623 . . . . 0.0 111.682 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -76.24 -50.28 14.88 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.08 0.943 . . . . 0.0 111.195 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.527 0 O-C-N 119.93 -1.731 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 117.972 -1.013 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -69.56 141.67 46.67 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.397 2.065 . . . . 0.0 110.942 175.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.89 -21.5 15.68 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 118.033 -0.984 . . . . 0.0 113.029 175.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -36.95 94.65 0.08 OUTLIER Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 128.466 2.706 . . . . 0.0 112.504 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -76.3 102.87 1.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 122.432 2.088 . . . . 0.0 111.074 -171.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -82.32 66.8 8.08 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.588 0.755 . . . . 0.0 111.085 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -160.28 82.7 2.18 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 123.349 0.66 . . . . 0.0 110.635 175.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -72.57 143.31 37.9 Favored 'Trans proline' 0 C--O 1.24 0.615 0 C-N-CA 122.451 2.101 . . . . 0.0 111.628 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.19 -106.68 3.01 Favored Glycine 0 C--O 1.22 -0.734 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -175.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -170.1 145.63 2.87 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.01 1.324 . . . . 0.0 108.035 175.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -109.96 -151.24 0.47 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.672 1.589 . . . . 0.0 108.604 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 85.92 47.33 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.944 2.898 . . . . 0.0 111.27 175.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.87 149.74 57.17 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 123.733 0.813 . . . . 0.0 111.836 -176.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -72.03 -171.52 0.7 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.664 2.909 . . . . 0.0 111.725 176.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 62.49 19.1 10.95 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.051 1.34 . . . . 0.0 113.605 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -168.05 -52.33 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 127.003 2.121 . . . . 0.0 110.662 -174.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.69 -62.42 1.88 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.696 1.134 . . . . 0.0 111.334 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -14.65 52.74 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.286 -0.884 . . . . 0.0 112.54 178.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -33.61 74.22 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.101 1.36 . . . . 0.0 111.71 173.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -67.59 -47.11 70.69 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.126 0.971 . . . . 0.0 110.476 173.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -62.38 -48.51 79.43 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.379 1.072 . . . . 0.0 110.939 178.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -35.35 79.41 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.59 1.156 . . . . 0.0 112.487 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -48.82 27.68 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.346 0.521 . . . . 0.0 112.122 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.31 -33.11 73.05 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.555 0.616 . . . . 0.0 111.349 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.74 -26.11 32.03 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 125.881 1.673 . . . . 0.0 113.153 169.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -68.97 -62.16 1.49 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 120.36 1.436 . . . . 0.0 111.706 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -55.8 -48.44 75.38 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.358 0.663 . . . . 0.0 110.629 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.287 0.1 OUTLIER -57.07 -27.05 61.37 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 176.343 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -68.53 -59.74 2.93 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.352 1.461 . . . . 0.0 111.003 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.89 -17.0 64.69 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.939 0.896 . . . . 0.0 113.048 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.1 t -81.77 -37.71 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 126.107 1.763 . . . . 0.0 111.962 169.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.8 p -66.75 -45.04 79.85 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 117.726 -1.13 . . . . 0.0 112.302 175.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 10.6 mtp180 -44.18 -39.79 4.6 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 125.078 1.351 . . . . 0.0 113.131 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.34 -38.16 27.15 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.09 1.756 . . . . 0.0 113.031 175.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -136.26 56.72 1.8 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.605 1.962 . . . . 0.0 111.299 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -109.74 54.2 0.67 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 123.198 1.475 . . . . 0.0 111.985 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.604 0 O-C-N 119.715 -1.866 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.2 62.14 5.96 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 124.15 3.234 . . . . 0.0 110.99 174.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.11 168.05 20.54 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.538 1.535 . . . . 0.0 109.824 175.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.0 ptpp? -55.89 151.42 24.18 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 123.919 0.887 . . . . 0.0 111.492 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -72.51 90.3 0.81 Allowed 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 123.171 2.581 . . . . 0.0 111.206 -178.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.01 82.64 2.77 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.978 1.311 . . . . 0.0 109.014 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -134.51 154.84 79.93 Favored Pre-proline 0 C--O 1.234 0.267 0 C-N-CA 123.987 0.915 . . . . 0.0 110.943 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -77.28 156.16 33.03 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.684 2.256 . . . . 0.0 112.041 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 70.5 156.73 1.89 Allowed Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.542 1.068 . . . . 0.0 112.847 -172.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -170.48 134.13 1.1 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.807 0.843 . . . . 0.0 109.914 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -129.69 73.8 1.55 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.659 1.184 . . . . 0.0 111.1 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.6 173.06 13.56 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.443 -0.786 . . . . 0.0 111.257 179.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.9 t -56.0 147.24 45.28 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 124.005 0.922 . . . . 0.0 111.091 173.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -72.63 54.67 2.51 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 124.383 3.389 . . . . 0.0 112.968 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -97.55 9.7 41.77 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.506 1.922 . . . . 0.0 113.237 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -163.4 -44.18 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.746 1.618 . . . . 0.0 111.473 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.04 -64.63 0.88 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.2 1.0 . . . . 0.0 110.956 176.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.77 -15.13 52.14 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-O 118.0 -1.0 . . . . 0.0 111.814 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -32.64 71.46 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.582 1.153 . . . . 0.0 112.136 171.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -70.01 -49.5 50.81 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.358 1.063 . . . . 0.0 110.161 175.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -66.87 -46.36 75.22 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.299 1.039 . . . . 0.0 112.144 -179.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.72 -33.65 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.407 1.883 . . . . 0.0 112.385 174.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.0 t -69.01 -50.36 49.53 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 122.548 0.339 . . . . 0.0 111.84 173.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.7 -32.07 73.15 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.012 0.369 . . . . 0.0 111.774 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -55.23 -31.35 61.42 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 125.815 1.646 . . . . 0.0 112.097 170.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.14 -59.82 4.73 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.886 1.221 . . . . 0.0 111.604 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -56.24 -49.46 74.09 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.71 0.804 . . . . 0.0 110.592 175.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.266 0.1 OUTLIER -56.93 -26.78 60.08 Favored 'General case' 0 CA--C 1.557 1.244 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 177.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -68.8 -55.23 11.87 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.924 1.689 . . . . 0.0 111.035 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.98 -16.66 61.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.0 t -75.26 -40.03 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 126.078 1.751 . . . . 0.0 112.144 172.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p -82.23 -40.91 20.98 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 123.837 0.855 . . . . 0.0 111.964 177.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 10.1 mtt180 -47.75 -36.07 10.91 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.337 1.455 . . . . 0.0 113.397 178.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -35.03 11.96 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.816 1.246 . . . . 0.0 113.398 174.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.6 mmm180 -124.46 45.07 2.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.348 1.859 . . . . 0.0 111.421 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -136.4 36.58 2.72 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 122.848 1.309 . . . . 0.0 112.293 -178.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.575 0 O-C-N 118.867 -2.395 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 116.817 -1.563 . . . . 0.0 111.911 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.92 67.72 5.81 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 123.656 2.904 . . . . 0.0 111.44 -178.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.62 23.38 10.82 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.84 2.056 . . . . 0.0 110.715 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.83 156.75 79.09 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 125.508 1.523 . . . . 0.0 111.098 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.86 49.19 1.83 Allowed 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 124.649 3.566 . . . . 0.0 113.275 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -165.04 109.43 0.89 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.211 1.404 . . . . 0.0 109.677 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.58 154.81 63.62 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.036 0.935 . . . . 0.0 110.999 176.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -76.59 160.96 34.56 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.315 2.677 . . . . 0.0 112.51 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.42 151.06 2.24 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.121 1.344 . . . . 0.0 112.726 -172.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -76.24 67.54 2.52 Favored 'General case' 0 CA--C 1.549 0.937 0 O-C-N 121.385 -1.068 . . . . 0.0 111.204 174.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -110.04 83.03 1.69 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.197 1.399 . . . . 0.0 111.239 -177.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.59 83.09 2.11 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.449 1.1 . . . . 0.0 110.156 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.86 151.06 16.56 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 124.63 1.172 . . . . 0.0 112.114 177.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -73.13 98.77 1.04 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.986 2.457 . . . . 0.0 110.576 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -141.11 77.45 1.6 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 126.014 1.726 . . . . 0.0 109.099 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.9 11.48 6.04 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.463 1.105 . . . . 0.0 112.501 -179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.74 -63.34 1.28 Allowed 'General case' 0 C--N 1.347 0.476 0 C-N-CA 126.09 1.756 . . . . 0.0 110.837 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.51 -16.36 63.59 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 118.548 -0.739 . . . . 0.0 111.688 -177.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -26.91 68.59 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 125.84 1.656 . . . . 0.0 112.197 171.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -73.73 -50.19 21.96 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.175 0.99 . . . . 0.0 109.663 172.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.94 -48.18 81.56 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 124.422 1.089 . . . . 0.0 111.613 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.72 77.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.293 1.437 . . . . 0.0 113.282 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -55.05 17.55 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.332 0.653 . . . . 0.0 111.202 174.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.13 -33.9 75.35 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.588 0.355 . . . . 0.0 111.487 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.9 tmm_? -56.12 -34.12 65.78 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 126.212 1.805 . . . . 0.0 111.857 171.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -59.66 -60.3 4.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 120.19 1.359 . . . . 0.0 110.956 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -55.57 -49.03 73.79 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.365 0.666 . . . . 0.0 110.932 175.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.297 0.1 OUTLIER -56.11 -28.71 58.91 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.391 176.112 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.07 -58.76 3.96 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 125.681 1.592 . . . . 0.0 111.358 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.67 -17.69 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.838 0.855 . . . . 0.0 112.822 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 62.1 t -76.69 -41.17 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 C-N-CA 125.492 1.517 . . . . 0.0 111.501 168.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.5 p -71.85 -37.69 70.21 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -48.76 -33.98 11.34 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.799 1.24 . . . . 0.0 113.44 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -111.45 19.58 18.06 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.133 1.773 . . . . 0.0 111.966 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.87 85.04 0.1 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.713 1.605 . . . . 0.0 111.781 -176.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -155.4 -50.48 0.08 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.71 0.767 . . . . 0.0 112.385 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.467 0 O-C-N 119.358 -2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.422 ' H3 ' ' HD2' ' A' ' 2' ' ' PRO . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 117.646 -1.169 . . . . 0.0 112.016 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.422 ' HD2' ' H3 ' ' A' ' 1' ' ' TYR . 31.0 Cg_endo -72.02 0.52 7.09 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.636 2.891 . . . . 0.0 114.05 -179.22 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.32 147.34 37.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.985 2.514 . . . . 0.0 108.558 177.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.7 mtpt -72.31 -56.04 4.44 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 125.005 1.322 . . . . 0.0 112.422 170.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -72.77 99.35 1.06 Allowed 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.3 2.0 . . . . 0.0 109.572 176.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -84.18 168.62 15.6 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 123.88 0.872 . . . . 0.0 110.748 172.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 64.37 169.09 0.1 Allowed Pre-proline 0 CA--C 1.552 1.047 0 C-N-CA 125.348 1.459 . . . . 0.0 111.797 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -70.08 169.88 18.28 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 121.226 1.284 . . . . 0.0 111.072 172.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.82 -164.23 1.34 Allowed Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.068 0.842 . . . . 0.0 112.407 172.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.85 120.16 8.4 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.74 -0.859 . . . . 0.0 111.319 -178.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -107.15 86.79 2.37 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.775 1.63 . . . . 0.0 110.12 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.19 139.13 20.97 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 121.53 -0.731 . . . . 0.0 109.296 177.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t 39.22 83.25 0.21 Allowed Pre-proline 0 N--CA 1.468 0.442 0 C-N-CA 126.419 1.887 . . . . 0.0 111.774 -176.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -72.15 63.42 3.42 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.704 2.936 . . . . 0.0 111.906 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -86.7 18.87 3.15 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.551 1.94 . . . . 0.0 113.096 -178.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -166.3 -45.15 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.451 1.5 . . . . 0.0 110.495 -175.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.93 -64.99 0.66 Allowed 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.082 0.953 . . . . 0.0 110.669 176.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.59 -20.3 65.54 Favored 'General case' 0 N--CA 1.462 0.155 0 O-C-N 121.383 -0.823 . . . . 0.0 111.897 -178.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.87 -31.62 71.08 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.536 1.134 . . . . 0.0 111.838 174.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -72.48 -48.72 38.52 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.488 1.115 . . . . 0.0 110.748 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -62.23 -46.74 87.5 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 124.15 0.98 . . . . 0.0 110.62 178.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.09 -38.2 73.01 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.094 1.357 . . . . 0.0 112.421 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 t -65.19 -55.55 17.93 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.546 0.738 . . . . 0.0 111.245 175.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 tt -62.88 -31.25 72.26 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.928 -0.482 . . . . 0.0 111.503 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 39.2 ttt180 -61.41 -28.56 69.34 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 126.189 1.796 . . . . 0.0 111.766 172.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -63.6 -61.36 2.37 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 120.061 1.3 . . . . 0.0 111.009 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -53.81 -49.53 68.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.293 0.637 . . . . 0.0 110.989 174.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.92 -22.34 48.24 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 121.179 -0.95 . . . . 0.0 113.39 177.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.97 -52.58 12.37 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.357 1.863 . . . . 0.0 111.062 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -74.45 -12.02 60.39 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 177.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.6 t -83.16 -33.58 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 C-N-CA 125.536 1.535 . . . . 0.0 112.451 172.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.6 p -86.26 -38.18 17.83 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 124.592 1.157 . . . . 0.0 111.806 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -44.51 -42.35 7.11 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.235 1.414 . . . . 0.0 113.56 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.64 -42.22 56.09 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.728 1.211 . . . . 0.0 112.004 176.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mtp-105 -122.76 53.27 1.28 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.242 1.817 . . . . 0.0 111.536 178.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -104.07 55.76 0.73 Allowed 'General case' 0 C--O 1.223 -0.317 0 CA-C-O 123.28 1.515 . . . . 0.0 110.716 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.566 0 O-C-N 119.361 -2.087 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 . . . . . 0 N--CA 1.475 0.794 0 CA-C-O 119.289 -0.386 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -77.29 53.16 4.14 Favored 'Trans proline' 0 CA--C 1.551 1.355 0 C-N-CA 124.186 3.258 . . . . 0.0 112.583 178.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.39 142.22 12.62 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.291 1.436 . . . . 0.0 109.336 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.7 mttt 166.49 -57.39 0.0 OUTLIER Pre-proline 0 N--CA 1.481 1.117 0 C-N-CA 128.552 2.741 . . . . 0.0 111.328 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -76.43 90.18 1.22 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.582 2.188 . . . . 0.0 110.897 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -139.41 146.35 40.03 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.936 1.294 . . . . 0.0 109.365 176.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.94 153.03 51.81 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.358 0.663 . . . . 0.0 111.277 175.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -72.55 109.63 2.81 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.94 2.426 . . . . 0.0 111.219 177.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.02 92.07 0.55 Allowed Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.396 1.474 . . . . 0.0 111.296 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -145.05 99.68 3.36 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.735 0.814 . . . . 0.0 110.7 -178.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -127.0 83.26 2.15 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.463 1.905 . . . . 0.0 111.431 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -103.96 101.38 11.16 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.796 0.838 . . . . 0.0 109.657 178.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.41 163.85 2.3 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.251 1.421 . . . . 0.0 112.213 176.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -69.39 -172.22 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.409 2.072 . . . . 0.0 110.447 173.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.264 11.9 pt-20 53.09 18.16 1.09 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.05 1.34 . . . . 0.0 114.454 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -162.54 -38.84 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.042 2.137 . . . . 0.0 111.257 -175.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.45 -60.18 4.04 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.473 1.488 . . . . 0.0 111.006 177.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.3 t -62.7 -19.51 63.96 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.179 -0.95 . . . . 0.0 112.518 -177.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -34.42 72.36 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.78 1.632 . . . . 0.0 111.25 173.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -67.78 -51.95 42.91 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 124.179 0.991 . . . . 0.0 110.507 172.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.33 -47.78 75.17 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.356 1.062 . . . . 0.0 111.212 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.8 76.87 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.02 0.928 . . . . 0.0 112.66 177.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -45.78 54.23 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.929 0.892 . . . . 0.0 111.64 174.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.26 -34.19 76.05 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.9 1.28 . . . . 0.0 111.333 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -21.01 53.86 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 125.343 1.457 . . . . 0.0 112.711 170.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.74 -59.08 3.17 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.572 1.533 . . . . 0.0 111.146 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -55.9 -47.91 76.58 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.213 0.605 . . . . 0.0 111.048 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.279 0.1 OUTLIER -60.61 -18.66 54.49 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 175.819 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.76 -56.09 4.91 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 119.904 -1.748 . . . . 0.0 111.313 175.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.21 -11.75 61.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 177.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.8 t -86.96 -37.77 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.74 1.616 . . . . 0.0 112.539 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 p -70.72 -43.03 69.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.795 0.725 . . . . 0.0 111.915 175.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.8 ttt85 -46.54 -40.71 13.14 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.999 1.32 . . . . 0.0 112.812 -178.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -46.85 -33.28 4.37 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.664 1.986 . . . . 0.0 114.251 175.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -135.3 46.68 2.38 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 127.408 2.283 . . . . 0.0 110.835 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -114.51 73.95 0.85 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.835 1.302 . . . . 0.0 111.372 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.597 0 O-C-N 119.617 -1.927 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 117.642 -1.17 . . . . 0.0 111.466 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -68.08 135.67 35.47 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 121.954 1.769 . . . . 0.0 110.232 179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.35 -92.21 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 124.657 1.183 . . . . 0.0 111.459 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -143.05 65.15 15.25 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 124.529 1.132 . . . . 0.0 110.065 172.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.96 169.02 22.33 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.365 2.044 . . . . 0.0 110.638 176.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 62.13 171.92 0.13 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.364 1.465 . . . . 0.0 112.376 -173.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.06 80.64 10.2 Favored Pre-proline 0 C--O 1.241 0.627 0 O-C-N 120.994 -1.066 . . . . 0.0 110.007 176.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -68.06 147.61 73.92 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.511 2.141 . . . . 0.0 110.577 179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.75 52.66 0.01 OUTLIER Glycine 0 CA--C 1.528 0.886 0 C-N-CA 123.435 0.54 . . . . 0.0 113.0 -177.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.38 46.08 0.41 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.228 1.411 . . . . 0.0 113.34 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 36.7 t0 59.25 77.55 0.3 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.816 1.646 . . . . 0.0 113.394 -178.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.32 78.91 1.44 Allowed 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.54 -0.725 . . . . 0.0 110.264 -174.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.1 t 36.12 76.35 0.45 Allowed Pre-proline 0 N--CA 1.475 0.823 0 C-N-CA 125.845 1.658 . . . . 0.0 112.158 -175.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.59 49.4 1.15 Allowed 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 124.478 3.452 . . . . 0.0 113.767 -176.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -74.31 0.47 14.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.481 2.312 . . . . 0.0 113.387 176.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -133.21 -44.1 0.85 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.745 2.018 . . . . 0.0 112.378 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.86 -59.96 3.08 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.891 0.769 . . . . 0.0 109.691 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.0 m -63.45 -15.0 56.39 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 119.243 -0.408 . . . . 0.0 111.663 179.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -29.95 69.58 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.095 1.358 . . . . 0.0 112.352 170.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -75.25 -45.04 42.65 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.697 1.199 . . . . 0.0 110.456 172.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -65.44 -46.48 79.74 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 124.188 0.995 . . . . 0.0 112.141 -179.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.72 -39.71 85.6 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.065 1.346 . . . . 0.0 112.569 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.0 -49.03 55.58 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.952 0.501 . . . . 0.0 111.356 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -63.22 -34.11 76.95 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.126 0.57 . . . . 0.0 111.497 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.33 -32.97 69.01 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.031 1.733 . . . . 0.0 111.625 172.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -59.37 -61.87 2.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 119.725 1.148 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -54.55 -48.99 71.35 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.273 0.629 . . . . 0.0 111.025 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.285 0.1 OUTLIER -56.33 -26.95 54.16 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.413 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -69.03 -60.0 2.65 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.425 1.89 . . . . 0.0 111.148 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.54 -14.53 63.02 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -84.38 -34.4 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 126.3 1.84 . . . . 0.0 112.092 170.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.9 p -71.29 -42.51 68.61 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 118.141 -0.933 . . . . 0.0 112.92 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 -44.1 -39.88 4.54 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.17 1.388 . . . . 0.0 112.168 179.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.21 -42.51 30.31 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.887 1.675 . . . . 0.0 112.813 176.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.45 58.54 1.77 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.774 2.03 . . . . 0.0 110.971 177.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -114.35 78.75 1.18 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 122.984 1.373 . . . . 0.0 110.098 177.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.531 0 O-C-N 119.638 -1.914 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 118.409 -0.805 . . . . 0.0 109.869 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.61 103.63 1.33 Allowed 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 123.544 2.829 . . . . 0.0 109.976 174.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.55 128.39 36.32 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.743 0.817 . . . . 0.0 109.975 172.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.04 85.19 0.17 Allowed Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.467 1.507 . . . . 0.0 111.406 -176.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -73.03 84.87 1.26 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.449 2.766 . . . . 0.0 110.94 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 53.91 87.85 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.079 1.752 . . . . 0.0 112.88 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.3 147.64 86.85 Favored Pre-proline 0 CA--C 1.55 0.955 0 O-C-N 121.671 -0.643 . . . . 0.0 111.453 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -71.26 170.51 18.12 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.867 2.378 . . . . 0.0 111.35 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.77 101.32 0.91 Allowed Glycine 0 CA--C 1.528 0.886 0 CA-C-O 119.109 -0.828 . . . . 0.0 112.084 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -69.47 42.48 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.652 1.581 . . . . 0.0 114.721 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -86.59 72.19 10.27 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.653 1.581 . . . . 0.0 111.25 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -156.93 168.86 26.22 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.933 1.293 . . . . 0.0 111.021 175.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 t 42.23 78.74 0.36 Allowed Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 126.097 1.759 . . . . 0.0 112.66 178.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.43 117.02 4.68 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.484 2.123 . . . . 0.0 110.472 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -131.7 76.94 1.74 Allowed 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 126.974 2.11 . . . . 0.0 107.071 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 68.44 -6.59 0.78 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.75 1.62 . . . . 0.0 113.532 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -59.95 4.61 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 120.352 -1.467 . . . . 0.0 110.352 174.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.4 t -62.03 -19.61 63.06 Favored 'General case' 0 C--O 1.218 -0.596 0 O-C-N 121.841 -0.537 . . . . 0.0 111.357 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -29.48 63.93 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 124.421 1.089 . . . . 0.0 112.446 172.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -73.82 -47.84 35.61 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.558 1.143 . . . . 0.0 110.939 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -70.93 -43.68 67.71 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 124.355 1.062 . . . . 0.0 112.841 -177.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.18 -38.89 91.94 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.726 2.011 . . . . 0.0 111.705 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 t -68.06 -49.1 63.43 Favored 'General case' 0 C--N 1.346 0.45 0 O-C-N 122.046 -0.409 . . . . 0.0 110.622 172.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tt -61.62 -34.39 75.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.312 0.505 . . . . 0.0 112.095 177.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -29.75 53.52 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 126.126 1.771 . . . . 0.0 112.093 171.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -67.51 -59.83 3.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 120.112 1.324 . . . . 0.0 111.967 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -56.55 -48.83 76.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 110.853 175.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.301 0.1 OUTLIER -56.61 -26.11 54.83 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 118.547 -0.739 . . . . 0.0 112.691 175.735 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -54.75 9.51 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.996 1.718 . . . . 0.0 112.64 178.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -71.63 -14.55 62.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.837 0.855 . . . . 0.0 112.935 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.9 t -83.63 -38.51 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 126.1 1.76 . . . . 0.0 111.816 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 p -67.07 -44.44 80.06 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.173 175.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 -47.95 -41.66 25.55 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.008 0.923 . . . . 0.0 113.03 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.81 -40.02 54.43 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.181 1.393 . . . . 0.0 112.691 176.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.25 68.24 1.26 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.152 0.981 . . . . 0.0 112.229 176.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -96.99 -52.45 3.86 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.889 0.852 . . . . 0.0 112.245 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.581 0 O-C-N 119.406 -2.059 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 117.387 -1.292 . . . . 0.0 111.699 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.64 174.88 10.36 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.053 1.835 . . . . 0.0 111.749 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.29 162.6 14.47 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.522 1.129 . . . . 0.0 110.467 175.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.2 87.62 3.89 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 123.698 0.799 . . . . 0.0 110.055 178.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -72.9 58.78 3.42 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 124.25 3.3 . . . . 0.0 112.733 -176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 55.24 177.63 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.076 1.751 . . . . 0.0 113.15 -168.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -156.32 87.28 2.94 Favored Pre-proline 0 CA--C 1.541 0.631 0 O-C-N 121.365 -0.834 . . . . 0.0 110.16 171.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.8 174.08 12.41 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 122.2 1.933 . . . . 0.0 111.587 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.14 68.58 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 CA-C-O 119.295 -0.725 . . . . 0.0 111.9 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -167.56 136.86 2.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.595 1.158 . . . . 0.0 109.792 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.1 p30 -120.98 67.88 0.87 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.231 1.813 . . . . 0.0 111.013 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -143.63 178.84 7.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.783 0.833 . . . . 0.0 111.533 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.35 152.44 79.49 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 123.139 0.575 . . . . 0.0 111.264 177.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -75.65 66.39 6.57 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.326 2.684 . . . . 0.0 112.012 -178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -113.42 5.79 16.9 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.985 1.714 . . . . 0.0 113.524 -177.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -163.64 -52.31 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 126.03 1.732 . . . . 0.0 110.075 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.75 -62.85 1.5 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.36 0.982 . . . . 0.0 110.689 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.44 -17.48 64.58 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.21 -0.931 . . . . 0.0 112.078 -177.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.67 -32.58 71.77 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 126.109 1.764 . . . . 0.0 111.161 172.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -71.98 -48.65 43.37 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 124.46 1.104 . . . . 0.0 110.43 173.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.91 -47.85 83.54 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 123.945 0.898 . . . . 0.0 110.619 178.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.54 82.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.13 0.877 . . . . 0.0 112.835 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 t -71.59 -51.46 23.22 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 122.871 0.468 . . . . 0.0 111.398 175.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.73 -31.59 72.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.901 0.88 . . . . 0.0 111.938 178.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.33 -30.63 29.41 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 126.27 1.828 . . . . 0.0 111.84 169.108 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -64.92 -64.26 0.91 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.994 1.27 . . . . 0.0 110.986 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -54.0 -48.36 70.51 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.615 0.766 . . . . 0.0 110.969 176.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.283 0.1 OUTLIER -57.69 -27.4 62.87 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.329 177.044 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -68.42 -55.21 12.67 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.707 1.603 . . . . 0.0 111.345 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.36 -10.93 60.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 76.9 t -88.02 -35.6 8.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 125.823 1.649 . . . . 0.0 111.624 170.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.7 p -65.96 -42.21 90.25 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.83 -26.5 35.52 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 175.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -73.34 -17.65 61.27 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.42 1.088 . . . . 0.0 111.767 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -146.26 59.9 1.23 Allowed 'General case' 0 C--N 1.343 0.32 0 C-N-CA 127.333 2.253 . . . . 0.0 112.048 -174.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -117.14 70.63 0.78 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 123.026 1.393 . . . . 0.0 110.095 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.755 0 O-C-N 119.285 -2.134 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 117.356 -1.307 . . . . 0.0 111.341 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.06 171.26 17.92 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 121.69 1.594 . . . . 0.0 110.673 177.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -164.29 179.01 7.1 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.761 1.624 . . . . 0.0 108.495 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.41 82.03 0.18 Allowed Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 125.22 1.408 . . . . 0.0 110.566 179.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -70.0 175.88 7.71 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.89 2.393 . . . . 0.0 111.574 178.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -99.16 155.09 17.65 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 123.867 0.867 . . . . 0.0 111.453 176.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.25 81.47 8.78 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 124.538 1.135 . . . . 0.0 108.959 177.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -72.72 47.44 1.19 Allowed 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 124.034 3.156 . . . . 0.0 113.427 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 47.5 -143.75 5.93 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.389 1.471 . . . . 0.0 112.236 -172.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -161.25 118.42 2.28 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.291 0.637 . . . . 0.0 109.892 170.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -113.45 93.65 4.49 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.068 1.347 . . . . 0.0 109.223 176.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.03 57.45 0.15 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.935 1.294 . . . . 0.0 111.535 171.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.02 143.11 35.68 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 125.78 1.632 . . . . 0.0 110.672 -177.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.06 178.07 4.49 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.356 2.037 . . . . 0.0 111.95 176.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 67.64 15.02 9.68 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.107 1.363 . . . . 0.0 113.803 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -159.77 -52.04 0.06 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.691 1.596 . . . . 0.0 111.039 -176.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -59.86 4.72 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.461 1.028 . . . . 0.0 111.326 176.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.2 m -60.61 -19.25 57.3 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.182 -0.949 . . . . 0.0 112.563 -179.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -38.44 77.95 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.822 1.249 . . . . 0.0 111.004 171.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -66.95 -46.06 75.87 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.439 1.095 . . . . 0.0 111.039 175.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -60.93 -48.89 79.72 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 124.251 1.021 . . . . 0.0 111.349 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.01 92.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.782 0.833 . . . . 0.0 112.402 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -48.41 75.22 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.342 0.519 . . . . 0.0 111.641 174.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -34.02 77.06 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.614 0.765 . . . . 0.0 111.5 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 28.5 ttm-85 -56.4 -32.82 65.18 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 125.28 1.432 . . . . 0.0 112.495 168.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -59.33 -60.79 3.3 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.994 1.27 . . . . 0.0 111.11 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -54.57 -48.88 71.53 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.452 0.701 . . . . 0.0 111.102 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.276 0.1 OUTLIER -58.55 -21.89 54.04 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 176.201 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -74.98 -54.77 6.61 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.651 1.58 . . . . 0.0 112.179 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -68.44 -18.59 64.45 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.166 -0.959 . . . . 0.0 112.415 176.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.6 t -84.25 -28.26 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.2 1.8 . . . . 0.0 113.729 172.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.4 p -78.93 -43.41 24.76 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 117.629 -1.176 . . . . 0.0 111.709 172.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.13 -44.15 31.87 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.616 1.098 . . . . 0.0 113.654 176.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -70.86 -17.24 62.73 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.2 10.15 20.13 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.884 2.474 . . . . 0.0 112.806 178.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.9 38.53 0.71 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 123.586 1.66 . . . . 0.0 110.753 -176.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.528 0 O-C-N 118.708 -2.495 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 117.644 -1.17 . . . . 0.0 112.644 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.84 149.38 53.77 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.344 2.029 . . . . 0.0 110.287 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 39.89 53.12 2.63 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.882 1.673 . . . . 0.0 112.914 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -130.55 76.95 76.71 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 125.227 1.411 . . . . 0.0 108.556 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -79.07 156.0 26.22 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.93 2.42 . . . . 0.0 111.504 170.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -145.83 98.45 3.12 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 125.333 1.453 . . . . 0.0 109.433 -177.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -43.05 97.76 0.15 Allowed Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 125.333 1.453 . . . . 0.0 111.994 -175.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -78.6 121.18 5.03 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.84 1.693 . . . . 0.0 109.76 -169.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.53 59.05 0.51 Allowed Glycine 0 CA--C 1.522 0.482 0 CA-C-O 118.618 -1.101 . . . . 0.0 111.903 -174.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 66.08 124.78 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 127.168 2.187 . . . . 0.0 113.516 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -113.39 93.06 4.22 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.323 1.049 . . . . 0.0 109.801 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.59 120.84 16.87 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.64 1.576 . . . . 0.0 109.856 177.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.79 147.67 41.57 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 124.146 0.978 . . . . 0.0 110.294 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.99 -171.96 0.45 Allowed 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.577 2.851 . . . . 0.0 111.054 175.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 52.0 20.44 1.25 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.509 1.524 . . . . 0.0 115.043 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -163.62 -50.77 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.842 1.657 . . . . 0.0 110.649 -173.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.87 -62.56 1.79 Allowed 'General case' 0 C--N 1.347 0.48 0 CA-C-N 119.724 1.147 . . . . 0.0 110.909 176.747 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.5 t -62.79 -19.14 63.74 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.644 -0.66 . . . . 0.0 111.472 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -31.32 70.45 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 125.706 1.602 . . . . 0.0 112.098 172.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -71.4 -46.55 59.99 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.16 0.984 . . . . 0.0 110.467 172.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -67.6 -50.09 59.91 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 124.593 1.157 . . . . 0.0 112.04 -178.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.14 -37.86 81.36 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.646 1.578 . . . . 0.0 112.623 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -69.9 -50.78 38.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.975 0.51 . . . . 0.0 111.423 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -36.6 77.07 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.334 0.516 . . . . 0.0 111.705 175.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -35.24 62.75 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.74 1.616 . . . . 0.0 111.778 171.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -59.8 -57.98 10.55 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 119.834 1.197 . . . . 0.0 111.825 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -56.66 -49.65 74.42 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.04 0.536 . . . . 0.0 110.579 174.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . 0.293 0.1 OUTLIER -55.55 -27.97 52.09 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.2 176.946 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -68.93 -56.94 6.3 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 127.057 2.143 . . . . 0.0 112.242 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.63 -17.63 63.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.71 0.804 . . . . 0.0 112.37 178.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -78.49 -41.58 25.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 126.1 1.76 . . . . 0.0 111.444 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 p -68.55 -37.29 79.81 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.416 1.086 . . . . 0.0 113.27 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -19.69 12.95 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 175.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -116.67 21.17 13.61 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.278 1.831 . . . . 0.0 111.784 178.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -173.38 87.67 0.06 Allowed 'General case' 0 C--N 1.347 0.46 0 C-N-CA 126.755 2.022 . . . . 0.0 111.851 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -151.59 65.54 0.87 Allowed 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 123.072 1.415 . . . . 0.0 110.779 178.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 O-C-N 118.711 -2.493 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.214 -0.811 0 CA-C-O 118.819 -0.61 . . . . 0.0 111.532 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.65 -43.21 99.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.666 1.187 . . . . 0.0 112.404 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -65.93 -51.01 62.35 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 124.166 0.986 . . . . 0.0 111.325 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.9 tp -60.94 -37.09 81.12 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.406 0.682 . . . . 0.0 111.077 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.8 ' HA ' HD23 ' A' ' 28' ' ' LEU . 33.5 ttp180 -58.6 -34.16 70.81 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 125.77 1.628 . . . . 0.0 111.831 173.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -58.48 -59.63 5.07 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.492 1.042 . . . . 0.0 111.068 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -55.27 -48.94 73.28 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.373 0.669 . . . . 0.0 111.092 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.8 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.272 0.1 OUTLIER -59.26 -20.34 53.42 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 175.929 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.79 -55.18 5.72 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.711 -1.868 . . . . 0.0 111.16 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.25 -17.76 64.38 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.4 t -83.08 -36.12 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.789 1.636 . . . . 0.0 112.937 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 CA--C 1.515 -0.39 0 CA-C-O 117.821 -1.085 . . . . 0.0 110.823 175.257 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 119.402 -0.333 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.67 85.56 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.693 1.197 . . . . 0.0 112.303 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 t -71.92 -50.2 31.16 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 123.053 0.541 . . . . 0.0 111.325 174.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.3 tp -56.99 -37.9 72.31 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.934 0.893 . . . . 0.0 111.171 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.698 ' HA ' HD23 ' A' ' 28' ' ' LEU . 1.4 tmt_? -54.95 -36.46 65.34 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 125.772 1.629 . . . . 0.0 111.9 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -60.23 -55.57 32.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.171 1.351 . . . . 0.0 111.477 -178.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -57.01 -50.18 73.51 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.104 0.561 . . . . 0.0 110.643 174.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.698 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.277 0.1 OUTLIER -58.4 -21.1 49.37 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 175.511 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -76.2 -56.54 4.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.036 1.734 . . . . 0.0 110.982 176.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 pp -67.04 -19.35 65.67 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 176.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.0 t -82.48 -31.27 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.098 1.759 . . . . 0.0 112.908 173.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 N--CA 1.467 0.415 0 O-C-N 121.196 -0.94 . . . . 0.0 112.035 176.912 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.216 -0.688 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.64 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.12 -40.09 96.59 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.166 2.187 . . . . 0.0 112.379 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 t -69.87 -51.7 31.04 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 123.318 0.386 . . . . 0.0 110.881 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.49 -34.41 72.54 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.841 -0.537 . . . . 0.0 112.194 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.793 ' HA ' HD23 ' A' ' 28' ' ' LEU . 8.4 ttm180 -57.4 -31.67 66.07 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 125.62 1.568 . . . . 0.0 111.973 172.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -58.96 -60.07 4.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 120.317 1.417 . . . . 0.0 111.112 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -54.81 -49.18 71.64 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.362 0.665 . . . . 0.0 111.271 174.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.299 0.1 OUTLIER -57.18 -28.62 62.97 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 121.67 -0.643 . . . . 0.0 112.554 175.947 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -67.83 -60.1 2.78 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 126.142 1.777 . . . . 0.0 110.35 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.55 -11.82 58.93 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 118.472 -0.775 . . . . 0.0 113.024 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -84.85 -40.16 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.152 1.381 . . . . 0.0 111.66 171.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 CA--C 1.518 -0.271 0 C-N-CA 123.496 0.718 . . . . 0.0 111.281 175.235 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.95 -28.04 69.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.714 1.206 . . . . 0.0 113.069 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.98 -47.02 19.49 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.873 0.869 . . . . 0.0 111.189 172.059 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.15 -32.22 73.71 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 0.0 112.539 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.682 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -53.15 -28.28 25.28 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.492 1.517 . . . . 0.0 112.325 169.538 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -68.07 -63.05 1.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.836 1.198 . . . . 0.0 111.242 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.405 ' O ' HG23 ' A' ' 31' ' ' VAL . 66.3 t80 -54.42 -48.47 71.62 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.23 0.612 . . . . 0.0 110.752 176.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.291 0.1 OUTLIER -57.91 -23.94 55.58 Favored 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 176.411 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -74.32 -51.13 16.11 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.911 1.684 . . . . 0.0 112.11 175.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 -8.18 55.4 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 27' ' ' TYR . 55.6 t -89.16 -38.85 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 126.14 1.776 . . . . 0.0 111.84 171.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 124.404 1.082 . . . . 0.0 113.823 -179.913 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.216 -0.693 0 CA-C-O 118.927 -0.559 . . . . 0.0 112.335 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.85 -37.1 85.51 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.164 1.786 . . . . 0.0 111.445 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t -72.82 -48.28 39.26 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 124.001 0.92 . . . . 0.0 111.041 174.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.84 -32.06 73.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.191 0.596 . . . . 0.0 111.297 177.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.813 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.77 -24.79 67.9 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.333 1.853 . . . . 0.0 112.042 173.599 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -67.31 -59.2 3.61 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.674 1.125 . . . . 0.0 110.923 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.4 ' O ' HG23 ' A' ' 31' ' ' VAL . 53.6 t80 -54.78 -49.78 70.08 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.549 0.74 . . . . 0.0 110.496 173.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.813 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.284 0.1 OUTLIER -57.91 -23.72 54.61 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.45 177.139 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -75.72 -48.07 23.44 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.116 1.766 . . . . 0.0 112.453 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -76.26 -6.39 51.22 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.66 -0.65 . . . . 0.0 112.689 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 27' ' ' TYR . 75.1 t -95.06 -29.14 4.05 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 126.988 2.115 . . . . 0.0 112.799 172.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p . . . . . 0 CA--C 1.519 -0.218 0 O-C-N 120.918 -1.114 . . . . 0.0 112.224 176.777 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.3 t80 . . . . . 0 C--O 1.22 -0.46 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.2 89.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.169 1.788 . . . . 0.0 112.099 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.5 t -67.88 -52.0 41.55 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.984 0.356 . . . . 0.0 111.244 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -36.46 73.53 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.708 -0.62 . . . . 0.0 112.02 176.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.696 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -53.89 -28.51 36.95 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.277 1.831 . . . . 0.0 112.663 171.461 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -67.32 -62.06 1.61 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.785 1.175 . . . . 0.0 111.115 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.46 -48.34 74.67 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 123.131 0.572 . . . . 0.0 110.876 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.696 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.308 0.1 OUTLIER -57.08 -27.12 61.46 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 176.248 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.02 -60.42 2.51 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.471 1.508 . . . . 0.0 111.063 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.4 -19.24 65.75 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.634 0.774 . . . . 0.0 112.756 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 72.5 t -78.27 -40.29 25.26 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 126.354 1.862 . . . . 0.0 111.628 169.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p . . . . . 0 CA--C 1.513 -0.447 0 CA-C-O 118.066 -0.969 . . . . 0.0 112.945 176.921 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.99 -30.85 71.91 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.637 1.975 . . . . 0.0 112.129 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -43.42 62.91 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.231 0.612 . . . . 0.0 110.742 170.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.88 -33.72 76.68 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.266 -0.397 . . . . 0.0 112.011 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.686 ' HA ' HD23 ' A' ' 28' ' ' LEU . 6.2 tpm_? -48.2 -36.09 13.06 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.952 1.701 . . . . 0.0 111.803 176.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -64.1 -59.78 4.03 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.317 1.847 . . . . 0.0 112.174 177.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -55.4 -50.21 70.35 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.12 0.568 . . . . 0.0 110.513 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.686 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.264 0.0 OUTLIER -59.64 -18.69 43.79 Favored 'General case' 0 CA--C 1.556 1.198 0 O-C-N 121.583 -0.698 . . . . 0.0 112.4 175.929 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -77.75 -52.79 8.37 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.1 1.76 . . . . 0.0 112.743 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.96 -16.83 62.67 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.34 -0.85 . . . . 0.0 113.062 176.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.7 t -81.9 -39.65 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 126.433 1.893 . . . . 0.0 112.372 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 28' ' ' LEU . 24.0 p . . . . . 0 CA--C 1.512 -0.491 0 CA-C-O 117.524 -1.226 . . . . 0.0 111.388 176.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.2 t80 . . . . . 0 C--O 1.22 -0.454 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.54 -33.17 71.07 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.842 1.257 . . . . 0.0 112.628 173.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.54 -45.37 46.02 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.199 0.454 . . . . 0.0 111.229 173.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -65.07 -28.96 69.83 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.81 0.844 . . . . 0.0 112.518 177.338 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.706 ' HA ' HD23 ' A' ' 28' ' ' LEU . 25.3 tpt180 -50.05 -37.27 32.53 Favored 'General case' 0 C--O 1.207 -1.168 0 C-N-CA 125.247 1.419 . . . . 0.0 111.471 171.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -61.39 -59.27 5.53 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.881 0.872 . . . . 0.0 111.816 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.43 -49.09 73.32 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 123.4 0.68 . . . . 0.0 111.08 174.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.269 0.0 OUTLIER -60.65 -17.38 47.01 Favored 'General case' 0 CA--C 1.563 1.463 0 O-C-N 121.177 -0.952 . . . . 0.0 112.906 175.665 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.14 -54.03 6.71 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.435 -2.041 . . . . 0.0 111.408 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 pp -71.12 -14.84 62.43 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 176.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.1 t -84.64 -38.44 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.482 1.513 . . . . 0.0 112.171 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.428 HG23 HD12 ' A' ' 28' ' ' LEU . 14.6 p . . . . . 0 CA--C 1.508 -0.64 0 CA-C-O 116.682 -1.628 . . . . 0.0 110.913 175.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 . . . . . 0 C--O 1.22 -0.464 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.37 -36.49 80.37 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.44 2.296 . . . . 0.0 112.491 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.4 t -68.08 -54.64 16.75 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.2 1.0 . . . . 0.0 110.89 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -34.44 75.26 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.971 0.508 . . . . 0.0 111.309 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.815 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.59 -35.5 63.42 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 125.995 1.718 . . . . 0.0 112.166 171.115 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -61.0 -56.64 18.74 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.036 1.289 . . . . 0.0 111.758 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -56.2 -50.44 71.22 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 123.576 0.75 . . . . 0.0 110.347 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.279 0.1 OUTLIER -57.47 -23.01 47.34 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 119.065 -0.493 . . . . 0.0 112.218 176.028 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.66 -49.19 16.77 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.32 1.848 . . . . 0.0 112.5 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -75.46 -12.58 60.27 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.55 -35.31 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 126.017 1.727 . . . . 0.0 112.402 172.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 p . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.52 -1.228 . . . . 0.0 111.556 175.528 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--O 1.22 -0.456 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.94 -41.22 95.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.993 2.117 . . . . 0.0 112.125 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -47.43 67.85 Favored 'General case' 0 C--N 1.343 0.304 0 O-C-N 122.126 -0.359 . . . . 0.0 111.299 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.2 tp -60.48 -34.94 74.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.872 -0.518 . . . . 0.0 111.663 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.668 ' HA ' HD23 ' A' ' 28' ' ' LEU . 67.9 ttt180 -60.17 -17.5 41.34 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.087 2.155 . . . . 0.0 113.188 173.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -75.85 -59.02 2.94 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.316 0.962 . . . . 0.0 111.402 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.25 -49.15 76.96 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 122.886 0.474 . . . . 0.0 110.538 175.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.668 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.266 0.1 OUTLIER -58.92 -18.67 35.5 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 175.652 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.12 -57.04 4.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.694 -1.879 . . . . 0.0 111.722 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.57 -15.13 63.16 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -84.22 -37.48 12.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 C-N-CA 126.554 1.942 . . . . 0.0 112.265 170.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.87 -1.062 . . . . 0.0 111.339 177.3 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.222 -0.353 0 CA-C-O 119.479 -0.296 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -35.35 79.41 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.59 1.156 . . . . 0.0 112.487 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -48.82 27.68 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.346 0.521 . . . . 0.0 112.122 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.31 -33.11 73.05 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.555 0.616 . . . . 0.0 111.349 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.688 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.74 -26.11 32.03 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 125.881 1.673 . . . . 0.0 113.153 169.132 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -68.97 -62.16 1.49 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 120.36 1.436 . . . . 0.0 111.706 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -55.8 -48.44 75.38 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.358 0.663 . . . . 0.0 110.629 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.688 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.287 0.1 OUTLIER -57.07 -27.05 61.37 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 176.343 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -68.53 -59.74 2.93 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.352 1.461 . . . . 0.0 111.003 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.89 -17.0 64.69 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.939 0.896 . . . . 0.0 113.048 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.1 t -81.77 -37.71 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 126.107 1.763 . . . . 0.0 111.962 169.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.8 p . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 117.726 -1.13 . . . . 0.0 112.302 175.609 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--O 1.223 -0.316 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.72 -33.65 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.407 1.883 . . . . 0.0 112.385 174.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.0 t -69.01 -50.36 49.53 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 122.548 0.339 . . . . 0.0 111.84 173.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.7 -32.07 73.15 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.012 0.369 . . . . 0.0 111.774 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.794 ' HA ' HD23 ' A' ' 28' ' ' LEU . 35.5 ttt180 -55.23 -31.35 61.42 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 125.815 1.646 . . . . 0.0 112.097 170.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.14 -59.82 4.73 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.886 1.221 . . . . 0.0 111.604 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.441 ' O ' HG23 ' A' ' 31' ' ' VAL . 64.4 t80 -56.24 -49.46 74.09 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.71 0.804 . . . . 0.0 110.592 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.794 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.266 0.1 OUTLIER -56.93 -26.78 60.08 Favored 'General case' 0 CA--C 1.557 1.244 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 177.168 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -68.8 -55.23 11.87 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.924 1.689 . . . . 0.0 111.035 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.98 -16.66 61.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 27' ' ' TYR . 46.0 t -75.26 -40.03 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 126.078 1.751 . . . . 0.0 112.144 172.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 CA--C 1.522 -0.133 0 C-N-CA 123.837 0.855 . . . . 0.0 111.964 177.932 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--O 1.219 -0.531 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.72 77.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.293 1.437 . . . . 0.0 113.282 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -55.05 17.55 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.332 0.653 . . . . 0.0 111.202 174.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.13 -33.9 75.35 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.588 0.355 . . . . 0.0 111.487 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.777 ' HA ' HD23 ' A' ' 28' ' ' LEU . 4.9 tmm_? -56.12 -34.12 65.78 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 126.212 1.805 . . . . 0.0 111.857 171.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -59.66 -60.3 4.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 120.19 1.359 . . . . 0.0 110.956 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -55.57 -49.03 73.79 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.365 0.666 . . . . 0.0 110.932 175.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.297 0.1 OUTLIER -56.11 -28.71 58.91 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.391 176.112 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.07 -58.76 3.96 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 125.681 1.592 . . . . 0.0 111.358 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.67 -17.69 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.838 0.855 . . . . 0.0 112.822 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 62.1 t -76.69 -41.17 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 C-N-CA 125.492 1.517 . . . . 0.0 111.501 168.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.5 p . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 179.44 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.217 -0.641 0 CA-C-O 118.726 -0.654 . . . . 0.0 110.62 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.09 -38.2 73.01 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.094 1.357 . . . . 0.0 112.421 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 t -65.19 -55.55 17.93 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.546 0.738 . . . . 0.0 111.245 175.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 tt -62.88 -31.25 72.26 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.928 -0.482 . . . . 0.0 111.503 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.842 ' HA ' HD23 ' A' ' 28' ' ' LEU . 39.2 ttt180 -61.41 -28.56 69.34 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 126.189 1.796 . . . . 0.0 111.766 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -63.6 -61.36 2.37 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 120.061 1.3 . . . . 0.0 111.009 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.478 ' O ' HG23 ' A' ' 31' ' ' VAL . 61.3 t80 -53.81 -49.53 68.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.293 0.637 . . . . 0.0 110.989 174.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.842 HD23 ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -57.92 -22.34 48.24 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 121.179 -0.95 . . . . 0.0 113.39 177.219 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.97 -52.58 12.37 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.357 1.863 . . . . 0.0 111.062 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -74.45 -12.02 60.39 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 177.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 27' ' ' TYR . 55.6 t -83.16 -33.58 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 C-N-CA 125.536 1.535 . . . . 0.0 112.451 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.512 -0.488 0 C-N-CA 124.592 1.157 . . . . 0.0 111.806 178.523 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 N--CA 1.465 0.301 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.8 76.87 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.02 0.928 . . . . 0.0 112.66 177.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -45.78 54.23 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.929 0.892 . . . . 0.0 111.64 174.211 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.26 -34.19 76.05 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.9 1.28 . . . . 0.0 111.333 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.645 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -58.71 -21.01 53.86 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 125.343 1.457 . . . . 0.0 112.711 170.99 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.74 -59.08 3.17 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.572 1.533 . . . . 0.0 111.146 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -55.9 -47.91 76.58 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.213 0.605 . . . . 0.0 111.048 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.645 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.279 0.1 OUTLIER -60.61 -18.66 54.49 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 175.819 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.76 -56.09 4.91 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 119.904 -1.748 . . . . 0.0 111.313 175.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.21 -11.75 61.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 177.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.8 t -86.96 -37.77 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.74 1.616 . . . . 0.0 112.539 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.234 0.281 0 CA-C-N 118.795 0.725 . . . . 0.0 111.915 175.142 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.1 t80 . . . . . 0 C--O 1.219 -0.544 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.72 -39.71 85.6 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.065 1.346 . . . . 0.0 112.569 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.0 -49.03 55.58 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.952 0.501 . . . . 0.0 111.356 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -63.22 -34.11 76.95 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.126 0.57 . . . . 0.0 111.497 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.831 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -58.33 -32.97 69.01 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.031 1.733 . . . . 0.0 111.625 172.139 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -59.37 -61.87 2.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 119.725 1.148 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -54.55 -48.99 71.35 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.273 0.629 . . . . 0.0 111.025 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.831 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.285 0.1 OUTLIER -56.33 -26.95 54.16 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.413 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -69.03 -60.0 2.65 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.425 1.89 . . . . 0.0 111.148 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.54 -14.53 63.02 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -84.38 -34.4 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 126.3 1.84 . . . . 0.0 112.092 170.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 CA--C 1.511 -0.538 0 CA-C-O 118.141 -0.933 . . . . 0.0 112.92 176.362 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--O 1.221 -0.431 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.18 -38.89 91.94 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.726 2.011 . . . . 0.0 111.705 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 t -68.06 -49.1 63.43 Favored 'General case' 0 C--N 1.346 0.45 0 O-C-N 122.046 -0.409 . . . . 0.0 110.622 172.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tt -61.62 -34.39 75.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.312 0.505 . . . . 0.0 112.095 177.144 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.711 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.67 -29.75 53.52 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 126.126 1.771 . . . . 0.0 112.093 171.037 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -67.51 -59.83 3.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 120.112 1.324 . . . . 0.0 111.967 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -56.55 -48.83 76.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 110.853 175.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.711 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.301 0.1 OUTLIER -56.61 -26.11 54.83 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 118.547 -0.739 . . . . 0.0 112.691 175.735 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -54.75 9.51 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.996 1.718 . . . . 0.0 112.64 178.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -71.63 -14.55 62.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.837 0.855 . . . . 0.0 112.935 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.9 t -83.63 -38.51 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 126.1 1.76 . . . . 0.0 111.816 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.446 -0.664 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.173 175.579 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.222 -0.365 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.54 82.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.13 0.877 . . . . 0.0 112.835 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 t -71.59 -51.46 23.22 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 122.871 0.468 . . . . 0.0 111.398 175.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.73 -31.59 72.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.901 0.88 . . . . 0.0 111.938 178.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.709 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -52.33 -30.63 29.41 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 126.27 1.828 . . . . 0.0 111.84 169.108 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -64.92 -64.26 0.91 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.994 1.27 . . . . 0.0 110.986 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.418 ' O ' HG23 ' A' ' 31' ' ' VAL . 68.1 t80 -54.0 -48.36 70.51 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.615 0.766 . . . . 0.0 110.969 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.709 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.283 0.1 OUTLIER -57.69 -27.4 62.87 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.329 177.044 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -68.42 -55.21 12.67 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.707 1.603 . . . . 0.0 111.345 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.36 -10.93 60.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 27' ' ' TYR . 76.9 t -88.02 -35.6 8.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 125.823 1.649 . . . . 0.0 111.624 170.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.7 p . . . . . 0 N--CA 1.464 0.266 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 177.024 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 . . . . . 0 C--O 1.226 -0.156 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.01 92.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.782 0.833 . . . . 0.0 112.402 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -48.41 75.22 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.342 0.519 . . . . 0.0 111.641 174.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -34.02 77.06 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.614 0.765 . . . . 0.0 111.5 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.737 ' HA ' HD23 ' A' ' 28' ' ' LEU . 28.5 ttm-85 -56.4 -32.82 65.18 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 125.28 1.432 . . . . 0.0 112.495 168.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -59.33 -60.79 3.3 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.994 1.27 . . . . 0.0 111.11 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -54.57 -48.88 71.53 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.452 0.701 . . . . 0.0 111.102 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.737 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.276 0.1 OUTLIER -58.55 -21.89 54.04 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 176.201 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -74.98 -54.77 6.61 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.651 1.58 . . . . 0.0 112.179 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -68.44 -18.59 64.45 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.166 -0.959 . . . . 0.0 112.415 176.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.6 t -84.25 -28.26 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.2 1.8 . . . . 0.0 113.729 172.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.4 p . . . . . 0 CA--C 1.51 -0.595 0 CA-C-O 117.629 -1.176 . . . . 0.0 111.709 172.399 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 . . . . . 0 C--O 1.222 -0.381 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.14 -37.86 81.36 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.646 1.578 . . . . 0.0 112.623 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -69.9 -50.78 38.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.975 0.51 . . . . 0.0 111.423 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -36.6 77.07 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.334 0.516 . . . . 0.0 111.705 175.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.771 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.43 -35.24 62.75 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.74 1.616 . . . . 0.0 111.778 171.551 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -59.8 -57.98 10.55 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 119.834 1.197 . . . . 0.0 111.825 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -56.66 -49.65 74.42 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.04 0.536 . . . . 0.0 110.579 174.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.771 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.293 0.1 OUTLIER -55.55 -27.97 52.09 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.2 176.946 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -68.93 -56.94 6.3 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 127.057 2.143 . . . . 0.0 112.242 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.63 -17.63 63.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.71 0.804 . . . . 0.0 112.37 178.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -78.49 -41.58 25.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 126.1 1.76 . . . . 0.0 111.444 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 p . . . . . 0 N--CA 1.466 0.356 0 C-N-CA 124.416 1.086 . . . . 0.0 113.27 178.378 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.67 64.01 4.75 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 124.552 3.501 . . . . 0.0 112.013 176.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.54 120.73 2.83 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 125.627 1.571 . . . . 0.0 110.541 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 mttp 162.04 -57.57 0.0 OUTLIER Pre-proline 0 N--CA 1.482 1.159 0 C-N-CA 129.384 3.073 . . . . 0.0 112.776 -172.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -75.86 72.0 5.33 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.875 2.384 . . . . 0.0 111.013 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -79.1 65.89 4.4 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.549 1.14 . . . . 0.0 111.365 177.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -160.0 155.43 22.01 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.063 0.945 . . . . 0.0 112.009 176.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -73.97 124.65 9.29 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.118 2.545 . . . . 0.0 111.279 175.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.63 -67.39 0.08 OUTLIER Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.998 1.285 . . . . 0.0 110.404 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -151.78 116.26 5.07 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.395 1.078 . . . . 0.0 111.355 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -118.57 88.15 2.87 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 126.913 2.085 . . . . 0.0 110.486 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.95 ' HB1' HD21 ' A' ' 17' ' ' LEU . . . -149.36 152.56 36.0 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.508 ' O ' HD23 ' A' ' 17' ' ' LEU . 1.4 t -101.54 145.84 31.17 Favored Pre-proline 0 N--CA 1.473 0.724 0 C-N-CA 122.987 0.515 . . . . 0.0 110.345 178.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.417 ' HA ' ' HB2' ' A' ' 18' ' ' SER . 58.2 Cg_endo -71.73 -171.31 0.63 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.691 1.594 . . . . 0.0 111.191 174.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 79.84 102.24 0.06 Allowed 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.58 1.552 . . . . 0.0 108.609 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 75.18 -49.5 0.64 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.827 1.651 . . . . 0.0 112.415 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.95 HD21 ' HB1' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -63.22 -63.62 1.14 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.63 1.172 . . . . 0.0 110.486 174.48 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.417 ' HB2' ' HA ' ' A' ' 14' ' ' PRO . 0.1 OUTLIER -63.34 -15.25 56.82 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.583 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -28.12 67.95 Favored 'General case' 0 C--O 1.215 -0.723 0 C-N-CA 124.705 1.202 . . . . 0.0 112.036 172.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -71.2 -52.89 16.58 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.221 0.608 . . . . 0.0 109.969 172.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -63.46 -48.37 78.0 Favored 'General case' 0 C--O 1.214 -0.811 0 C-N-CA 123.415 0.686 . . . . 0.0 111.532 -178.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.65 -43.21 99.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.666 1.187 . . . . 0.0 112.404 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -65.93 -51.01 62.35 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 124.166 0.986 . . . . 0.0 111.325 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.9 tp -60.94 -37.09 81.12 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.406 0.682 . . . . 0.0 111.077 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.8 ' HA ' HD23 ' A' ' 28' ' ' LEU . 33.5 ttp180 -58.6 -34.16 70.81 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 125.77 1.628 . . . . 0.0 111.831 173.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -58.48 -59.63 5.07 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.492 1.042 . . . . 0.0 111.068 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -55.27 -48.94 73.28 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.373 0.669 . . . . 0.0 111.092 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.8 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.272 0.1 OUTLIER -59.26 -20.34 53.42 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 175.929 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.79 -55.18 5.72 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.711 -1.868 . . . . 0.0 111.16 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.25 -17.76 64.38 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.4 t -83.08 -36.12 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.789 1.636 . . . . 0.0 112.937 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p -70.55 -46.83 62.81 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 117.821 -1.085 . . . . 0.0 110.823 175.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -44.55 -41.97 6.89 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.522 1.129 . . . . 0.0 113.708 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -47.53 -37.82 12.9 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.1 1.36 . . . . 0.0 113.151 175.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.18 67.08 1.33 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.323 1.849 . . . . 0.0 111.192 172.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -112.05 57.58 0.64 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 123.136 1.446 . . . . 0.0 109.905 175.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.648 0 O-C-N 118.825 -2.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 117.496 -1.24 . . . . 0.0 111.391 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -74.52 -176.51 2.8 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.072 1.848 . . . . 0.0 111.108 174.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.83 -25.67 65.18 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.23 1.012 . . . . 0.0 113.078 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.87 157.37 13.99 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 126.565 1.946 . . . . 0.0 110.878 174.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -75.23 -177.33 3.44 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 124.161 3.24 . . . . 0.0 112.484 174.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -107.7 76.68 1.08 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.109 1.364 . . . . 0.0 110.922 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -162.19 92.2 1.33 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.82 0.848 . . . . 0.0 110.002 172.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -70.48 164.15 36.27 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 121.32 1.347 . . . . 0.0 111.495 175.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 139.87 -123.35 2.43 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.04 1.305 . . . . 0.0 110.917 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -147.09 110.53 4.88 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.044 0.938 . . . . 0.0 111.305 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -129.83 84.39 2.21 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 124.88 1.272 . . . . 0.0 109.745 179.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.9 79.33 0.89 Allowed 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.159 -0.963 . . . . 0.0 111.423 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.4 t -100.28 141.89 23.59 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.945 1.298 . . . . 0.0 111.346 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -70.21 -179.02 2.81 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.237 2.625 . . . . 0.0 111.924 174.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 64.72 16.5 10.43 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.741 1.216 . . . . 0.0 113.406 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -157.6 -52.46 0.07 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.97 1.708 . . . . 0.0 110.689 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.463 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -57.91 -62.85 1.51 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 119.29 0.95 . . . . 0.0 111.422 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.8 t -66.87 -17.97 65.15 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.771 -0.58 . . . . 0.0 111.766 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.64 -36.75 77.0 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.355 1.462 . . . . 0.0 111.562 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -67.0 -48.39 68.59 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.472 0.709 . . . . 0.0 110.766 173.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -60.49 -47.54 85.68 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 124.218 1.007 . . . . 0.0 111.399 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.67 85.56 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.693 1.197 . . . . 0.0 112.303 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 t -71.92 -50.2 31.16 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 123.053 0.541 . . . . 0.0 111.325 174.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.3 tp -56.99 -37.9 72.31 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.934 0.893 . . . . 0.0 111.171 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.698 ' HA ' HD23 ' A' ' 28' ' ' LEU . 1.4 tmt_? -54.95 -36.46 65.34 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 125.772 1.629 . . . . 0.0 111.9 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -60.23 -55.57 32.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.171 1.351 . . . . 0.0 111.477 -178.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -57.01 -50.18 73.51 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.104 0.561 . . . . 0.0 110.643 174.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.698 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.277 0.1 OUTLIER -58.4 -21.1 49.37 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 175.511 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -76.2 -56.54 4.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.036 1.734 . . . . 0.0 110.982 176.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 pp -67.04 -19.35 65.67 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 176.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.0 t -82.48 -31.27 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.098 1.759 . . . . 0.0 112.908 173.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.1 p -79.71 -39.34 31.4 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.196 -0.94 . . . . 0.0 112.035 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -55.15 -39.85 69.93 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 118.499 0.591 . . . . 0.0 112.53 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -79.67 10.82 3.6 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.411 1.484 . . . . 0.0 114.116 174.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -127.3 -56.37 1.33 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.505 1.522 . . . . 0.0 111.165 -176.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -84.52 12.84 6.27 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.137 2.575 . . . . 0.0 112.903 177.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.593 0 O-C-N 118.846 -2.409 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 9.3 t80 . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.63 78.5 2.4 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.326 2.017 . . . . 0.0 109.281 176.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.64 160.08 5.94 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.54 170.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.59 84.25 0.18 Allowed Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.826 1.65 . . . . 0.0 110.774 -175.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -70.92 89.49 0.65 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.519 2.813 . . . . 0.0 111.056 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -114.96 153.99 29.57 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 126.352 1.861 . . . . 0.0 110.279 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.57 162.49 0.09 OUTLIER Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 125.979 1.711 . . . . 0.0 114.421 -170.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -76.96 84.63 1.9 Allowed 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.056 2.504 . . . . 0.0 111.487 177.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -168.71 48.48 0.22 Allowed Glycine 0 CA--C 1.529 0.923 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.696 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -69.79 41.2 0.05 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 126.119 1.768 . . . . 0.0 113.617 176.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -107.31 85.16 2.08 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 122.825 1.297 . . . . 0.0 110.736 -175.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.01 71.64 1.43 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.158 1.383 . . . . 0.0 109.881 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -113.34 83.82 6.99 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 124.493 1.117 . . . . 0.0 109.84 176.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -73.87 45.92 1.2 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.588 3.526 . . . . 0.0 112.757 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -83.51 3.97 29.99 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.837 2.055 . . . . 0.0 113.439 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -134.01 -45.37 0.79 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.743 1.217 . . . . 0.0 112.703 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.499 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -65.33 -60.96 2.42 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.704 0.802 . . . . 0.0 109.051 179.49 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -17.96 62.17 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-O 117.754 -1.117 . . . . 0.0 110.858 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -58.09 -34.14 69.84 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 125.014 1.326 . . . . 0.0 112.117 172.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -68.1 -46.62 70.44 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.497 0.719 . . . . 0.0 110.957 174.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -45.76 64.43 Favored 'General case' 0 C--O 1.216 -0.688 0 C-N-CA 124.307 1.043 . . . . 0.0 111.64 -179.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.12 -40.09 96.59 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.166 2.187 . . . . 0.0 112.379 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 t -69.87 -51.7 31.04 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 123.318 0.386 . . . . 0.0 110.881 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.49 -34.41 72.54 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.841 -0.537 . . . . 0.0 112.194 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.793 ' HA ' HD23 ' A' ' 28' ' ' LEU . 8.4 ttm180 -57.4 -31.67 66.07 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 125.62 1.568 . . . . 0.0 111.973 172.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -58.96 -60.07 4.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 120.317 1.417 . . . . 0.0 111.112 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -54.81 -49.18 71.64 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.362 0.665 . . . . 0.0 111.271 174.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.299 0.1 OUTLIER -57.18 -28.62 62.97 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 121.67 -0.643 . . . . 0.0 112.554 175.947 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -67.83 -60.1 2.78 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 126.142 1.777 . . . . 0.0 110.35 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.55 -11.82 58.93 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 118.472 -0.775 . . . . 0.0 113.024 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -84.85 -40.16 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.152 1.381 . . . . 0.0 111.66 171.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.3 p -61.48 -54.13 47.39 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 123.496 0.718 . . . . 0.0 111.281 175.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.68 30.02 0.37 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.409 1.084 . . . . 0.0 113.29 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.68 -45.84 1.75 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 125.542 1.537 . . . . 0.0 111.952 178.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -128.52 46.5 2.59 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 122.107 0.956 . . . . 0.0 112.095 -177.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -89.66 -55.04 3.8 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.662 1.185 . . . . 0.0 112.668 178.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 O-C-N 120.301 -1.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 119.259 -0.401 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -72.52 129.77 15.17 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.305 2.004 . . . . 0.0 110.842 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -68.61 97.18 0.77 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.181 1.392 . . . . 0.0 110.883 177.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.36 160.8 30.56 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 124.089 0.955 . . . . 0.0 111.523 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -74.34 131.79 15.56 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.449 2.1 . . . . 0.0 110.561 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -165.89 156.87 13.46 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.63 1.572 . . . . 0.0 108.987 173.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.55 164.26 0.1 OUTLIER Pre-proline 0 CA--C 1.556 1.188 0 C-N-CA 126.945 2.098 . . . . 0.0 113.053 -173.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -71.9 -176.86 2.26 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 121.897 1.731 . . . . 0.0 111.789 172.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -56.0 162.92 5.61 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 123.275 0.464 . . . . 0.0 112.979 172.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -159.1 128.47 5.49 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.835 0.854 . . . . 0.0 109.442 -177.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -91.64 90.85 7.75 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.716 1.206 . . . . 0.0 109.316 170.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -113.65 -179.1 3.54 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.726 1.211 . . . . 0.0 111.492 173.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.1 t -50.81 143.57 14.73 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.619 1.168 . . . . 0.0 111.905 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -72.67 71.38 3.27 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 123.733 2.955 . . . . 0.0 112.1 -176.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -124.42 18.37 8.94 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.752 1.621 . . . . 0.0 112.41 -175.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -164.7 -60.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.792 1.637 . . . . 0.0 109.925 175.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.512 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -54.11 -64.37 0.85 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.237 1.015 . . . . 0.0 110.843 -178.653 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.14 -21.68 65.82 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.453 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.39 -29.95 69.27 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 125.549 1.54 . . . . 0.0 112.27 175.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -71.32 -52.26 19.79 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.902 1.281 . . . . 0.0 110.051 172.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -61.76 -44.3 97.15 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 124.846 1.258 . . . . 0.0 112.607 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.95 -28.04 69.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.714 1.206 . . . . 0.0 113.069 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.98 -47.02 19.49 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.873 0.869 . . . . 0.0 111.189 172.059 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.15 -32.22 73.71 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 0.0 112.539 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.682 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -53.15 -28.28 25.28 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.492 1.517 . . . . 0.0 112.325 169.538 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -68.07 -63.05 1.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.836 1.198 . . . . 0.0 111.242 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.405 ' O ' HG23 ' A' ' 31' ' ' VAL . 66.3 t80 -54.42 -48.47 71.62 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.23 0.612 . . . . 0.0 110.752 176.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.291 0.1 OUTLIER -57.91 -23.94 55.58 Favored 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 176.411 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -74.32 -51.13 16.11 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.911 1.684 . . . . 0.0 112.11 175.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 -8.18 55.4 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 27' ' ' TYR . 55.6 t -89.16 -38.85 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 126.14 1.776 . . . . 0.0 111.84 171.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p -69.91 -35.85 74.92 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.404 1.082 . . . . 0.0 113.823 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -24.24 2.93 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.822 1.249 . . . . 0.0 113.99 172.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -119.97 33.21 5.7 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.839 2.056 . . . . 0.0 110.536 179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -146.74 -54.5 0.24 Allowed 'General case' 0 C--N 1.343 0.304 0 C-N-CA 124.861 1.264 . . . . 0.0 112.348 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.84 27.44 0.75 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.072 2.149 . . . . 0.0 112.535 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.532 0 O-C-N 118.884 -2.385 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 116.803 -1.57 . . . . 0.0 111.783 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -68.44 176.55 5.58 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.458 2.106 . . . . 0.0 112.011 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.57 162.31 1.69 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.862 0.865 . . . . 0.0 111.557 170.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.41 157.23 31.61 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.482 0.713 . . . . 0.0 110.397 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -74.57 75.59 3.45 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 123.484 2.789 . . . . 0.0 110.517 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -70.01 113.71 7.48 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.696 0.798 . . . . 0.0 109.327 175.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.42 74.29 8.22 Favored Pre-proline 0 C--O 1.244 0.787 0 C-N-CA 124.693 1.197 . . . . 0.0 109.876 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.81 126.71 15.77 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.896 2.398 . . . . 0.0 109.314 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.5 -93.11 0.07 OUTLIER Glycine 0 CA--C 1.53 0.989 0 C-N-CA 123.731 0.681 . . . . 0.0 112.366 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -157.09 111.64 2.73 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.573 0.749 . . . . 0.0 110.458 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.95 96.59 4.8 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.53 1.532 . . . . 0.0 109.034 -178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -157.92 78.46 0.83 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.376 1.07 . . . . 0.0 109.351 178.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 t -64.69 146.37 98.44 Favored Pre-proline 0 CA--C 1.547 0.86 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.34 178.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -76.78 125.46 8.15 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 122.561 2.174 . . . . 0.0 111.038 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -171.17 95.12 0.18 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.82 2.048 . . . . 0.0 106.906 -176.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 75.47 -44.88 0.53 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.756 0.823 . . . . 0.0 112.212 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 17' ' ' LEU . 0.3 OUTLIER -51.52 -55.78 17.07 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.534 1.534 . . . . 0.0 109.85 174.538 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.5 p -57.61 -32.53 67.3 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.286 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -20.31 64.18 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.853 1.261 . . . . 0.0 112.785 175.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -82.29 -49.1 10.43 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.097 1.359 . . . . 0.0 108.736 174.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -70.28 -45.19 66.84 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 123.942 0.897 . . . . 0.0 112.335 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.85 -37.1 85.51 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.164 1.786 . . . . 0.0 111.445 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t -72.82 -48.28 39.26 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 124.001 0.92 . . . . 0.0 111.041 174.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.84 -32.06 73.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.191 0.596 . . . . 0.0 111.297 177.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.813 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.77 -24.79 67.9 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.333 1.853 . . . . 0.0 112.042 173.599 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -67.31 -59.2 3.61 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.674 1.125 . . . . 0.0 110.923 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.4 ' O ' HG23 ' A' ' 31' ' ' VAL . 53.6 t80 -54.78 -49.78 70.08 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.549 0.74 . . . . 0.0 110.496 173.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.813 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.284 0.1 OUTLIER -57.91 -23.72 54.61 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.45 177.139 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -75.72 -48.07 23.44 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.116 1.766 . . . . 0.0 112.453 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -76.26 -6.39 51.22 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.66 -0.65 . . . . 0.0 112.689 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 27' ' ' TYR . 75.1 t -95.06 -29.14 4.05 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 126.988 2.115 . . . . 0.0 112.799 172.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -76.03 -38.22 57.47 Favored 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 120.918 -1.114 . . . . 0.0 112.224 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.13 -23.43 1.25 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 175.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -62.28 -64.54 0.9 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.644 1.578 . . . . 0.0 110.446 174.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.49 -30.05 67.83 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.18 0.592 . . . . 0.0 112.501 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -104.28 40.53 1.45 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.397 2.279 . . . . 0.0 110.534 -174.636 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.594 0 O-C-N 120.409 -1.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 N--CA 1.476 0.842 0 CA-C-O 117.464 -1.255 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.93 58.01 4.7 Favored 'Trans proline' 0 CA--C 1.547 1.157 0 C-N-CA 122.752 2.301 . . . . 0.0 111.731 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.69 139.58 48.18 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.934 1.694 . . . . 0.0 109.691 177.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -60.75 -53.88 59.98 Favored Pre-proline 0 CA--C 1.542 0.646 0 CA-C-O 118.093 -0.956 . . . . 0.0 112.466 171.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -77.44 88.25 1.43 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.982 2.455 . . . . 0.0 111.074 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -161.7 104.68 1.21 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.742 0.817 . . . . 0.0 109.459 175.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.37 161.63 37.89 Favored Pre-proline 0 CA--C 1.54 0.559 0 O-C-N 121.11 -0.994 . . . . 0.0 110.744 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -78.8 173.56 13.43 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.456 2.771 . . . . 0.0 112.244 172.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.4 -144.95 16.08 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.431 1.015 . . . . 0.0 110.789 -173.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 44.5 72.09 0.22 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.427 1.891 . . . . 0.0 113.178 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.6 t0 46.2 63.82 1.72 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.094 0.958 . . . . 0.0 111.447 -177.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.87 167.84 7.09 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.938 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.05 156.51 3.55 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 124.42 1.088 . . . . 0.0 112.102 176.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.53 -170.0 0.35 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.463 2.775 . . . . 0.0 111.132 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 78.78 89.04 0.06 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.585 1.954 . . . . 0.0 109.645 -177.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 54.8 35.94 25.3 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -178.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -53.32 -65.07 0.63 Allowed 'General case' 0 C--N 1.348 0.512 0 O-C-N 120.208 -1.558 . . . . 0.0 110.574 -178.921 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.94 -22.99 67.17 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 117.924 -1.036 . . . . 0.0 110.043 -177.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -32.82 70.48 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 125.273 1.429 . . . . 0.0 112.183 176.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -66.98 -45.58 77.24 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.5 0.72 . . . . 0.0 110.682 172.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -71.5 -47.74 53.43 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 124.7 1.2 . . . . 0.0 112.664 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.2 89.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.169 1.788 . . . . 0.0 112.099 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.5 t -67.88 -52.0 41.55 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.984 0.356 . . . . 0.0 111.244 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -36.46 73.53 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.708 -0.62 . . . . 0.0 112.02 176.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.696 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -53.89 -28.51 36.95 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.277 1.831 . . . . 0.0 112.663 171.461 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -67.32 -62.06 1.61 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.785 1.175 . . . . 0.0 111.115 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.46 -48.34 74.67 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 123.131 0.572 . . . . 0.0 110.876 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.696 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.308 0.1 OUTLIER -57.08 -27.12 61.46 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 176.248 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.02 -60.42 2.51 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.471 1.508 . . . . 0.0 111.063 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.4 -19.24 65.75 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.634 0.774 . . . . 0.0 112.756 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 72.5 t -78.27 -40.29 25.26 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 126.354 1.862 . . . . 0.0 111.628 169.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p -65.95 -44.68 84.32 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 118.066 -0.969 . . . . 0.0 112.945 176.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.3 mtp85 -44.23 -39.38 4.39 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.271 1.428 . . . . 0.0 113.478 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.6 mm-40 -52.87 -43.2 65.93 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.479 1.112 . . . . 0.0 113.363 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.25 53.41 2.0 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.242 1.417 . . . . 0.0 112.131 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -92.87 -51.52 5.04 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.039 1.336 . . . . 0.0 110.801 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 O-C-N 118.701 -2.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.549 0.927 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.89 151.07 68.21 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 120.979 1.119 . . . . 0.0 111.134 -179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.84 78.42 1.74 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.656 1.182 . . . . 0.0 109.686 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.99 153.58 81.03 Favored Pre-proline 0 N--CA 1.468 0.471 0 C-N-CA 124.231 1.013 . . . . 0.0 110.42 -178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -69.26 173.76 10.06 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.72 2.28 . . . . 0.0 111.439 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.08 111.83 0.54 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.112 0.965 . . . . 0.0 112.495 176.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.28 149.91 36.49 Favored Pre-proline 0 CA--C 1.539 0.551 0 O-C-N 121.528 -0.733 . . . . 0.0 110.679 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -70.92 165.12 33.31 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.517 2.145 . . . . 0.0 111.423 175.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.79 155.43 16.82 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.222 0.915 . . . . 0.0 111.666 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -164.28 76.62 0.34 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.49 0.716 . . . . 0.0 111.152 -178.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.4 t0 48.5 82.98 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.414 1.485 . . . . 0.0 113.903 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -146.41 143.83 29.3 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.397 -0.814 . . . . 0.0 110.693 177.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.5 146.69 72.0 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.777 0.831 . . . . 0.0 111.198 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -72.87 118.67 5.67 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.61 2.207 . . . . 0.0 111.863 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -130.11 72.07 1.47 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.632 1.973 . . . . 0.0 108.936 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 67.18 -4.51 0.83 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.238 1.415 . . . . 0.0 113.316 -178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.488 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -60.89 -60.31 3.99 Favored 'General case' 0 C--N 1.343 0.294 0 O-C-N 120.416 -1.428 . . . . 0.0 110.343 174.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.84 -18.98 62.02 Favored 'General case' 0 C--O 1.217 -0.639 0 O-C-N 122.08 -0.388 . . . . 0.0 110.836 -179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -24.16 65.07 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.438 1.095 . . . . 0.0 112.743 173.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -76.32 -47.76 22.42 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.415 1.086 . . . . 0.0 110.506 172.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -72.41 -46.76 53.73 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.478 1.111 . . . . 0.0 112.167 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.99 -30.85 71.91 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.637 1.975 . . . . 0.0 112.129 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -43.42 62.91 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.231 0.612 . . . . 0.0 110.742 170.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.88 -33.72 76.68 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.266 -0.397 . . . . 0.0 112.011 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.686 ' HA ' HD23 ' A' ' 28' ' ' LEU . 6.2 tpm_? -48.2 -36.09 13.06 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.952 1.701 . . . . 0.0 111.803 176.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -64.1 -59.78 4.03 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.317 1.847 . . . . 0.0 112.174 177.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -55.4 -50.21 70.35 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.12 0.568 . . . . 0.0 110.513 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.686 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.264 0.0 OUTLIER -59.64 -18.69 43.79 Favored 'General case' 0 CA--C 1.556 1.198 0 O-C-N 121.583 -0.698 . . . . 0.0 112.4 175.929 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -77.75 -52.79 8.37 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.1 1.76 . . . . 0.0 112.743 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.96 -16.83 62.67 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.34 -0.85 . . . . 0.0 113.062 176.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.7 t -81.9 -39.65 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 126.433 1.893 . . . . 0.0 112.372 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 28' ' ' LEU . 24.0 p -68.66 -43.08 76.96 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 117.524 -1.226 . . . . 0.0 111.388 176.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.2 ttt-85 -45.36 -44.97 12.22 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.453 1.101 . . . . 0.0 112.231 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -50.95 -43.97 60.42 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.713 1.605 . . . . 0.0 112.462 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.36 47.45 2.19 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.471 1.908 . . . . 0.0 111.98 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -88.65 50.36 1.95 Allowed 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 123.74 1.733 . . . . 0.0 111.361 -178.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.435 0 O-C-N 118.741 -2.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 . . . . . 0 N--CA 1.475 0.805 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -73.96 168.62 24.35 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 121.855 1.703 . . . . 0.0 110.943 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -144.03 140.02 29.31 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.098 1.759 . . . . 0.0 106.798 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -51.51 79.22 Favored Pre-proline 0 N--CA 1.47 0.538 0 CA-C-O 117.419 -1.277 . . . . 0.0 112.9 169.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -75.99 167.17 26.62 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.563 2.175 . . . . 0.0 110.813 172.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 60.18 178.74 0.09 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.534 1.534 . . . . 0.0 112.331 -171.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 55.06 74.73 0.69 Allowed Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 124.403 1.081 . . . . 0.0 112.313 -178.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.14 173.62 10.15 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.617 2.212 . . . . 0.0 112.233 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.59 82.58 0.09 OUTLIER Glycine 0 C--N 1.34 0.78 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.179 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.19 32.04 0.08 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.136 1.375 . . . . 0.0 114.132 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.08 80.4 9.19 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.905 1.682 . . . . 0.0 109.976 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.86 59.1 3.05 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.186 -0.946 . . . . 0.0 111.33 174.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.49 84.95 61.25 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 124.456 1.103 . . . . 0.0 110.377 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -73.62 54.69 3.02 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 124.415 3.41 . . . . 0.0 112.3 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -128.4 8.97 6.03 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.346 1.458 . . . . 0.0 111.81 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -154.25 -39.5 0.09 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.527 1.131 . . . . 0.0 112.225 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.495 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -62.8 -62.0 2.03 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 119.242 0.928 . . . . 0.0 110.395 173.891 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.07 -18.9 50.13 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -177.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -32.7 68.83 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 126.19 1.796 . . . . 0.0 112.186 173.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -70.4 -48.54 55.65 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.981 1.312 . . . . 0.0 109.472 174.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -63.26 -46.64 85.92 Favored 'General case' 0 C--O 1.22 -0.454 0 C-N-CA 124.936 1.294 . . . . 0.0 112.181 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.54 -33.17 71.07 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.842 1.257 . . . . 0.0 112.628 173.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.54 -45.37 46.02 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.199 0.454 . . . . 0.0 111.229 173.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -65.07 -28.96 69.83 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.81 0.844 . . . . 0.0 112.518 177.338 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.706 ' HA ' HD23 ' A' ' 28' ' ' LEU . 25.3 tpt180 -50.05 -37.27 32.53 Favored 'General case' 0 C--O 1.207 -1.168 0 C-N-CA 125.247 1.419 . . . . 0.0 111.471 171.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -61.39 -59.27 5.53 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.881 0.872 . . . . 0.0 111.816 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.43 -49.09 73.32 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 123.4 0.68 . . . . 0.0 111.08 174.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.269 0.0 OUTLIER -60.65 -17.38 47.01 Favored 'General case' 0 CA--C 1.563 1.463 0 O-C-N 121.177 -0.952 . . . . 0.0 112.906 175.665 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.14 -54.03 6.71 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.435 -2.041 . . . . 0.0 111.408 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 pp -71.12 -14.84 62.43 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 176.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.1 t -84.64 -38.44 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.482 1.513 . . . . 0.0 112.171 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.428 HG23 HD12 ' A' ' 28' ' ' LEU . 14.6 p -67.25 -47.96 69.19 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 116.682 -1.628 . . . . 0.0 110.913 175.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -40.12 -47.06 2.3 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 120.22 1.373 . . . . 0.0 113.348 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.6 tm0? -49.63 -44.39 47.44 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.855 1.662 . . . . 0.0 112.551 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.7 mmm180 -135.23 54.55 1.93 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.148 1.779 . . . . 0.0 111.676 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -85.31 -51.55 6.5 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 122.171 0.986 . . . . 0.0 110.378 -177.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.591 0 O-C-N 120.059 -1.65 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 119.406 -0.331 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.62 0.81 8.72 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.091 2.527 . . . . 0.0 114.486 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.85 -93.01 0.07 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.704 1.601 . . . . 0.0 111.133 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.8 mttt -126.31 162.77 44.29 Favored Pre-proline 0 N--CA 1.468 0.467 0 C-N-CA 125.577 1.551 . . . . 0.0 110.805 178.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -69.72 152.89 69.61 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.316 2.011 . . . . 0.0 110.659 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -67.85 162.58 23.78 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.489 0.662 . . . . 0.0 110.785 175.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -116.11 86.69 17.51 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 124.48 1.112 . . . . 0.0 109.23 178.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -69.78 158.32 57.32 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.095 1.863 . . . . 0.0 111.094 177.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.8 176.16 46.38 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.094 173.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -158.05 131.9 7.91 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.869 0.867 . . . . 0.0 108.973 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -126.24 93.65 3.87 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.2 1.4 . . . . 0.0 109.09 178.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.48 163.34 33.0 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.287 0.635 . . . . 0.0 109.867 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 40.3 t -56.44 145.65 57.8 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 123.914 0.886 . . . . 0.0 111.231 175.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.77 69.2 3.69 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.004 3.136 . . . . 0.0 112.183 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -121.85 10.47 10.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.253 1.421 . . . . 0.0 112.493 -177.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -168.36 -52.27 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.036 1.734 . . . . 0.0 111.039 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.526 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.66 -63.17 1.4 Allowed 'General case' 0 C--N 1.344 0.338 0 CA-C-N 119.211 0.914 . . . . 0.0 110.137 177.301 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.5 t -63.33 -17.82 62.97 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 121.799 -0.563 . . . . 0.0 110.915 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -26.36 67.25 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.814 1.246 . . . . 0.0 112.59 172.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -75.35 -49.25 19.69 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.019 0.928 . . . . 0.0 109.77 172.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -66.4 -50.43 63.48 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 125.005 1.322 . . . . 0.0 112.009 -178.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.37 -36.49 80.37 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.44 2.296 . . . . 0.0 112.491 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.4 t -68.08 -54.64 16.75 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.2 1.0 . . . . 0.0 110.89 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -34.44 75.26 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.971 0.508 . . . . 0.0 111.309 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.815 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.59 -35.5 63.42 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 125.995 1.718 . . . . 0.0 112.166 171.115 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -61.0 -56.64 18.74 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.036 1.289 . . . . 0.0 111.758 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -56.2 -50.44 71.22 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 123.576 0.75 . . . . 0.0 110.347 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.279 0.1 OUTLIER -57.47 -23.01 47.34 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 119.065 -0.493 . . . . 0.0 112.218 176.028 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.66 -49.19 16.77 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.32 1.848 . . . . 0.0 112.5 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -75.46 -12.58 60.27 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.55 -35.31 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 126.017 1.727 . . . . 0.0 112.402 172.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 p -69.23 -44.96 70.95 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-O 117.52 -1.228 . . . . 0.0 111.556 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -44.1 -41.48 5.62 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.312 1.445 . . . . 0.0 114.213 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -50.7 -32.59 19.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.49 1.516 . . . . 0.0 112.97 174.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -154.73 67.87 0.7 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.338 2.255 . . . . 0.0 111.513 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -107.71 50.53 0.77 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 122.982 1.373 . . . . 0.0 111.993 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.606 0 O-C-N 119.261 -2.15 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 118.374 -0.822 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -71.89 -166.67 0.27 Allowed 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.122 2.548 . . . . 0.0 111.697 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -39.62 119.69 1.0 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.353 1.461 . . . . 0.0 111.613 175.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -51.91 77.74 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-O 117.632 -1.175 . . . . 0.0 112.194 175.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -76.23 59.92 6.15 Favored 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.291 2.661 . . . . 0.0 111.947 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -151.88 40.84 0.65 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.542 1.537 . . . . 0.0 111.302 177.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -127.86 76.2 77.59 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.402 1.081 . . . . 0.0 109.817 174.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -74.52 165.17 32.28 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.503 2.135 . . . . 0.0 111.453 174.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.21 -176.23 39.62 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.861 1.22 . . . . 0.0 110.882 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -74.31 36.99 0.1 Allowed 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -83.68 82.4 8.33 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.328 1.451 . . . . 0.0 110.34 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.53 112.5 13.14 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 121.593 -0.692 . . . . 0.0 110.239 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 t -124.44 143.59 43.54 Favored Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 123.791 0.836 . . . . 0.0 110.836 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -69.38 178.18 4.59 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.758 2.305 . . . . 0.0 111.647 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 63.82 23.5 13.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.019 1.328 . . . . 0.0 114.265 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -167.43 -53.11 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.338 1.855 . . . . 0.0 110.381 -176.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.483 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -60.69 -65.49 0.68 Allowed 'General case' 0 C--N 1.346 0.432 0 CA-C-N 119.527 1.058 . . . . 0.0 110.52 177.477 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.79 -16.83 63.57 Favored 'General case' 0 C--O 1.218 -0.557 0 O-C-N 121.876 -0.515 . . . . 0.0 110.539 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -27.7 66.99 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.121 1.368 . . . . 0.0 112.059 173.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -72.05 -49.26 38.18 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.157 0.983 . . . . 0.0 110.633 173.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -72.33 -44.19 63.03 Favored 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 124.576 1.15 . . . . 0.0 112.351 -177.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.94 -41.22 95.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.993 2.117 . . . . 0.0 112.125 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -47.43 67.85 Favored 'General case' 0 C--N 1.343 0.304 0 O-C-N 122.126 -0.359 . . . . 0.0 111.299 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.2 tp -60.48 -34.94 74.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.872 -0.518 . . . . 0.0 111.663 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.668 ' HA ' HD23 ' A' ' 28' ' ' LEU . 67.9 ttt180 -60.17 -17.5 41.34 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.087 2.155 . . . . 0.0 113.188 173.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -75.85 -59.02 2.94 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.316 0.962 . . . . 0.0 111.402 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.25 -49.15 76.96 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 122.886 0.474 . . . . 0.0 110.538 175.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.668 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.266 0.1 OUTLIER -58.92 -18.67 35.5 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 175.652 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.12 -57.04 4.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.694 -1.879 . . . . 0.0 111.722 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.57 -15.13 63.16 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -84.22 -37.48 12.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 C-N-CA 126.554 1.942 . . . . 0.0 112.265 170.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 p -71.05 -41.4 70.81 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 117.87 -1.062 . . . . 0.0 111.339 177.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.62 -45.43 6.79 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 119.644 1.111 . . . . 0.0 113.8 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -47.55 -42.27 23.13 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.771 1.628 . . . . 0.0 112.908 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -136.47 54.53 1.88 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.759 1.623 . . . . 0.0 111.682 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -76.24 -50.28 14.88 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.08 0.943 . . . . 0.0 111.195 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.527 0 O-C-N 119.93 -1.731 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 117.972 -1.013 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -69.56 141.67 46.67 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.397 2.065 . . . . 0.0 110.942 175.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.89 -21.5 15.68 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 118.033 -0.984 . . . . 0.0 113.029 175.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -36.95 94.65 0.08 OUTLIER Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 128.466 2.706 . . . . 0.0 112.504 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -76.3 102.87 1.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 122.432 2.088 . . . . 0.0 111.074 -171.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -82.32 66.8 8.08 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.588 0.755 . . . . 0.0 111.085 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -160.28 82.7 2.18 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 123.349 0.66 . . . . 0.0 110.635 175.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -72.57 143.31 37.9 Favored 'Trans proline' 0 C--O 1.24 0.615 0 C-N-CA 122.451 2.101 . . . . 0.0 111.628 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.19 -106.68 3.01 Favored Glycine 0 C--O 1.22 -0.734 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -175.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -170.1 145.63 2.87 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.01 1.324 . . . . 0.0 108.035 175.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -109.96 -151.24 0.47 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.672 1.589 . . . . 0.0 108.604 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 85.92 47.33 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.944 2.898 . . . . 0.0 111.27 175.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.87 149.74 57.17 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 123.733 0.813 . . . . 0.0 111.836 -176.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -72.03 -171.52 0.7 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.664 2.909 . . . . 0.0 111.725 176.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 62.49 19.1 10.95 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.051 1.34 . . . . 0.0 113.605 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -168.05 -52.33 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 127.003 2.121 . . . . 0.0 110.662 -174.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.463 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -60.69 -62.42 1.88 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.696 1.134 . . . . 0.0 111.334 176.494 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -14.65 52.74 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.286 -0.884 . . . . 0.0 112.54 178.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -33.61 74.22 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.101 1.36 . . . . 0.0 111.71 173.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -67.59 -47.11 70.69 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.126 0.971 . . . . 0.0 110.476 173.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -62.38 -48.51 79.43 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.379 1.072 . . . . 0.0 110.939 178.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -35.35 79.41 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.59 1.156 . . . . 0.0 112.487 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -48.82 27.68 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.346 0.521 . . . . 0.0 112.122 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.31 -33.11 73.05 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.555 0.616 . . . . 0.0 111.349 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.688 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.74 -26.11 32.03 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 125.881 1.673 . . . . 0.0 113.153 169.132 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -68.97 -62.16 1.49 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 120.36 1.436 . . . . 0.0 111.706 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -55.8 -48.44 75.38 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.358 0.663 . . . . 0.0 110.629 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.688 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.287 0.1 OUTLIER -57.07 -27.05 61.37 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 176.343 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -68.53 -59.74 2.93 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.352 1.461 . . . . 0.0 111.003 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.89 -17.0 64.69 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.939 0.896 . . . . 0.0 113.048 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.1 t -81.77 -37.71 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 126.107 1.763 . . . . 0.0 111.962 169.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.8 p -66.75 -45.04 79.85 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 117.726 -1.13 . . . . 0.0 112.302 175.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 10.6 mtp180 -44.18 -39.79 4.6 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 125.078 1.351 . . . . 0.0 113.131 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.34 -38.16 27.15 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.09 1.756 . . . . 0.0 113.031 175.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -136.26 56.72 1.8 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.605 1.962 . . . . 0.0 111.299 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -109.74 54.2 0.67 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 123.198 1.475 . . . . 0.0 111.985 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.604 0 O-C-N 119.715 -1.866 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.2 62.14 5.96 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 124.15 3.234 . . . . 0.0 110.99 174.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.11 168.05 20.54 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.538 1.535 . . . . 0.0 109.824 175.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.0 ptpp? -55.89 151.42 24.18 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 123.919 0.887 . . . . 0.0 111.492 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -72.51 90.3 0.81 Allowed 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 123.171 2.581 . . . . 0.0 111.206 -178.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.01 82.64 2.77 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.978 1.311 . . . . 0.0 109.014 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -134.51 154.84 79.93 Favored Pre-proline 0 C--O 1.234 0.267 0 C-N-CA 123.987 0.915 . . . . 0.0 110.943 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -77.28 156.16 33.03 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.684 2.256 . . . . 0.0 112.041 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 70.5 156.73 1.89 Allowed Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.542 1.068 . . . . 0.0 112.847 -172.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -170.48 134.13 1.1 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.807 0.843 . . . . 0.0 109.914 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -129.69 73.8 1.55 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.659 1.184 . . . . 0.0 111.1 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.6 173.06 13.56 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.443 -0.786 . . . . 0.0 111.257 179.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.9 t -56.0 147.24 45.28 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 124.005 0.922 . . . . 0.0 111.091 173.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -72.63 54.67 2.51 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 124.383 3.389 . . . . 0.0 112.968 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -97.55 9.7 41.77 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.506 1.922 . . . . 0.0 113.237 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -163.4 -44.18 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.746 1.618 . . . . 0.0 111.473 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.491 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -60.04 -64.63 0.88 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.2 1.0 . . . . 0.0 110.956 176.151 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.77 -15.13 52.14 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-O 118.0 -1.0 . . . . 0.0 111.814 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -32.64 71.46 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.582 1.153 . . . . 0.0 112.136 171.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -70.01 -49.5 50.81 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.358 1.063 . . . . 0.0 110.161 175.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -66.87 -46.36 75.22 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.299 1.039 . . . . 0.0 112.144 -179.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.72 -33.65 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.407 1.883 . . . . 0.0 112.385 174.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.0 t -69.01 -50.36 49.53 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 122.548 0.339 . . . . 0.0 111.84 173.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.7 -32.07 73.15 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.012 0.369 . . . . 0.0 111.774 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.794 ' HA ' HD23 ' A' ' 28' ' ' LEU . 35.5 ttt180 -55.23 -31.35 61.42 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 125.815 1.646 . . . . 0.0 112.097 170.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.14 -59.82 4.73 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.886 1.221 . . . . 0.0 111.604 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.441 ' O ' HG23 ' A' ' 31' ' ' VAL . 64.4 t80 -56.24 -49.46 74.09 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.71 0.804 . . . . 0.0 110.592 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.794 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.266 0.1 OUTLIER -56.93 -26.78 60.08 Favored 'General case' 0 CA--C 1.557 1.244 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 177.168 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -68.8 -55.23 11.87 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.924 1.689 . . . . 0.0 111.035 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.98 -16.66 61.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 27' ' ' TYR . 46.0 t -75.26 -40.03 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 126.078 1.751 . . . . 0.0 112.144 172.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p -82.23 -40.91 20.98 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 123.837 0.855 . . . . 0.0 111.964 177.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 10.1 mtt180 -47.75 -36.07 10.91 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.337 1.455 . . . . 0.0 113.397 178.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -35.03 11.96 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.816 1.246 . . . . 0.0 113.398 174.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.6 mmm180 -124.46 45.07 2.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.348 1.859 . . . . 0.0 111.421 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -136.4 36.58 2.72 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 122.848 1.309 . . . . 0.0 112.293 -178.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.575 0 O-C-N 118.867 -2.395 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 116.817 -1.563 . . . . 0.0 111.911 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.92 67.72 5.81 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 123.656 2.904 . . . . 0.0 111.44 -178.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.62 23.38 10.82 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.84 2.056 . . . . 0.0 110.715 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.83 156.75 79.09 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 125.508 1.523 . . . . 0.0 111.098 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.86 49.19 1.83 Allowed 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 124.649 3.566 . . . . 0.0 113.275 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -165.04 109.43 0.89 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.211 1.404 . . . . 0.0 109.677 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.58 154.81 63.62 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.036 0.935 . . . . 0.0 110.999 176.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -76.59 160.96 34.56 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.315 2.677 . . . . 0.0 112.51 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.42 151.06 2.24 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.121 1.344 . . . . 0.0 112.726 -172.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -76.24 67.54 2.52 Favored 'General case' 0 CA--C 1.549 0.937 0 O-C-N 121.385 -1.068 . . . . 0.0 111.204 174.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -110.04 83.03 1.69 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.197 1.399 . . . . 0.0 111.239 -177.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.59 83.09 2.11 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.449 1.1 . . . . 0.0 110.156 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.86 151.06 16.56 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 124.63 1.172 . . . . 0.0 112.114 177.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -73.13 98.77 1.04 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.986 2.457 . . . . 0.0 110.576 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -141.11 77.45 1.6 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 126.014 1.726 . . . . 0.0 109.099 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.9 11.48 6.04 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.463 1.105 . . . . 0.0 112.501 -179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.48 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -57.74 -63.34 1.28 Allowed 'General case' 0 C--N 1.347 0.476 0 C-N-CA 126.09 1.756 . . . . 0.0 110.837 179.464 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.51 -16.36 63.59 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 118.548 -0.739 . . . . 0.0 111.688 -177.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -26.91 68.59 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 125.84 1.656 . . . . 0.0 112.197 171.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -73.73 -50.19 21.96 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.175 0.99 . . . . 0.0 109.663 172.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.94 -48.18 81.56 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 124.422 1.089 . . . . 0.0 111.613 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.72 77.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.293 1.437 . . . . 0.0 113.282 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -55.05 17.55 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.332 0.653 . . . . 0.0 111.202 174.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.13 -33.9 75.35 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.588 0.355 . . . . 0.0 111.487 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.777 ' HA ' HD23 ' A' ' 28' ' ' LEU . 4.9 tmm_? -56.12 -34.12 65.78 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 126.212 1.805 . . . . 0.0 111.857 171.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -59.66 -60.3 4.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 120.19 1.359 . . . . 0.0 110.956 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -55.57 -49.03 73.79 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.365 0.666 . . . . 0.0 110.932 175.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.297 0.1 OUTLIER -56.11 -28.71 58.91 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.391 176.112 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.07 -58.76 3.96 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 125.681 1.592 . . . . 0.0 111.358 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.67 -17.69 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.838 0.855 . . . . 0.0 112.822 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 62.1 t -76.69 -41.17 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 C-N-CA 125.492 1.517 . . . . 0.0 111.501 168.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.5 p -71.85 -37.69 70.21 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -48.76 -33.98 11.34 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.799 1.24 . . . . 0.0 113.44 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -111.45 19.58 18.06 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.133 1.773 . . . . 0.0 111.966 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.87 85.04 0.1 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.713 1.605 . . . . 0.0 111.781 -176.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -155.4 -50.48 0.08 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.71 0.767 . . . . 0.0 112.385 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.467 0 O-C-N 119.358 -2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 117.646 -1.169 . . . . 0.0 112.016 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -72.02 0.52 7.09 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.636 2.891 . . . . 0.0 114.05 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.32 147.34 37.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.985 2.514 . . . . 0.0 108.558 177.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.7 mtpt -72.31 -56.04 4.44 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 125.005 1.322 . . . . 0.0 112.422 170.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -72.77 99.35 1.06 Allowed 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.3 2.0 . . . . 0.0 109.572 176.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -84.18 168.62 15.6 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 123.88 0.872 . . . . 0.0 110.748 172.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.521 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . 64.37 169.09 0.1 Allowed Pre-proline 0 CA--C 1.552 1.047 0 C-N-CA 125.348 1.459 . . . . 0.0 111.797 -174.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 19.8 Cg_endo -70.08 169.88 18.28 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 121.226 1.284 . . . . 0.0 111.072 172.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.82 -164.23 1.34 Allowed Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.068 0.842 . . . . 0.0 112.407 172.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.85 120.16 8.4 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.74 -0.859 . . . . 0.0 111.319 -178.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -107.15 86.79 2.37 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.775 1.63 . . . . 0.0 110.12 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.19 139.13 20.97 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 121.53 -0.731 . . . . 0.0 109.296 177.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t 39.22 83.25 0.21 Allowed Pre-proline 0 N--CA 1.468 0.442 0 C-N-CA 126.419 1.887 . . . . 0.0 111.774 -176.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -72.15 63.42 3.42 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.704 2.936 . . . . 0.0 111.906 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -86.7 18.87 3.15 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.551 1.94 . . . . 0.0 113.096 -178.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -166.3 -45.15 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.451 1.5 . . . . 0.0 110.495 -175.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.525 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -54.93 -64.99 0.66 Allowed 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.082 0.953 . . . . 0.0 110.669 176.946 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.59 -20.3 65.54 Favored 'General case' 0 N--CA 1.462 0.155 0 O-C-N 121.383 -0.823 . . . . 0.0 111.897 -178.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.87 -31.62 71.08 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.536 1.134 . . . . 0.0 111.838 174.4 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -72.48 -48.72 38.52 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.488 1.115 . . . . 0.0 110.748 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -62.23 -46.74 87.5 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 124.15 0.98 . . . . 0.0 110.62 178.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.09 -38.2 73.01 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.094 1.357 . . . . 0.0 112.421 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 t -65.19 -55.55 17.93 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.546 0.738 . . . . 0.0 111.245 175.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 tt -62.88 -31.25 72.26 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.928 -0.482 . . . . 0.0 111.503 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.842 ' HA ' HD23 ' A' ' 28' ' ' LEU . 39.2 ttt180 -61.41 -28.56 69.34 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 126.189 1.796 . . . . 0.0 111.766 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -63.6 -61.36 2.37 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 120.061 1.3 . . . . 0.0 111.009 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.478 ' O ' HG23 ' A' ' 31' ' ' VAL . 61.3 t80 -53.81 -49.53 68.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.293 0.637 . . . . 0.0 110.989 174.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.842 HD23 ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -57.92 -22.34 48.24 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 121.179 -0.95 . . . . 0.0 113.39 177.219 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.97 -52.58 12.37 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.357 1.863 . . . . 0.0 111.062 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -74.45 -12.02 60.39 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 177.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 27' ' ' TYR . 55.6 t -83.16 -33.58 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 C-N-CA 125.536 1.535 . . . . 0.0 112.451 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.6 p -86.26 -38.18 17.83 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 124.592 1.157 . . . . 0.0 111.806 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -44.51 -42.35 7.11 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.235 1.414 . . . . 0.0 113.56 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.64 -42.22 56.09 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.728 1.211 . . . . 0.0 112.004 176.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mtp-105 -122.76 53.27 1.28 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.242 1.817 . . . . 0.0 111.536 178.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -104.07 55.76 0.73 Allowed 'General case' 0 C--O 1.223 -0.317 0 CA-C-O 123.28 1.515 . . . . 0.0 110.716 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.566 0 O-C-N 119.361 -2.087 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 . . . . . 0 N--CA 1.475 0.794 0 CA-C-O 119.289 -0.386 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -77.29 53.16 4.14 Favored 'Trans proline' 0 CA--C 1.551 1.355 0 C-N-CA 124.186 3.258 . . . . 0.0 112.583 178.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.39 142.22 12.62 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.291 1.436 . . . . 0.0 109.336 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.7 mttt 166.49 -57.39 0.0 OUTLIER Pre-proline 0 N--CA 1.481 1.117 0 C-N-CA 128.552 2.741 . . . . 0.0 111.328 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -76.43 90.18 1.22 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.582 2.188 . . . . 0.0 110.897 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -139.41 146.35 40.03 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.936 1.294 . . . . 0.0 109.365 176.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.94 153.03 51.81 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.358 0.663 . . . . 0.0 111.277 175.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -72.55 109.63 2.81 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.94 2.426 . . . . 0.0 111.219 177.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.02 92.07 0.55 Allowed Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.396 1.474 . . . . 0.0 111.296 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -145.05 99.68 3.36 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.735 0.814 . . . . 0.0 110.7 -178.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -127.0 83.26 2.15 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.463 1.905 . . . . 0.0 111.431 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -103.96 101.38 11.16 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.796 0.838 . . . . 0.0 109.657 178.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.41 163.85 2.3 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.251 1.421 . . . . 0.0 112.213 176.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -69.39 -172.22 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.409 2.072 . . . . 0.0 110.447 173.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.264 11.9 pt-20 53.09 18.16 1.09 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.05 1.34 . . . . 0.0 114.454 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -162.54 -38.84 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.042 2.137 . . . . 0.0 111.257 -175.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.466 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -57.45 -60.18 4.04 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.473 1.488 . . . . 0.0 111.006 177.009 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.3 t -62.7 -19.51 63.96 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.179 -0.95 . . . . 0.0 112.518 -177.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -34.42 72.36 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.78 1.632 . . . . 0.0 111.25 173.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -67.78 -51.95 42.91 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 124.179 0.991 . . . . 0.0 110.507 172.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.33 -47.78 75.17 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.356 1.062 . . . . 0.0 111.212 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.8 76.87 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.02 0.928 . . . . 0.0 112.66 177.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -45.78 54.23 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.929 0.892 . . . . 0.0 111.64 174.211 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.26 -34.19 76.05 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.9 1.28 . . . . 0.0 111.333 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.645 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -58.71 -21.01 53.86 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 125.343 1.457 . . . . 0.0 112.711 170.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.74 -59.08 3.17 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.572 1.533 . . . . 0.0 111.146 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -55.9 -47.91 76.58 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.213 0.605 . . . . 0.0 111.048 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.645 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.279 0.1 OUTLIER -60.61 -18.66 54.49 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 175.819 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.76 -56.09 4.91 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 119.904 -1.748 . . . . 0.0 111.313 175.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.21 -11.75 61.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 177.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.8 t -86.96 -37.77 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.74 1.616 . . . . 0.0 112.539 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 p -70.72 -43.03 69.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.795 0.725 . . . . 0.0 111.915 175.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.8 ttt85 -46.54 -40.71 13.14 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.999 1.32 . . . . 0.0 112.812 -178.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -46.85 -33.28 4.37 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.664 1.986 . . . . 0.0 114.251 175.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -135.3 46.68 2.38 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 127.408 2.283 . . . . 0.0 110.835 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -114.51 73.95 0.85 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.835 1.302 . . . . 0.0 111.372 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.597 0 O-C-N 119.617 -1.927 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 117.642 -1.17 . . . . 0.0 111.466 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -68.08 135.67 35.47 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 121.954 1.769 . . . . 0.0 110.232 179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.35 -92.21 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 124.657 1.183 . . . . 0.0 111.459 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -143.05 65.15 15.25 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 124.529 1.132 . . . . 0.0 110.065 172.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.96 169.02 22.33 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.365 2.044 . . . . 0.0 110.638 176.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 62.13 171.92 0.13 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.364 1.465 . . . . 0.0 112.376 -173.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.06 80.64 10.2 Favored Pre-proline 0 C--O 1.241 0.627 0 O-C-N 120.994 -1.066 . . . . 0.0 110.007 176.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -68.06 147.61 73.92 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.511 2.141 . . . . 0.0 110.577 179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.75 52.66 0.01 OUTLIER Glycine 0 CA--C 1.528 0.886 0 C-N-CA 123.435 0.54 . . . . 0.0 113.0 -177.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.38 46.08 0.41 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.228 1.411 . . . . 0.0 113.34 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 36.7 t0 59.25 77.55 0.3 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.816 1.646 . . . . 0.0 113.394 -178.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.32 78.91 1.44 Allowed 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.54 -0.725 . . . . 0.0 110.264 -174.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.1 t 36.12 76.35 0.45 Allowed Pre-proline 0 N--CA 1.475 0.823 0 C-N-CA 125.845 1.658 . . . . 0.0 112.158 -175.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.59 49.4 1.15 Allowed 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 124.478 3.452 . . . . 0.0 113.767 -176.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -74.31 0.47 14.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.481 2.312 . . . . 0.0 113.387 176.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -133.21 -44.1 0.85 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.745 2.018 . . . . 0.0 112.378 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.519 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -66.86 -59.96 3.08 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.891 0.769 . . . . 0.0 109.691 -179.47 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.0 m -63.45 -15.0 56.39 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 119.243 -0.408 . . . . 0.0 111.663 179.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -29.95 69.58 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.095 1.358 . . . . 0.0 112.352 170.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -75.25 -45.04 42.65 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.697 1.199 . . . . 0.0 110.456 172.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -65.44 -46.48 79.74 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 124.188 0.995 . . . . 0.0 112.141 -179.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.72 -39.71 85.6 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.065 1.346 . . . . 0.0 112.569 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.0 -49.03 55.58 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.952 0.501 . . . . 0.0 111.356 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -63.22 -34.11 76.95 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.126 0.57 . . . . 0.0 111.497 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.831 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -58.33 -32.97 69.01 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.031 1.733 . . . . 0.0 111.625 172.139 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -59.37 -61.87 2.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 119.725 1.148 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -54.55 -48.99 71.35 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.273 0.629 . . . . 0.0 111.025 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.831 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.285 0.1 OUTLIER -56.33 -26.95 54.16 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.413 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -69.03 -60.0 2.65 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.425 1.89 . . . . 0.0 111.148 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.54 -14.53 63.02 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -84.38 -34.4 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 126.3 1.84 . . . . 0.0 112.092 170.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.9 p -71.29 -42.51 68.61 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 118.141 -0.933 . . . . 0.0 112.92 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 -44.1 -39.88 4.54 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.17 1.388 . . . . 0.0 112.168 179.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.21 -42.51 30.31 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.887 1.675 . . . . 0.0 112.813 176.26 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.45 58.54 1.77 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.774 2.03 . . . . 0.0 110.971 177.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -114.35 78.75 1.18 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 122.984 1.373 . . . . 0.0 110.098 177.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.531 0 O-C-N 119.638 -1.914 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 118.409 -0.805 . . . . 0.0 109.869 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.61 103.63 1.33 Allowed 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 123.544 2.829 . . . . 0.0 109.976 174.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.55 128.39 36.32 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.743 0.817 . . . . 0.0 109.975 172.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.04 85.19 0.17 Allowed Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.467 1.507 . . . . 0.0 111.406 -176.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -73.03 84.87 1.26 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.449 2.766 . . . . 0.0 110.94 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 53.91 87.85 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.079 1.752 . . . . 0.0 112.88 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.3 147.64 86.85 Favored Pre-proline 0 CA--C 1.55 0.955 0 O-C-N 121.671 -0.643 . . . . 0.0 111.453 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -71.26 170.51 18.12 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.867 2.378 . . . . 0.0 111.35 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.77 101.32 0.91 Allowed Glycine 0 CA--C 1.528 0.886 0 CA-C-O 119.109 -0.828 . . . . 0.0 112.084 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -69.47 42.48 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.652 1.581 . . . . 0.0 114.721 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -86.59 72.19 10.27 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.653 1.581 . . . . 0.0 111.25 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -156.93 168.86 26.22 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.933 1.293 . . . . 0.0 111.021 175.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 t 42.23 78.74 0.36 Allowed Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 126.097 1.759 . . . . 0.0 112.66 178.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.43 117.02 4.68 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.484 2.123 . . . . 0.0 110.472 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -131.7 76.94 1.74 Allowed 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 126.974 2.11 . . . . 0.0 107.071 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 68.44 -6.59 0.78 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.75 1.62 . . . . 0.0 113.532 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.523 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -59.8 -59.95 4.61 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 120.352 -1.467 . . . . 0.0 110.352 174.328 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.4 t -62.03 -19.61 63.06 Favored 'General case' 0 C--O 1.218 -0.596 0 O-C-N 121.841 -0.537 . . . . 0.0 111.357 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -29.48 63.93 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 124.421 1.089 . . . . 0.0 112.446 172.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -73.82 -47.84 35.61 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.558 1.143 . . . . 0.0 110.939 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -70.93 -43.68 67.71 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 124.355 1.062 . . . . 0.0 112.841 -177.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.18 -38.89 91.94 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.726 2.011 . . . . 0.0 111.705 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 t -68.06 -49.1 63.43 Favored 'General case' 0 C--N 1.346 0.45 0 O-C-N 122.046 -0.409 . . . . 0.0 110.622 172.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tt -61.62 -34.39 75.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.312 0.505 . . . . 0.0 112.095 177.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.711 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.67 -29.75 53.52 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 126.126 1.771 . . . . 0.0 112.093 171.037 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -67.51 -59.83 3.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 120.112 1.324 . . . . 0.0 111.967 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -56.55 -48.83 76.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 110.853 175.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.711 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.301 0.1 OUTLIER -56.61 -26.11 54.83 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 118.547 -0.739 . . . . 0.0 112.691 175.735 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -54.75 9.51 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.996 1.718 . . . . 0.0 112.64 178.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -71.63 -14.55 62.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.837 0.855 . . . . 0.0 112.935 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.9 t -83.63 -38.51 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 126.1 1.76 . . . . 0.0 111.816 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 p -67.07 -44.44 80.06 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.173 175.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 -47.95 -41.66 25.55 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.008 0.923 . . . . 0.0 113.03 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.81 -40.02 54.43 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.181 1.393 . . . . 0.0 112.691 176.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.25 68.24 1.26 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.152 0.981 . . . . 0.0 112.229 176.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -96.99 -52.45 3.86 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.889 0.852 . . . . 0.0 112.245 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.581 0 O-C-N 119.406 -2.059 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 117.387 -1.292 . . . . 0.0 111.699 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.64 174.88 10.36 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.053 1.835 . . . . 0.0 111.749 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.29 162.6 14.47 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.522 1.129 . . . . 0.0 110.467 175.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.2 87.62 3.89 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 123.698 0.799 . . . . 0.0 110.055 178.139 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -72.9 58.78 3.42 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 124.25 3.3 . . . . 0.0 112.733 -176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 55.24 177.63 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.076 1.751 . . . . 0.0 113.15 -168.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -156.32 87.28 2.94 Favored Pre-proline 0 CA--C 1.541 0.631 0 O-C-N 121.365 -0.834 . . . . 0.0 110.16 171.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.8 174.08 12.41 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 122.2 1.933 . . . . 0.0 111.587 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.14 68.58 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 CA-C-O 119.295 -0.725 . . . . 0.0 111.9 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -167.56 136.86 2.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.595 1.158 . . . . 0.0 109.792 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.1 p30 -120.98 67.88 0.87 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.231 1.813 . . . . 0.0 111.013 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -143.63 178.84 7.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.783 0.833 . . . . 0.0 111.533 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.35 152.44 79.49 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 123.139 0.575 . . . . 0.0 111.264 177.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -75.65 66.39 6.57 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.326 2.684 . . . . 0.0 112.012 -178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -113.42 5.79 16.9 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.985 1.714 . . . . 0.0 113.524 -177.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -163.64 -52.31 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 126.03 1.732 . . . . 0.0 110.075 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.485 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -57.75 -62.85 1.5 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.36 0.982 . . . . 0.0 110.689 179.014 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.44 -17.48 64.58 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.21 -0.931 . . . . 0.0 112.078 -177.143 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.67 -32.58 71.77 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 126.109 1.764 . . . . 0.0 111.161 172.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -71.98 -48.65 43.37 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 124.46 1.104 . . . . 0.0 110.43 173.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.91 -47.85 83.54 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 123.945 0.898 . . . . 0.0 110.619 178.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.54 82.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.13 0.877 . . . . 0.0 112.835 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 t -71.59 -51.46 23.22 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 122.871 0.468 . . . . 0.0 111.398 175.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.73 -31.59 72.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.901 0.88 . . . . 0.0 111.938 178.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.709 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -52.33 -30.63 29.41 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 126.27 1.828 . . . . 0.0 111.84 169.108 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -64.92 -64.26 0.91 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.994 1.27 . . . . 0.0 110.986 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.418 ' O ' HG23 ' A' ' 31' ' ' VAL . 68.1 t80 -54.0 -48.36 70.51 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.615 0.766 . . . . 0.0 110.969 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.709 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.283 0.1 OUTLIER -57.69 -27.4 62.87 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.329 177.044 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -68.42 -55.21 12.67 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.707 1.603 . . . . 0.0 111.345 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.36 -10.93 60.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 27' ' ' TYR . 76.9 t -88.02 -35.6 8.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 125.823 1.649 . . . . 0.0 111.624 170.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.7 p -65.96 -42.21 90.25 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.83 -26.5 35.52 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 175.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -73.34 -17.65 61.27 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.42 1.088 . . . . 0.0 111.767 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -146.26 59.9 1.23 Allowed 'General case' 0 C--N 1.343 0.32 0 C-N-CA 127.333 2.253 . . . . 0.0 112.048 -174.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -117.14 70.63 0.78 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 123.026 1.393 . . . . 0.0 110.095 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.755 0 O-C-N 119.285 -2.134 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 117.356 -1.307 . . . . 0.0 111.341 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.06 171.26 17.92 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 121.69 1.594 . . . . 0.0 110.673 177.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -164.29 179.01 7.1 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.761 1.624 . . . . 0.0 108.495 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.41 82.03 0.18 Allowed Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 125.22 1.408 . . . . 0.0 110.566 179.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -70.0 175.88 7.71 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.89 2.393 . . . . 0.0 111.574 178.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -99.16 155.09 17.65 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 123.867 0.867 . . . . 0.0 111.453 176.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.25 81.47 8.78 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 124.538 1.135 . . . . 0.0 108.959 177.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -72.72 47.44 1.19 Allowed 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 124.034 3.156 . . . . 0.0 113.427 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 47.5 -143.75 5.93 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.389 1.471 . . . . 0.0 112.236 -172.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -161.25 118.42 2.28 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.291 0.637 . . . . 0.0 109.892 170.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -113.45 93.65 4.49 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.068 1.347 . . . . 0.0 109.223 176.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.03 57.45 0.15 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.935 1.294 . . . . 0.0 111.535 171.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.02 143.11 35.68 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 125.78 1.632 . . . . 0.0 110.672 -177.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.06 178.07 4.49 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.356 2.037 . . . . 0.0 111.95 176.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 67.64 15.02 9.68 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.107 1.363 . . . . 0.0 113.803 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -159.77 -52.04 0.06 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.691 1.596 . . . . 0.0 111.039 -176.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.451 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -60.71 -59.86 4.72 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.461 1.028 . . . . 0.0 111.326 176.232 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.2 m -60.61 -19.25 57.3 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.182 -0.949 . . . . 0.0 112.563 -179.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -38.44 77.95 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.822 1.249 . . . . 0.0 111.004 171.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -66.95 -46.06 75.87 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.439 1.095 . . . . 0.0 111.039 175.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -60.93 -48.89 79.72 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 124.251 1.021 . . . . 0.0 111.349 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.01 92.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.782 0.833 . . . . 0.0 112.402 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -48.41 75.22 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.342 0.519 . . . . 0.0 111.641 174.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -34.02 77.06 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.614 0.765 . . . . 0.0 111.5 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.737 ' HA ' HD23 ' A' ' 28' ' ' LEU . 28.5 ttm-85 -56.4 -32.82 65.18 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 125.28 1.432 . . . . 0.0 112.495 168.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -59.33 -60.79 3.3 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.994 1.27 . . . . 0.0 111.11 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -54.57 -48.88 71.53 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.452 0.701 . . . . 0.0 111.102 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.737 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.276 0.1 OUTLIER -58.55 -21.89 54.04 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 176.201 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -74.98 -54.77 6.61 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.651 1.58 . . . . 0.0 112.179 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -68.44 -18.59 64.45 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.166 -0.959 . . . . 0.0 112.415 176.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.6 t -84.25 -28.26 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.2 1.8 . . . . 0.0 113.729 172.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.4 p -78.93 -43.41 24.76 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 117.629 -1.176 . . . . 0.0 111.709 172.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.13 -44.15 31.87 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.616 1.098 . . . . 0.0 113.654 176.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -70.86 -17.24 62.73 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.2 10.15 20.13 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.884 2.474 . . . . 0.0 112.806 178.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.9 38.53 0.71 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 123.586 1.66 . . . . 0.0 110.753 -176.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.528 0 O-C-N 118.708 -2.495 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 117.644 -1.17 . . . . 0.0 112.644 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.84 149.38 53.77 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.344 2.029 . . . . 0.0 110.287 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 39.89 53.12 2.63 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.882 1.673 . . . . 0.0 112.914 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -130.55 76.95 76.71 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 125.227 1.411 . . . . 0.0 108.556 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -79.07 156.0 26.22 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.93 2.42 . . . . 0.0 111.504 170.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -145.83 98.45 3.12 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 125.333 1.453 . . . . 0.0 109.433 -177.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -43.05 97.76 0.15 Allowed Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 125.333 1.453 . . . . 0.0 111.994 -175.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -78.6 121.18 5.03 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.84 1.693 . . . . 0.0 109.76 -169.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.53 59.05 0.51 Allowed Glycine 0 CA--C 1.522 0.482 0 CA-C-O 118.618 -1.101 . . . . 0.0 111.903 -174.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 66.08 124.78 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 127.168 2.187 . . . . 0.0 113.516 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -113.39 93.06 4.22 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.323 1.049 . . . . 0.0 109.801 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.59 120.84 16.87 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.64 1.576 . . . . 0.0 109.856 177.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.79 147.67 41.57 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 124.146 0.978 . . . . 0.0 110.294 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.99 -171.96 0.45 Allowed 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.577 2.851 . . . . 0.0 111.054 175.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 52.0 20.44 1.25 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.509 1.524 . . . . 0.0 115.043 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -163.62 -50.77 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.842 1.657 . . . . 0.0 110.649 -173.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.483 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -58.87 -62.56 1.79 Allowed 'General case' 0 C--N 1.347 0.48 0 CA-C-N 119.724 1.147 . . . . 0.0 110.909 176.747 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.5 t -62.79 -19.14 63.74 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.644 -0.66 . . . . 0.0 111.472 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -31.32 70.45 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 125.706 1.602 . . . . 0.0 112.098 172.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -71.4 -46.55 59.99 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.16 0.984 . . . . 0.0 110.467 172.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -67.6 -50.09 59.91 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 124.593 1.157 . . . . 0.0 112.04 -178.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.14 -37.86 81.36 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.646 1.578 . . . . 0.0 112.623 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -69.9 -50.78 38.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.975 0.51 . . . . 0.0 111.423 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -36.6 77.07 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.334 0.516 . . . . 0.0 111.705 175.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.771 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.43 -35.24 62.75 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.74 1.616 . . . . 0.0 111.778 171.551 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -59.8 -57.98 10.55 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 119.834 1.197 . . . . 0.0 111.825 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -56.66 -49.65 74.42 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.04 0.536 . . . . 0.0 110.579 174.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.771 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.293 0.1 OUTLIER -55.55 -27.97 52.09 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.2 176.946 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -68.93 -56.94 6.3 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 127.057 2.143 . . . . 0.0 112.242 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.63 -17.63 63.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.71 0.804 . . . . 0.0 112.37 178.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -78.49 -41.58 25.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 126.1 1.76 . . . . 0.0 111.444 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 p -68.55 -37.29 79.81 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.416 1.086 . . . . 0.0 113.27 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -19.69 12.95 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 175.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -116.67 21.17 13.61 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.278 1.831 . . . . 0.0 111.784 178.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -173.38 87.67 0.06 Allowed 'General case' 0 C--N 1.347 0.46 0 C-N-CA 126.755 2.022 . . . . 0.0 111.851 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -151.59 65.54 0.87 Allowed 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 123.072 1.415 . . . . 0.0 110.779 178.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 O-C-N 118.711 -2.493 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.214 -0.811 0 CA-C-O 118.819 -0.61 . . . . 0.0 111.532 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.65 -43.21 99.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.666 1.187 . . . . 0.0 112.404 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -65.93 -51.01 62.35 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 124.166 0.986 . . . . 0.0 111.325 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.9 tp -60.94 -37.09 81.12 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.406 0.682 . . . . 0.0 111.077 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.8 ' HA ' HD23 ' A' ' 28' ' ' LEU . 33.5 ttp180 -58.6 -34.16 70.81 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 125.77 1.628 . . . . 0.0 111.831 173.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -58.48 -59.63 5.07 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.492 1.042 . . . . 0.0 111.068 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -55.27 -48.94 73.28 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.373 0.669 . . . . 0.0 111.092 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.8 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.272 0.1 OUTLIER -59.26 -20.34 53.42 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 175.929 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.79 -55.18 5.72 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.711 -1.868 . . . . 0.0 111.16 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.25 -17.76 64.38 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.4 t -83.08 -36.12 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.789 1.636 . . . . 0.0 112.937 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p . . . . . 0 CA--C 1.515 -0.39 0 CA-C-O 117.821 -1.085 . . . . 0.0 110.823 175.257 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.9 t80 . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 119.402 -0.333 . . . . 0.0 111.399 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.67 85.56 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.693 1.197 . . . . 0.0 112.303 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 t -71.92 -50.2 31.16 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 123.053 0.541 . . . . 0.0 111.325 174.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.3 tp -56.99 -37.9 72.31 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.934 0.893 . . . . 0.0 111.171 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.698 ' HA ' HD23 ' A' ' 28' ' ' LEU . 1.4 tmt_? -54.95 -36.46 65.34 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 125.772 1.629 . . . . 0.0 111.9 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -60.23 -55.57 32.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.171 1.351 . . . . 0.0 111.477 -178.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -57.01 -50.18 73.51 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.104 0.561 . . . . 0.0 110.643 174.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.698 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.277 0.1 OUTLIER -58.4 -21.1 49.37 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 175.511 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -76.2 -56.54 4.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.036 1.734 . . . . 0.0 110.982 176.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 pp -67.04 -19.35 65.67 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 176.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.0 t -82.48 -31.27 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.098 1.759 . . . . 0.0 112.908 173.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 N--CA 1.467 0.415 0 O-C-N 121.196 -0.94 . . . . 0.0 112.035 176.912 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.216 -0.688 0 CA-C-O 119.084 -0.484 . . . . 0.0 111.64 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.12 -40.09 96.59 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.166 2.187 . . . . 0.0 112.379 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 t -69.87 -51.7 31.04 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 123.318 0.386 . . . . 0.0 110.881 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.49 -34.41 72.54 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.841 -0.537 . . . . 0.0 112.194 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.793 ' HA ' HD23 ' A' ' 28' ' ' LEU . 8.4 ttm180 -57.4 -31.67 66.07 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 125.62 1.568 . . . . 0.0 111.973 172.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -58.96 -60.07 4.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 120.317 1.417 . . . . 0.0 111.112 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -54.81 -49.18 71.64 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.362 0.665 . . . . 0.0 111.271 174.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.299 0.1 OUTLIER -57.18 -28.62 62.97 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 121.67 -0.643 . . . . 0.0 112.554 175.947 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -67.83 -60.1 2.78 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 126.142 1.777 . . . . 0.0 110.35 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.55 -11.82 58.93 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 118.472 -0.775 . . . . 0.0 113.024 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -84.85 -40.16 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.152 1.381 . . . . 0.0 111.66 171.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 CA--C 1.518 -0.271 0 C-N-CA 123.496 0.718 . . . . 0.0 111.281 175.235 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.95 -28.04 69.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.714 1.206 . . . . 0.0 113.069 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.98 -47.02 19.49 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.873 0.869 . . . . 0.0 111.189 172.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.15 -32.22 73.71 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 0.0 112.539 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.682 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -53.15 -28.28 25.28 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.492 1.517 . . . . 0.0 112.325 169.538 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -68.07 -63.05 1.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.836 1.198 . . . . 0.0 111.242 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.405 ' O ' HG23 ' A' ' 31' ' ' VAL . 66.3 t80 -54.42 -48.47 71.62 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.23 0.612 . . . . 0.0 110.752 176.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.291 0.1 OUTLIER -57.91 -23.94 55.58 Favored 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 176.411 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -74.32 -51.13 16.11 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.911 1.684 . . . . 0.0 112.11 175.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 -8.18 55.4 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 27' ' ' TYR . 55.6 t -89.16 -38.85 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 126.14 1.776 . . . . 0.0 111.84 171.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 124.404 1.082 . . . . 0.0 113.823 -179.913 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.216 -0.693 0 CA-C-O 118.927 -0.559 . . . . 0.0 112.335 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.85 -37.1 85.51 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.164 1.786 . . . . 0.0 111.445 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t -72.82 -48.28 39.26 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 124.001 0.92 . . . . 0.0 111.041 174.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.84 -32.06 73.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.191 0.596 . . . . 0.0 111.297 177.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.813 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.77 -24.79 67.9 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.333 1.853 . . . . 0.0 112.042 173.599 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -67.31 -59.2 3.61 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.674 1.125 . . . . 0.0 110.923 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.4 ' O ' HG23 ' A' ' 31' ' ' VAL . 53.6 t80 -54.78 -49.78 70.08 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.549 0.74 . . . . 0.0 110.496 173.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.813 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.284 0.1 OUTLIER -57.91 -23.72 54.61 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.45 177.139 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -75.72 -48.07 23.44 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.116 1.766 . . . . 0.0 112.453 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -76.26 -6.39 51.22 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.66 -0.65 . . . . 0.0 112.689 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 27' ' ' TYR . 75.1 t -95.06 -29.14 4.05 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 126.988 2.115 . . . . 0.0 112.799 172.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p . . . . . 0 CA--C 1.519 -0.218 0 O-C-N 120.918 -1.114 . . . . 0.0 112.224 176.777 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.3 t80 . . . . . 0 C--O 1.22 -0.46 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.2 89.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.169 1.788 . . . . 0.0 112.099 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.5 t -67.88 -52.0 41.55 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.984 0.356 . . . . 0.0 111.244 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -36.46 73.53 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.708 -0.62 . . . . 0.0 112.02 176.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.696 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -53.89 -28.51 36.95 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.277 1.831 . . . . 0.0 112.663 171.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -67.32 -62.06 1.61 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.785 1.175 . . . . 0.0 111.115 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.46 -48.34 74.67 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 123.131 0.572 . . . . 0.0 110.876 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.696 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.308 0.1 OUTLIER -57.08 -27.12 61.46 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 176.248 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.02 -60.42 2.51 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.471 1.508 . . . . 0.0 111.063 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.4 -19.24 65.75 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.634 0.774 . . . . 0.0 112.756 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 72.5 t -78.27 -40.29 25.26 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 126.354 1.862 . . . . 0.0 111.628 169.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p . . . . . 0 CA--C 1.513 -0.447 0 CA-C-O 118.066 -0.969 . . . . 0.0 112.945 176.921 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.1 t80 . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.99 -30.85 71.91 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.637 1.975 . . . . 0.0 112.129 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -43.42 62.91 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.231 0.612 . . . . 0.0 110.742 170.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.88 -33.72 76.68 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.266 -0.397 . . . . 0.0 112.011 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.686 ' HA ' HD23 ' A' ' 28' ' ' LEU . 6.2 tpm_? -48.2 -36.09 13.06 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.952 1.701 . . . . 0.0 111.803 176.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -64.1 -59.78 4.03 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.317 1.847 . . . . 0.0 112.174 177.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -55.4 -50.21 70.35 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.12 0.568 . . . . 0.0 110.513 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.686 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.264 0.0 OUTLIER -59.64 -18.69 43.79 Favored 'General case' 0 CA--C 1.556 1.198 0 O-C-N 121.583 -0.698 . . . . 0.0 112.4 175.929 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -77.75 -52.79 8.37 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.1 1.76 . . . . 0.0 112.743 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.96 -16.83 62.67 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.34 -0.85 . . . . 0.0 113.062 176.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.7 t -81.9 -39.65 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 126.433 1.893 . . . . 0.0 112.372 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 28' ' ' LEU . 24.0 p . . . . . 0 CA--C 1.512 -0.491 0 CA-C-O 117.524 -1.226 . . . . 0.0 111.388 176.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.2 t80 . . . . . 0 C--O 1.22 -0.454 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.54 -33.17 71.07 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.842 1.257 . . . . 0.0 112.628 173.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.54 -45.37 46.02 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.199 0.454 . . . . 0.0 111.229 173.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -65.07 -28.96 69.83 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.81 0.844 . . . . 0.0 112.518 177.338 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.706 ' HA ' HD23 ' A' ' 28' ' ' LEU . 25.3 tpt180 -50.05 -37.27 32.53 Favored 'General case' 0 C--O 1.207 -1.168 0 C-N-CA 125.247 1.419 . . . . 0.0 111.471 171.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -61.39 -59.27 5.53 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.881 0.872 . . . . 0.0 111.816 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.43 -49.09 73.32 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 123.4 0.68 . . . . 0.0 111.08 174.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.269 0.0 OUTLIER -60.65 -17.38 47.01 Favored 'General case' 0 CA--C 1.563 1.463 0 O-C-N 121.177 -0.952 . . . . 0.0 112.906 175.665 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.14 -54.03 6.71 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.435 -2.041 . . . . 0.0 111.408 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 pp -71.12 -14.84 62.43 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 176.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.1 t -84.64 -38.44 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.482 1.513 . . . . 0.0 112.171 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.428 HG23 HD12 ' A' ' 28' ' ' LEU . 14.6 p . . . . . 0 CA--C 1.508 -0.64 0 CA-C-O 116.682 -1.628 . . . . 0.0 110.913 175.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 . . . . . 0 C--O 1.22 -0.464 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.37 -36.49 80.37 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.44 2.296 . . . . 0.0 112.491 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.4 t -68.08 -54.64 16.75 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.2 1.0 . . . . 0.0 110.89 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -34.44 75.26 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.971 0.508 . . . . 0.0 111.309 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.815 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.59 -35.5 63.42 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 125.995 1.718 . . . . 0.0 112.166 171.115 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -61.0 -56.64 18.74 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.036 1.289 . . . . 0.0 111.758 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -56.2 -50.44 71.22 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 123.576 0.75 . . . . 0.0 110.347 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.279 0.1 OUTLIER -57.47 -23.01 47.34 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 119.065 -0.493 . . . . 0.0 112.218 176.028 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.66 -49.19 16.77 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.32 1.848 . . . . 0.0 112.5 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -75.46 -12.58 60.27 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.55 -35.31 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 126.017 1.727 . . . . 0.0 112.402 172.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 p . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.52 -1.228 . . . . 0.0 111.556 175.528 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 . . . . . 0 C--O 1.22 -0.456 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.94 -41.22 95.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.993 2.117 . . . . 0.0 112.125 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -47.43 67.85 Favored 'General case' 0 C--N 1.343 0.304 0 O-C-N 122.126 -0.359 . . . . 0.0 111.299 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.2 tp -60.48 -34.94 74.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.872 -0.518 . . . . 0.0 111.663 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.668 ' HA ' HD23 ' A' ' 28' ' ' LEU . 67.9 ttt180 -60.17 -17.5 41.34 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.087 2.155 . . . . 0.0 113.188 173.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -75.85 -59.02 2.94 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.316 0.962 . . . . 0.0 111.402 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.25 -49.15 76.96 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 122.886 0.474 . . . . 0.0 110.538 175.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.668 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.266 0.1 OUTLIER -58.92 -18.67 35.5 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 175.652 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.12 -57.04 4.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.694 -1.879 . . . . 0.0 111.722 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.57 -15.13 63.16 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -84.22 -37.48 12.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 C-N-CA 126.554 1.942 . . . . 0.0 112.265 170.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.87 -1.062 . . . . 0.0 111.339 177.3 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.222 -0.353 0 CA-C-O 119.479 -0.296 . . . . 0.0 110.939 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -35.35 79.41 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.59 1.156 . . . . 0.0 112.487 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -48.82 27.68 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.346 0.521 . . . . 0.0 112.122 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.31 -33.11 73.05 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.555 0.616 . . . . 0.0 111.349 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.688 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.74 -26.11 32.03 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 125.881 1.673 . . . . 0.0 113.153 169.132 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -68.97 -62.16 1.49 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 120.36 1.436 . . . . 0.0 111.706 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -55.8 -48.44 75.38 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.358 0.663 . . . . 0.0 110.629 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.688 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.287 0.1 OUTLIER -57.07 -27.05 61.37 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 176.343 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -68.53 -59.74 2.93 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.352 1.461 . . . . 0.0 111.003 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.89 -17.0 64.69 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.939 0.896 . . . . 0.0 113.048 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.1 t -81.77 -37.71 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 126.107 1.763 . . . . 0.0 111.962 169.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.8 p . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 117.726 -1.13 . . . . 0.0 112.302 175.609 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--O 1.223 -0.316 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.72 -33.65 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.407 1.883 . . . . 0.0 112.385 174.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.0 t -69.01 -50.36 49.53 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 122.548 0.339 . . . . 0.0 111.84 173.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.7 -32.07 73.15 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.012 0.369 . . . . 0.0 111.774 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.794 ' HA ' HD23 ' A' ' 28' ' ' LEU . 35.5 ttt180 -55.23 -31.35 61.42 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 125.815 1.646 . . . . 0.0 112.097 170.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.14 -59.82 4.73 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.886 1.221 . . . . 0.0 111.604 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.441 ' O ' HG23 ' A' ' 31' ' ' VAL . 64.4 t80 -56.24 -49.46 74.09 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.71 0.804 . . . . 0.0 110.592 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.794 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.266 0.1 OUTLIER -56.93 -26.78 60.08 Favored 'General case' 0 CA--C 1.557 1.244 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 177.168 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -68.8 -55.23 11.87 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.924 1.689 . . . . 0.0 111.035 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.98 -16.66 61.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 27' ' ' TYR . 46.0 t -75.26 -40.03 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 126.078 1.751 . . . . 0.0 112.144 172.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 CA--C 1.522 -0.133 0 C-N-CA 123.837 0.855 . . . . 0.0 111.964 177.932 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--O 1.219 -0.531 0 CA-C-O 118.954 -0.546 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.72 77.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.293 1.437 . . . . 0.0 113.282 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -55.05 17.55 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.332 0.653 . . . . 0.0 111.202 174.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.13 -33.9 75.35 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.588 0.355 . . . . 0.0 111.487 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.777 ' HA ' HD23 ' A' ' 28' ' ' LEU . 4.9 tmm_? -56.12 -34.12 65.78 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 126.212 1.805 . . . . 0.0 111.857 171.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -59.66 -60.3 4.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 120.19 1.359 . . . . 0.0 110.956 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -55.57 -49.03 73.79 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.365 0.666 . . . . 0.0 110.932 175.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.297 0.1 OUTLIER -56.11 -28.71 58.91 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.391 176.112 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.07 -58.76 3.96 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 125.681 1.592 . . . . 0.0 111.358 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.67 -17.69 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.838 0.855 . . . . 0.0 112.822 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 62.1 t -76.69 -41.17 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 C-N-CA 125.492 1.517 . . . . 0.0 111.501 168.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.5 p . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 179.44 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.217 -0.641 0 CA-C-O 118.726 -0.654 . . . . 0.0 110.62 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.09 -38.2 73.01 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.094 1.357 . . . . 0.0 112.421 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 t -65.19 -55.55 17.93 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.546 0.738 . . . . 0.0 111.245 175.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 tt -62.88 -31.25 72.26 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.928 -0.482 . . . . 0.0 111.503 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.842 ' HA ' HD23 ' A' ' 28' ' ' LEU . 39.2 ttt180 -61.41 -28.56 69.34 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 126.189 1.796 . . . . 0.0 111.766 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -63.6 -61.36 2.37 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 120.061 1.3 . . . . 0.0 111.009 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.478 ' O ' HG23 ' A' ' 31' ' ' VAL . 61.3 t80 -53.81 -49.53 68.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.293 0.637 . . . . 0.0 110.989 174.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.842 HD23 ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -57.92 -22.34 48.24 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 121.179 -0.95 . . . . 0.0 113.39 177.219 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.97 -52.58 12.37 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.357 1.863 . . . . 0.0 111.062 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -74.45 -12.02 60.39 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 177.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 27' ' ' TYR . 55.6 t -83.16 -33.58 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 C-N-CA 125.536 1.535 . . . . 0.0 112.451 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.512 -0.488 0 C-N-CA 124.592 1.157 . . . . 0.0 111.806 178.523 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.2 t80 . . . . . 0 N--CA 1.465 0.301 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.8 76.87 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.02 0.928 . . . . 0.0 112.66 177.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -45.78 54.23 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.929 0.892 . . . . 0.0 111.64 174.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.26 -34.19 76.05 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.9 1.28 . . . . 0.0 111.333 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.645 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -58.71 -21.01 53.86 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 125.343 1.457 . . . . 0.0 112.711 170.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.74 -59.08 3.17 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.572 1.533 . . . . 0.0 111.146 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -55.9 -47.91 76.58 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.213 0.605 . . . . 0.0 111.048 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.645 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.279 0.1 OUTLIER -60.61 -18.66 54.49 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 175.819 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.76 -56.09 4.91 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 119.904 -1.748 . . . . 0.0 111.313 175.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.21 -11.75 61.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 177.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.8 t -86.96 -37.77 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.74 1.616 . . . . 0.0 112.539 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.234 0.281 0 CA-C-N 118.795 0.725 . . . . 0.0 111.915 175.142 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.1 t80 . . . . . 0 C--O 1.219 -0.544 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.72 -39.71 85.6 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.065 1.346 . . . . 0.0 112.569 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.0 -49.03 55.58 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.952 0.501 . . . . 0.0 111.356 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -63.22 -34.11 76.95 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.126 0.57 . . . . 0.0 111.497 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.831 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -58.33 -32.97 69.01 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.031 1.733 . . . . 0.0 111.625 172.139 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -59.37 -61.87 2.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 119.725 1.148 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -54.55 -48.99 71.35 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.273 0.629 . . . . 0.0 111.025 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.831 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.285 0.1 OUTLIER -56.33 -26.95 54.16 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.413 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -69.03 -60.0 2.65 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.425 1.89 . . . . 0.0 111.148 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.54 -14.53 63.02 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -84.38 -34.4 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 126.3 1.84 . . . . 0.0 112.092 170.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 CA--C 1.511 -0.538 0 CA-C-O 118.141 -0.933 . . . . 0.0 112.92 176.362 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 . . . . . 0 C--O 1.221 -0.431 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.18 -38.89 91.94 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.726 2.011 . . . . 0.0 111.705 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 t -68.06 -49.1 63.43 Favored 'General case' 0 C--N 1.346 0.45 0 O-C-N 122.046 -0.409 . . . . 0.0 110.622 172.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tt -61.62 -34.39 75.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.312 0.505 . . . . 0.0 112.095 177.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.711 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.67 -29.75 53.52 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 126.126 1.771 . . . . 0.0 112.093 171.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -67.51 -59.83 3.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 120.112 1.324 . . . . 0.0 111.967 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -56.55 -48.83 76.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 110.853 175.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.711 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.301 0.1 OUTLIER -56.61 -26.11 54.83 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 118.547 -0.739 . . . . 0.0 112.691 175.735 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -54.75 9.51 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.996 1.718 . . . . 0.0 112.64 178.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -71.63 -14.55 62.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.837 0.855 . . . . 0.0 112.935 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.9 t -83.63 -38.51 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 126.1 1.76 . . . . 0.0 111.816 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 p . . . . . 0 N--CA 1.446 -0.664 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.173 175.579 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.222 -0.365 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.54 82.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.13 0.877 . . . . 0.0 112.835 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 t -71.59 -51.46 23.22 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 122.871 0.468 . . . . 0.0 111.398 175.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.73 -31.59 72.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.901 0.88 . . . . 0.0 111.938 178.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.709 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -52.33 -30.63 29.41 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 126.27 1.828 . . . . 0.0 111.84 169.108 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -64.92 -64.26 0.91 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.994 1.27 . . . . 0.0 110.986 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.418 ' O ' HG23 ' A' ' 31' ' ' VAL . 68.1 t80 -54.0 -48.36 70.51 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.615 0.766 . . . . 0.0 110.969 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.709 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.283 0.1 OUTLIER -57.69 -27.4 62.87 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.329 177.044 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -68.42 -55.21 12.67 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.707 1.603 . . . . 0.0 111.345 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.36 -10.93 60.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 27' ' ' TYR . 76.9 t -88.02 -35.6 8.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 125.823 1.649 . . . . 0.0 111.624 170.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.7 p . . . . . 0 N--CA 1.464 0.266 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 177.024 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 . . . . . 0 C--O 1.226 -0.156 0 N-CA-C 111.349 0.129 . . . . 0.0 111.349 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.01 92.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.782 0.833 . . . . 0.0 112.402 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -48.41 75.22 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.342 0.519 . . . . 0.0 111.641 174.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -34.02 77.06 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.614 0.765 . . . . 0.0 111.5 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.737 ' HA ' HD23 ' A' ' 28' ' ' LEU . 28.5 ttm-85 -56.4 -32.82 65.18 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 125.28 1.432 . . . . 0.0 112.495 168.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -59.33 -60.79 3.3 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.994 1.27 . . . . 0.0 111.11 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -54.57 -48.88 71.53 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.452 0.701 . . . . 0.0 111.102 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.737 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.276 0.1 OUTLIER -58.55 -21.89 54.04 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 176.201 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -74.98 -54.77 6.61 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.651 1.58 . . . . 0.0 112.179 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -68.44 -18.59 64.45 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.166 -0.959 . . . . 0.0 112.415 176.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.6 t -84.25 -28.26 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.2 1.8 . . . . 0.0 113.729 172.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.4 p . . . . . 0 CA--C 1.51 -0.595 0 CA-C-O 117.629 -1.176 . . . . 0.0 111.709 172.399 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 . . . . . 0 C--O 1.222 -0.381 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.14 -37.86 81.36 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.646 1.578 . . . . 0.0 112.623 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -69.9 -50.78 38.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.975 0.51 . . . . 0.0 111.423 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -36.6 77.07 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.334 0.516 . . . . 0.0 111.705 175.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.771 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.43 -35.24 62.75 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.74 1.616 . . . . 0.0 111.778 171.551 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -59.8 -57.98 10.55 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 119.834 1.197 . . . . 0.0 111.825 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -56.66 -49.65 74.42 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.04 0.536 . . . . 0.0 110.579 174.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.771 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.293 0.1 OUTLIER -55.55 -27.97 52.09 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.2 176.946 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -68.93 -56.94 6.3 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 127.057 2.143 . . . . 0.0 112.242 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.63 -17.63 63.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.71 0.804 . . . . 0.0 112.37 178.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -78.49 -41.58 25.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 126.1 1.76 . . . . 0.0 111.444 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 p . . . . . 0 N--CA 1.466 0.356 0 C-N-CA 124.416 1.086 . . . . 0.0 113.27 178.378 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.67 64.01 4.75 Favored 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 124.552 3.501 . . . . 0.0 112.013 176.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.54 120.73 2.83 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 125.627 1.571 . . . . 0.0 110.541 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 mttp 162.04 -57.57 0.0 OUTLIER Pre-proline 0 N--CA 1.482 1.159 0 C-N-CA 129.384 3.073 . . . . 0.0 112.776 -172.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -75.86 72.0 5.33 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.875 2.384 . . . . 0.0 111.013 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -79.1 65.89 4.4 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.549 1.14 . . . . 0.0 111.365 177.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -160.0 155.43 22.01 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.063 0.945 . . . . 0.0 112.009 176.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -73.97 124.65 9.29 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 123.118 2.545 . . . . 0.0 111.279 175.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.63 -67.39 0.08 OUTLIER Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.998 1.285 . . . . 0.0 110.404 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -151.78 116.26 5.07 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.395 1.078 . . . . 0.0 111.355 178.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -118.57 88.15 2.87 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 126.913 2.085 . . . . 0.0 110.486 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.95 ' HB1' HD21 ' A' ' 17' ' ' LEU . . . -149.36 152.56 36.0 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.508 ' O ' HD23 ' A' ' 17' ' ' LEU . 1.4 t -101.54 145.84 31.17 Favored Pre-proline 0 N--CA 1.473 0.724 0 C-N-CA 122.987 0.515 . . . . 0.0 110.345 178.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.417 ' HA ' ' HB2' ' A' ' 18' ' ' SER . 58.2 Cg_endo -71.73 -171.31 0.63 Allowed 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.691 1.594 . . . . 0.0 111.191 174.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 79.84 102.24 0.06 Allowed 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 125.58 1.552 . . . . 0.0 108.609 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 75.18 -49.5 0.64 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.827 1.651 . . . . 0.0 112.415 -178.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.95 HD21 ' HB1' ' A' ' 12' ' ' ALA . 0.3 OUTLIER -63.22 -63.62 1.14 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.63 1.172 . . . . 0.0 110.486 174.48 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.417 ' HB2' ' HA ' ' A' ' 14' ' ' PRO . 0.1 OUTLIER -63.34 -15.25 56.82 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.583 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -28.12 67.95 Favored 'General case' 0 C--O 1.215 -0.723 0 C-N-CA 124.705 1.202 . . . . 0.0 112.036 172.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -71.2 -52.89 16.58 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.221 0.608 . . . . 0.0 109.969 172.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -63.46 -48.37 78.0 Favored 'General case' 0 C--O 1.214 -0.811 0 C-N-CA 123.415 0.686 . . . . 0.0 111.532 -178.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.65 -43.21 99.38 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.666 1.187 . . . . 0.0 112.404 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.7 t -65.93 -51.01 62.35 Favored 'General case' 0 C--N 1.344 0.357 0 C-N-CA 124.166 0.986 . . . . 0.0 111.325 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.9 tp -60.94 -37.09 81.12 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.406 0.682 . . . . 0.0 111.077 176.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.8 ' HA ' HD23 ' A' ' 28' ' ' LEU . 33.5 ttp180 -58.6 -34.16 70.81 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 125.77 1.628 . . . . 0.0 111.831 173.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -58.48 -59.63 5.07 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.492 1.042 . . . . 0.0 111.068 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -55.27 -48.94 73.28 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.373 0.669 . . . . 0.0 111.092 175.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.8 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.272 0.1 OUTLIER -59.26 -20.34 53.42 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 175.929 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.79 -55.18 5.72 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 119.711 -1.868 . . . . 0.0 111.16 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.25 -17.76 64.38 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.4 t -83.08 -36.12 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.789 1.636 . . . . 0.0 112.937 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.4 p -70.55 -46.83 62.81 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 117.821 -1.085 . . . . 0.0 110.823 175.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -44.55 -41.97 6.89 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.522 1.129 . . . . 0.0 113.708 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -47.53 -37.82 12.9 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.1 1.36 . . . . 0.0 113.151 175.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.18 67.08 1.33 Allowed 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.323 1.849 . . . . 0.0 111.192 172.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -112.05 57.58 0.64 Allowed 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 123.136 1.446 . . . . 0.0 109.905 175.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.648 0 O-C-N 118.825 -2.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 117.496 -1.24 . . . . 0.0 111.391 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -74.52 -176.51 2.8 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.072 1.848 . . . . 0.0 111.108 174.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.83 -25.67 65.18 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.23 1.012 . . . . 0.0 113.078 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.87 157.37 13.99 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 126.565 1.946 . . . . 0.0 110.878 174.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -75.23 -177.33 3.44 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 124.161 3.24 . . . . 0.0 112.484 174.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -107.7 76.68 1.08 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.109 1.364 . . . . 0.0 110.922 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -162.19 92.2 1.33 Allowed Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.82 0.848 . . . . 0.0 110.002 172.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -70.48 164.15 36.27 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 121.32 1.347 . . . . 0.0 111.495 175.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 139.87 -123.35 2.43 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.04 1.305 . . . . 0.0 110.917 -178.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -147.09 110.53 4.88 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.044 0.938 . . . . 0.0 111.305 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -129.83 84.39 2.21 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 124.88 1.272 . . . . 0.0 109.745 179.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.9 79.33 0.89 Allowed 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.159 -0.963 . . . . 0.0 111.423 177.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 46.4 t -100.28 141.89 23.59 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.945 1.298 . . . . 0.0 111.346 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -70.21 -179.02 2.81 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.237 2.625 . . . . 0.0 111.924 174.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 64.72 16.5 10.43 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.741 1.216 . . . . 0.0 113.406 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -157.6 -52.46 0.07 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.97 1.708 . . . . 0.0 110.689 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.463 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -57.91 -62.85 1.51 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 119.29 0.95 . . . . 0.0 111.422 179.07 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.8 t -66.87 -17.97 65.15 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 121.771 -0.58 . . . . 0.0 111.766 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.64 -36.75 77.0 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.355 1.462 . . . . 0.0 111.562 173.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -67.0 -48.39 68.59 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.472 0.709 . . . . 0.0 110.766 173.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -60.49 -47.54 85.68 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 124.218 1.007 . . . . 0.0 111.399 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.93 -37.67 85.56 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.693 1.197 . . . . 0.0 112.303 179.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 t -71.92 -50.2 31.16 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 123.053 0.541 . . . . 0.0 111.325 174.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 17.3 tp -56.99 -37.9 72.31 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.934 0.893 . . . . 0.0 111.171 175.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.698 ' HA ' HD23 ' A' ' 28' ' ' LEU . 1.4 tmt_? -54.95 -36.46 65.34 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 125.772 1.629 . . . . 0.0 111.9 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -60.23 -55.57 32.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 120.171 1.351 . . . . 0.0 111.477 -178.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -57.01 -50.18 73.51 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.104 0.561 . . . . 0.0 110.643 174.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.698 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.277 0.1 OUTLIER -58.4 -21.1 49.37 Favored 'General case' 0 CA--C 1.556 1.2 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 175.511 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -76.2 -56.54 4.55 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.036 1.734 . . . . 0.0 110.982 176.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 pp -67.04 -19.35 65.67 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 176.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 53.0 t -82.48 -31.27 9.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.098 1.759 . . . . 0.0 112.908 173.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.1 p -79.71 -39.34 31.4 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 121.196 -0.94 . . . . 0.0 112.035 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -55.15 -39.85 69.93 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 118.499 0.591 . . . . 0.0 112.53 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -79.67 10.82 3.6 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.411 1.484 . . . . 0.0 114.116 174.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -127.3 -56.37 1.33 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.505 1.522 . . . . 0.0 111.165 -176.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -84.52 12.84 6.27 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.137 2.575 . . . . 0.0 112.903 177.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.593 0 O-C-N 118.846 -2.409 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 9.3 t80 . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -73.63 78.5 2.4 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.326 2.017 . . . . 0.0 109.281 176.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.64 160.08 5.94 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.54 170.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 64.59 84.25 0.18 Allowed Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.826 1.65 . . . . 0.0 110.774 -175.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -70.92 89.49 0.65 Allowed 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 123.519 2.813 . . . . 0.0 111.056 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -114.96 153.99 29.57 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 126.352 1.861 . . . . 0.0 110.279 178.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.57 162.49 0.09 OUTLIER Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 125.979 1.711 . . . . 0.0 114.421 -170.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -76.96 84.63 1.9 Allowed 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.056 2.504 . . . . 0.0 111.487 177.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -168.71 48.48 0.22 Allowed Glycine 0 CA--C 1.529 0.923 0 CA-C-N 115.832 -0.622 . . . . 0.0 113.696 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -69.79 41.2 0.05 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 126.119 1.768 . . . . 0.0 113.617 176.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -107.31 85.16 2.08 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 122.825 1.297 . . . . 0.0 110.736 -175.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.01 71.64 1.43 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.158 1.383 . . . . 0.0 109.881 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -113.34 83.82 6.99 Favored Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 124.493 1.117 . . . . 0.0 109.84 176.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -73.87 45.92 1.2 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 124.588 3.526 . . . . 0.0 112.757 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -83.51 3.97 29.99 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.837 2.055 . . . . 0.0 113.439 175.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -134.01 -45.37 0.79 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.743 1.217 . . . . 0.0 112.703 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.499 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -65.33 -60.96 2.42 Favored 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.704 0.802 . . . . 0.0 109.051 179.49 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.84 -17.96 62.17 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-O 117.754 -1.117 . . . . 0.0 110.858 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 3.0 tmm_? -58.09 -34.14 69.84 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 125.014 1.326 . . . . 0.0 112.117 172.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -68.1 -46.62 70.44 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 123.497 0.719 . . . . 0.0 110.957 174.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.68 -45.76 64.43 Favored 'General case' 0 C--O 1.216 -0.688 0 C-N-CA 124.307 1.043 . . . . 0.0 111.64 -179.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.12 -40.09 96.59 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.166 2.187 . . . . 0.0 112.379 178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.2 t -69.87 -51.7 31.04 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 123.318 0.386 . . . . 0.0 110.881 173.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.6 tt -59.49 -34.41 72.54 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.841 -0.537 . . . . 0.0 112.194 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.793 ' HA ' HD23 ' A' ' 28' ' ' LEU . 8.4 ttm180 -57.4 -31.67 66.07 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 125.62 1.568 . . . . 0.0 111.973 172.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -58.96 -60.07 4.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 120.317 1.417 . . . . 0.0 111.112 178.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -54.81 -49.18 71.64 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.362 0.665 . . . . 0.0 111.271 174.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.299 0.1 OUTLIER -57.18 -28.62 62.97 Favored 'General case' 0 CA--C 1.551 1.009 0 O-C-N 121.67 -0.643 . . . . 0.0 112.554 175.947 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -67.83 -60.1 2.78 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 126.142 1.777 . . . . 0.0 110.35 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.55 -11.82 58.93 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 118.472 -0.775 . . . . 0.0 113.024 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.8 t -84.85 -40.16 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 C-N-CA 125.152 1.381 . . . . 0.0 111.66 171.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.3 p -61.48 -54.13 47.39 Favored 'General case' 0 CA--C 1.518 -0.271 0 C-N-CA 123.496 0.718 . . . . 0.0 111.281 175.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.68 30.02 0.37 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.409 1.084 . . . . 0.0 113.29 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.68 -45.84 1.75 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 125.542 1.537 . . . . 0.0 111.952 178.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -128.52 46.5 2.59 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 122.107 0.956 . . . . 0.0 112.095 -177.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -89.66 -55.04 3.8 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.662 1.185 . . . . 0.0 112.668 178.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 O-C-N 120.301 -1.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 119.259 -0.401 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -72.52 129.77 15.17 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.305 2.004 . . . . 0.0 110.842 177.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -68.61 97.18 0.77 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.181 1.392 . . . . 0.0 110.883 177.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.36 160.8 30.56 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 124.089 0.955 . . . . 0.0 111.523 176.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -74.34 131.79 15.56 Favored 'Trans proline' 0 N--CA 1.453 -0.871 0 C-N-CA 122.449 2.1 . . . . 0.0 110.561 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -165.89 156.87 13.46 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 125.63 1.572 . . . . 0.0 108.987 173.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 60.55 164.26 0.1 OUTLIER Pre-proline 0 CA--C 1.556 1.188 0 C-N-CA 126.945 2.098 . . . . 0.0 113.053 -173.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -71.9 -176.86 2.26 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 121.897 1.731 . . . . 0.0 111.789 172.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -56.0 162.92 5.61 Favored Glycine 0 CA--C 1.538 1.491 0 C-N-CA 123.275 0.464 . . . . 0.0 112.979 172.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -159.1 128.47 5.49 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.835 0.854 . . . . 0.0 109.442 -177.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -91.64 90.85 7.75 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.716 1.206 . . . . 0.0 109.316 170.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -113.65 -179.1 3.54 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.726 1.211 . . . . 0.0 111.492 173.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.1 t -50.81 143.57 14.73 Favored Pre-proline 0 CA--C 1.544 0.741 0 C-N-CA 124.619 1.168 . . . . 0.0 111.905 176.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -72.67 71.38 3.27 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 123.733 2.955 . . . . 0.0 112.1 -176.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -124.42 18.37 8.94 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.752 1.621 . . . . 0.0 112.41 -175.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -164.7 -60.41 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.792 1.637 . . . . 0.0 109.925 175.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.512 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -54.11 -64.37 0.85 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.237 1.015 . . . . 0.0 110.843 -178.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -67.14 -21.68 65.82 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 118.365 -0.826 . . . . 0.0 111.453 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.39 -29.95 69.27 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 125.549 1.54 . . . . 0.0 112.27 175.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -71.32 -52.26 19.79 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.902 1.281 . . . . 0.0 110.051 172.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -61.76 -44.3 97.15 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 124.846 1.258 . . . . 0.0 112.607 -179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.95 -28.04 69.27 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.714 1.206 . . . . 0.0 113.069 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.98 -47.02 19.49 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.873 0.869 . . . . 0.0 111.189 172.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.15 -32.22 73.71 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 121.514 -0.741 . . . . 0.0 112.539 177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.682 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -53.15 -28.28 25.28 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.492 1.517 . . . . 0.0 112.325 169.538 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -68.07 -63.05 1.14 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.836 1.198 . . . . 0.0 111.242 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.405 ' O ' HG23 ' A' ' 31' ' ' VAL . 66.3 t80 -54.42 -48.47 71.62 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 123.23 0.612 . . . . 0.0 110.752 176.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.291 0.1 OUTLIER -57.91 -23.94 55.58 Favored 'General case' 0 CA--C 1.554 1.121 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 176.411 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -74.32 -51.13 16.11 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.911 1.684 . . . . 0.0 112.11 175.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.4 -8.18 55.4 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 177.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 27' ' ' TYR . 55.6 t -89.16 -38.85 11.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 C-N-CA 126.14 1.776 . . . . 0.0 111.84 171.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p -69.91 -35.85 74.92 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.404 1.082 . . . . 0.0 113.823 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -24.24 2.93 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.822 1.249 . . . . 0.0 113.99 172.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.3 mm100 -119.97 33.21 5.7 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.839 2.056 . . . . 0.0 110.536 179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.5 ttt180 -146.74 -54.5 0.24 Allowed 'General case' 0 C--N 1.343 0.304 0 C-N-CA 124.861 1.264 . . . . 0.0 112.348 178.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.84 27.44 0.75 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 127.072 2.149 . . . . 0.0 112.535 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.532 0 O-C-N 118.884 -2.385 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 116.803 -1.57 . . . . 0.0 111.783 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -68.44 176.55 5.58 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 122.458 2.106 . . . . 0.0 112.011 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.57 162.31 1.69 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 123.862 0.865 . . . . 0.0 111.557 170.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.41 157.23 31.61 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 123.482 0.713 . . . . 0.0 110.397 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -74.57 75.59 3.45 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 123.484 2.789 . . . . 0.0 110.517 175.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -70.01 113.71 7.48 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.696 0.798 . . . . 0.0 109.327 175.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.42 74.29 8.22 Favored Pre-proline 0 C--O 1.244 0.787 0 C-N-CA 124.693 1.197 . . . . 0.0 109.876 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -66.81 126.71 15.77 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.896 2.398 . . . . 0.0 109.314 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.5 -93.11 0.07 OUTLIER Glycine 0 CA--C 1.53 0.989 0 C-N-CA 123.731 0.681 . . . . 0.0 112.366 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -157.09 111.64 2.73 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.573 0.749 . . . . 0.0 110.458 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.95 96.59 4.8 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.53 1.532 . . . . 0.0 109.034 -178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -157.92 78.46 0.83 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.376 1.07 . . . . 0.0 109.351 178.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 t -64.69 146.37 98.44 Favored Pre-proline 0 CA--C 1.547 0.86 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.34 178.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -76.78 125.46 8.15 Favored 'Trans proline' 0 C--N 1.356 0.926 0 C-N-CA 122.561 2.174 . . . . 0.0 111.038 178.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -171.17 95.12 0.18 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 126.82 2.048 . . . . 0.0 106.906 -176.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 75.47 -44.88 0.53 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.756 0.823 . . . . 0.0 112.212 178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.527 HD12 ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -51.52 -55.78 17.07 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 125.534 1.534 . . . . 0.0 109.85 174.538 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 57.5 p -57.61 -32.53 67.3 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.286 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -20.31 64.18 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.853 1.261 . . . . 0.0 112.785 175.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -82.29 -49.1 10.43 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.097 1.359 . . . . 0.0 108.736 174.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -70.28 -45.19 66.84 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 123.942 0.897 . . . . 0.0 112.335 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.85 -37.1 85.51 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 126.164 1.786 . . . . 0.0 111.445 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t -72.82 -48.28 39.26 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 124.001 0.92 . . . . 0.0 111.041 174.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.0 tt -63.84 -32.06 73.45 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.191 0.596 . . . . 0.0 111.297 177.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.813 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -63.77 -24.79 67.9 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 126.333 1.853 . . . . 0.0 112.042 173.599 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -67.31 -59.2 3.61 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.674 1.125 . . . . 0.0 110.923 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.4 ' O ' HG23 ' A' ' 31' ' ' VAL . 53.6 t80 -54.78 -49.78 70.08 Favored 'General case' 0 C--O 1.227 -0.117 0 C-N-CA 123.549 0.74 . . . . 0.0 110.496 173.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.813 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.284 0.1 OUTLIER -57.91 -23.72 54.61 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.45 177.139 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -75.72 -48.07 23.44 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.116 1.766 . . . . 0.0 112.453 178.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -76.26 -6.39 51.22 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.66 -0.65 . . . . 0.0 112.689 175.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 27' ' ' TYR . 75.1 t -95.06 -29.14 4.05 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.301 0 C-N-CA 126.988 2.115 . . . . 0.0 112.799 172.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -76.03 -38.22 57.47 Favored 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 120.918 -1.114 . . . . 0.0 112.224 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.13 -23.43 1.25 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 114.689 1.366 . . . . 0.0 114.689 175.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -62.28 -64.54 0.9 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.644 1.578 . . . . 0.0 110.446 174.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -69.49 -30.05 67.83 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.18 0.592 . . . . 0.0 112.501 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -104.28 40.53 1.45 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.397 2.279 . . . . 0.0 110.534 -174.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.594 0 O-C-N 120.409 -1.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 N--CA 1.476 0.842 0 CA-C-O 117.464 -1.255 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.93 58.01 4.7 Favored 'Trans proline' 0 CA--C 1.547 1.157 0 C-N-CA 122.752 2.301 . . . . 0.0 111.731 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.69 139.58 48.18 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.934 1.694 . . . . 0.0 109.691 177.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -60.75 -53.88 59.98 Favored Pre-proline 0 CA--C 1.542 0.646 0 CA-C-O 118.093 -0.956 . . . . 0.0 112.466 171.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -77.44 88.25 1.43 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 122.982 2.455 . . . . 0.0 111.074 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -161.7 104.68 1.21 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.742 0.817 . . . . 0.0 109.459 175.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.37 161.63 37.89 Favored Pre-proline 0 CA--C 1.54 0.559 0 O-C-N 121.11 -0.994 . . . . 0.0 110.744 176.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -78.8 173.56 13.43 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.456 2.771 . . . . 0.0 112.244 172.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.4 -144.95 16.08 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.431 1.015 . . . . 0.0 110.789 -173.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 44.5 72.09 0.22 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 126.427 1.891 . . . . 0.0 113.178 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.6 t0 46.2 63.82 1.72 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.094 0.958 . . . . 0.0 111.447 -177.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.87 167.84 7.09 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.938 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.05 156.51 3.55 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 124.42 1.088 . . . . 0.0 112.102 176.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.53 -170.0 0.35 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 123.463 2.775 . . . . 0.0 111.132 176.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 78.78 89.04 0.06 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.585 1.954 . . . . 0.0 109.645 -177.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 54.8 35.94 25.3 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -178.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -53.32 -65.07 0.63 Allowed 'General case' 0 C--N 1.348 0.512 0 O-C-N 120.208 -1.558 . . . . 0.0 110.574 -178.921 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.94 -22.99 67.17 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-O 117.924 -1.036 . . . . 0.0 110.043 -177.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -32.82 70.48 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 125.273 1.429 . . . . 0.0 112.183 176.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -66.98 -45.58 77.24 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.5 0.72 . . . . 0.0 110.682 172.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -71.5 -47.74 53.43 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 124.7 1.2 . . . . 0.0 112.664 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.31 -39.2 89.6 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.169 1.788 . . . . 0.0 112.099 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.5 t -67.88 -52.0 41.55 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 117.984 0.356 . . . . 0.0 111.244 173.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.37 -36.46 73.53 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.708 -0.62 . . . . 0.0 112.02 176.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.696 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -53.89 -28.51 36.95 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 126.277 1.831 . . . . 0.0 112.663 171.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -67.32 -62.06 1.61 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.785 1.175 . . . . 0.0 111.115 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.46 -48.34 74.67 Favored 'General case' 0 N--CA 1.461 0.114 0 C-N-CA 123.131 0.572 . . . . 0.0 110.876 176.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.696 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.308 0.1 OUTLIER -57.08 -27.12 61.46 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 112.91 0.707 . . . . 0.0 112.91 176.248 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -68.02 -60.42 2.51 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 125.471 1.508 . . . . 0.0 111.063 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.4 -19.24 65.75 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.634 0.774 . . . . 0.0 112.756 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 72.5 t -78.27 -40.29 25.26 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 C-N-CA 126.354 1.862 . . . . 0.0 111.628 169.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p -65.95 -44.68 84.32 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 118.066 -0.969 . . . . 0.0 112.945 176.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.3 mtp85 -44.23 -39.38 4.39 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.271 1.428 . . . . 0.0 113.478 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 39.6 mm-40 -52.87 -43.2 65.93 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.479 1.112 . . . . 0.0 113.363 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -134.25 53.41 2.0 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.242 1.417 . . . . 0.0 112.131 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -92.87 -51.52 5.04 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.039 1.336 . . . . 0.0 110.801 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 O-C-N 118.701 -2.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.549 0.927 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.89 151.07 68.21 Favored 'Trans proline' 0 N--CA 1.457 -0.641 0 C-N-CA 120.979 1.119 . . . . 0.0 111.134 -179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -134.84 78.42 1.74 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.656 1.182 . . . . 0.0 109.686 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -132.99 153.58 81.03 Favored Pre-proline 0 N--CA 1.468 0.471 0 C-N-CA 124.231 1.013 . . . . 0.0 110.42 -178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -69.26 173.76 10.06 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.72 2.28 . . . . 0.0 111.439 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.08 111.83 0.54 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.112 0.965 . . . . 0.0 112.495 176.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.28 149.91 36.49 Favored Pre-proline 0 CA--C 1.539 0.551 0 O-C-N 121.528 -0.733 . . . . 0.0 110.679 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -70.92 165.12 33.31 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.517 2.145 . . . . 0.0 111.423 175.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -105.79 155.43 16.82 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.222 0.915 . . . . 0.0 111.666 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -164.28 76.62 0.34 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.49 0.716 . . . . 0.0 111.152 -178.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.4 t0 48.5 82.98 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 125.414 1.485 . . . . 0.0 113.903 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -146.41 143.83 29.3 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.397 -0.814 . . . . 0.0 110.693 177.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.5 146.69 72.0 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.777 0.831 . . . . 0.0 111.198 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -72.87 118.67 5.67 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.61 2.207 . . . . 0.0 111.863 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -130.11 72.07 1.47 Allowed 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.632 1.973 . . . . 0.0 108.936 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 67.18 -4.51 0.83 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.238 1.415 . . . . 0.0 113.316 -178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.488 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -60.89 -60.31 3.99 Favored 'General case' 0 C--N 1.343 0.294 0 O-C-N 120.416 -1.428 . . . . 0.0 110.343 174.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.84 -18.98 62.02 Favored 'General case' 0 C--O 1.217 -0.639 0 O-C-N 122.08 -0.388 . . . . 0.0 110.836 -179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.49 -24.16 65.07 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 124.438 1.095 . . . . 0.0 112.743 173.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -76.32 -47.76 22.42 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.415 1.086 . . . . 0.0 110.506 172.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -72.41 -46.76 53.73 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.478 1.111 . . . . 0.0 112.167 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.99 -30.85 71.91 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.637 1.975 . . . . 0.0 112.129 179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.75 -43.42 62.91 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.231 0.612 . . . . 0.0 110.742 170.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.88 -33.72 76.68 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 119.266 -0.397 . . . . 0.0 112.011 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.686 ' HA ' HD23 ' A' ' 28' ' ' LEU . 6.2 tpm_? -48.2 -36.09 13.06 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.952 1.701 . . . . 0.0 111.803 176.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -64.1 -59.78 4.03 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 126.317 1.847 . . . . 0.0 112.174 177.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -55.4 -50.21 70.35 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.12 0.568 . . . . 0.0 110.513 174.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.686 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.264 0.0 OUTLIER -59.64 -18.69 43.79 Favored 'General case' 0 CA--C 1.556 1.198 0 O-C-N 121.583 -0.698 . . . . 0.0 112.4 175.929 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -77.75 -52.79 8.37 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 126.1 1.76 . . . . 0.0 112.743 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.96 -16.83 62.67 Favored 'General case' 0 N--CA 1.465 0.286 0 O-C-N 121.34 -0.85 . . . . 0.0 113.062 176.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.7 t -81.9 -39.65 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 126.433 1.893 . . . . 0.0 112.372 173.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 28' ' ' LEU . 24.0 p -68.66 -43.08 76.96 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 117.524 -1.226 . . . . 0.0 111.388 176.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.2 ttt-85 -45.36 -44.97 12.22 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.453 1.101 . . . . 0.0 112.231 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -50.95 -43.97 60.42 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.713 1.605 . . . . 0.0 112.462 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.36 47.45 2.19 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.471 1.908 . . . . 0.0 111.98 -179.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -88.65 50.36 1.95 Allowed 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 123.74 1.733 . . . . 0.0 111.361 -178.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.435 0 O-C-N 118.741 -2.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 . . . . . 0 N--CA 1.475 0.805 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -73.96 168.62 24.35 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 121.855 1.703 . . . . 0.0 110.943 173.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -144.03 140.02 29.31 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.098 1.759 . . . . 0.0 106.798 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -51.51 79.22 Favored Pre-proline 0 N--CA 1.47 0.538 0 CA-C-O 117.419 -1.277 . . . . 0.0 112.9 169.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -75.99 167.17 26.62 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.563 2.175 . . . . 0.0 110.813 172.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 60.18 178.74 0.09 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.534 1.534 . . . . 0.0 112.331 -171.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 55.06 74.73 0.69 Allowed Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 124.403 1.081 . . . . 0.0 112.313 -178.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -69.14 173.62 10.15 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 122.617 2.212 . . . . 0.0 112.233 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.59 82.58 0.09 OUTLIER Glycine 0 C--N 1.34 0.78 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.179 -179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.19 32.04 0.08 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.136 1.375 . . . . 0.0 114.132 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.08 80.4 9.19 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.905 1.682 . . . . 0.0 109.976 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.86 59.1 3.05 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.186 -0.946 . . . . 0.0 111.33 174.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -126.49 84.95 61.25 Favored Pre-proline 0 N--CA 1.471 0.583 0 C-N-CA 124.456 1.103 . . . . 0.0 110.377 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -73.62 54.69 3.02 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 124.415 3.41 . . . . 0.0 112.3 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -128.4 8.97 6.03 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.346 1.458 . . . . 0.0 111.81 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -154.25 -39.5 0.09 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.527 1.131 . . . . 0.0 112.225 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.495 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -62.8 -62.0 2.03 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 119.242 0.928 . . . . 0.0 110.395 173.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -60.07 -18.9 50.13 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -177.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -32.7 68.83 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 126.19 1.796 . . . . 0.0 112.186 173.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -70.4 -48.54 55.65 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.981 1.312 . . . . 0.0 109.472 174.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -63.26 -46.64 85.92 Favored 'General case' 0 C--O 1.22 -0.454 0 C-N-CA 124.936 1.294 . . . . 0.0 112.181 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.54 -33.17 71.07 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.842 1.257 . . . . 0.0 112.628 173.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.54 -45.37 46.02 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 118.199 0.454 . . . . 0.0 111.229 173.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -65.07 -28.96 69.83 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.81 0.844 . . . . 0.0 112.518 177.338 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.706 ' HA ' HD23 ' A' ' 28' ' ' LEU . 25.3 tpt180 -50.05 -37.27 32.53 Favored 'General case' 0 C--O 1.207 -1.168 0 C-N-CA 125.247 1.419 . . . . 0.0 111.471 171.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -61.39 -59.27 5.53 Favored 'General case' 0 C--O 1.221 -0.402 0 C-N-CA 123.881 0.872 . . . . 0.0 111.816 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.43 -49.09 73.32 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 123.4 0.68 . . . . 0.0 111.08 174.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.706 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.269 0.0 OUTLIER -60.65 -17.38 47.01 Favored 'General case' 0 CA--C 1.563 1.463 0 O-C-N 121.177 -0.952 . . . . 0.0 112.906 175.665 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -78.14 -54.03 6.71 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.435 -2.041 . . . . 0.0 111.408 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 pp -71.12 -14.84 62.43 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 176.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.1 t -84.64 -38.44 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 125.482 1.513 . . . . 0.0 112.171 171.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.428 HG23 HD12 ' A' ' 28' ' ' LEU . 14.6 p -67.25 -47.96 69.19 Favored 'General case' 0 CA--C 1.508 -0.64 0 CA-C-O 116.682 -1.628 . . . . 0.0 110.913 175.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -40.12 -47.06 2.3 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 120.22 1.373 . . . . 0.0 113.348 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.6 tm0? -49.63 -44.39 47.44 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.855 1.662 . . . . 0.0 112.551 179.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 12.7 mmm180 -135.23 54.55 1.93 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.148 1.779 . . . . 0.0 111.676 177.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -85.31 -51.55 6.5 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 122.171 0.986 . . . . 0.0 110.378 -177.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.591 0 O-C-N 120.059 -1.65 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 . . . . . 0 N--CA 1.482 1.137 0 CA-C-O 119.406 -0.331 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.62 0.81 8.72 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.091 2.527 . . . . 0.0 114.486 177.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.85 -93.01 0.07 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.704 1.601 . . . . 0.0 111.133 179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.8 mttt -126.31 162.77 44.29 Favored Pre-proline 0 N--CA 1.468 0.467 0 C-N-CA 125.577 1.551 . . . . 0.0 110.805 178.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -69.72 152.89 69.61 Favored 'Trans proline' 0 N--CA 1.456 -0.709 0 C-N-CA 122.316 2.011 . . . . 0.0 110.659 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -67.85 162.58 23.78 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.489 0.662 . . . . 0.0 110.785 175.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -116.11 86.69 17.51 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 124.48 1.112 . . . . 0.0 109.23 178.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -69.78 158.32 57.32 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.095 1.863 . . . . 0.0 111.094 177.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -73.8 176.16 46.38 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.094 173.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -158.05 131.9 7.91 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.869 0.867 . . . . 0.0 108.973 179.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -126.24 93.65 3.87 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 125.2 1.4 . . . . 0.0 109.09 178.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.48 163.34 33.0 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.287 0.635 . . . . 0.0 109.867 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 40.3 t -56.44 145.65 57.8 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 123.914 0.886 . . . . 0.0 111.231 175.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.77 69.2 3.69 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.004 3.136 . . . . 0.0 112.183 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -121.85 10.47 10.23 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.253 1.421 . . . . 0.0 112.493 -177.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -168.36 -52.27 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.036 1.734 . . . . 0.0 111.039 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.526 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -59.66 -63.17 1.4 Allowed 'General case' 0 C--N 1.344 0.338 0 CA-C-N 119.211 0.914 . . . . 0.0 110.137 177.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.5 t -63.33 -17.82 62.97 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 121.799 -0.563 . . . . 0.0 110.915 -178.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -26.36 67.25 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.814 1.246 . . . . 0.0 112.59 172.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -75.35 -49.25 19.69 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.019 0.928 . . . . 0.0 109.77 172.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -66.4 -50.43 63.48 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 125.005 1.322 . . . . 0.0 112.009 -178.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.37 -36.49 80.37 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.44 2.296 . . . . 0.0 112.491 178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.4 t -68.08 -54.64 16.75 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.2 1.0 . . . . 0.0 110.89 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.4 tt -61.33 -34.44 75.26 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.971 0.508 . . . . 0.0 111.309 177.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.815 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.59 -35.5 63.42 Favored 'General case' 0 C--O 1.214 -0.773 0 C-N-CA 125.995 1.718 . . . . 0.0 112.166 171.115 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -61.0 -56.64 18.74 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 120.036 1.289 . . . . 0.0 111.758 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -56.2 -50.44 71.22 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 123.576 0.75 . . . . 0.0 110.347 173.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.815 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.279 0.1 OUTLIER -57.47 -23.01 47.34 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-O 119.065 -0.493 . . . . 0.0 112.218 176.028 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.66 -49.19 16.77 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.32 1.848 . . . . 0.0 112.5 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -75.46 -12.58 60.27 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 174.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 54.2 t -86.55 -35.31 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 C-N-CA 126.017 1.727 . . . . 0.0 112.402 172.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 p -69.23 -44.96 70.95 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-O 117.52 -1.228 . . . . 0.0 111.556 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -44.1 -41.48 5.62 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.312 1.445 . . . . 0.0 114.213 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -50.7 -32.59 19.84 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.49 1.516 . . . . 0.0 112.97 174.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -154.73 67.87 0.7 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 127.338 2.255 . . . . 0.0 111.513 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -107.71 50.53 0.77 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 122.982 1.373 . . . . 0.0 111.993 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.606 0 O-C-N 119.261 -2.15 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 118.374 -0.822 . . . . 0.0 109.036 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -71.89 -166.67 0.27 Allowed 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 123.122 2.548 . . . . 0.0 111.697 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -39.62 119.69 1.0 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.353 1.461 . . . . 0.0 111.613 175.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -51.91 77.74 Favored Pre-proline 0 CA--C 1.542 0.655 0 CA-C-O 117.632 -1.175 . . . . 0.0 112.194 175.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -76.23 59.92 6.15 Favored 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.291 2.661 . . . . 0.0 111.947 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -151.88 40.84 0.65 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.542 1.537 . . . . 0.0 111.302 177.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -127.86 76.2 77.59 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.402 1.081 . . . . 0.0 109.817 174.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -74.52 165.17 32.28 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.503 2.135 . . . . 0.0 111.453 174.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.21 -176.23 39.62 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.861 1.22 . . . . 0.0 110.882 -176.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -74.31 36.99 0.1 Allowed 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -83.68 82.4 8.33 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.328 1.451 . . . . 0.0 110.34 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.53 112.5 13.14 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 121.593 -0.692 . . . . 0.0 110.239 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.8 t -124.44 143.59 43.54 Favored Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 123.791 0.836 . . . . 0.0 110.836 -179.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -69.38 178.18 4.59 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.758 2.305 . . . . 0.0 111.647 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 63.82 23.5 13.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.019 1.328 . . . . 0.0 114.265 178.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -167.43 -53.11 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.338 1.855 . . . . 0.0 110.381 -176.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.483 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -60.69 -65.49 0.68 Allowed 'General case' 0 C--N 1.346 0.432 0 CA-C-N 119.527 1.058 . . . . 0.0 110.52 177.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.79 -16.83 63.57 Favored 'General case' 0 C--O 1.218 -0.557 0 O-C-N 121.876 -0.515 . . . . 0.0 110.539 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.93 -27.7 66.99 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.121 1.368 . . . . 0.0 112.059 173.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -72.05 -49.26 38.18 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.157 0.983 . . . . 0.0 110.633 173.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -72.33 -44.19 63.03 Favored 'General case' 0 C--O 1.22 -0.456 0 C-N-CA 124.576 1.15 . . . . 0.0 112.351 -177.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.94 -41.22 95.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.993 2.117 . . . . 0.0 112.125 176.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -47.43 67.85 Favored 'General case' 0 C--N 1.343 0.304 0 O-C-N 122.126 -0.359 . . . . 0.0 111.299 173.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 9.2 tp -60.48 -34.94 74.77 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 121.872 -0.518 . . . . 0.0 111.663 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.668 ' HA ' HD23 ' A' ' 28' ' ' LEU . 67.9 ttt180 -60.17 -17.5 41.34 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.087 2.155 . . . . 0.0 113.188 173.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -75.85 -59.02 2.94 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.316 0.962 . . . . 0.0 111.402 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -57.25 -49.15 76.96 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 122.886 0.474 . . . . 0.0 110.538 175.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.668 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.266 0.1 OUTLIER -58.92 -18.67 35.5 Favored 'General case' 0 CA--C 1.562 1.43 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 175.652 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -76.12 -57.04 4.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 119.694 -1.879 . . . . 0.0 111.722 174.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 pp -69.57 -15.13 63.16 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -84.22 -37.48 12.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 C-N-CA 126.554 1.942 . . . . 0.0 112.265 170.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 p -71.05 -41.4 70.81 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-O 117.87 -1.062 . . . . 0.0 111.339 177.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.62 -45.43 6.79 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 119.644 1.111 . . . . 0.0 113.8 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -47.55 -42.27 23.13 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.771 1.628 . . . . 0.0 112.908 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -136.47 54.53 1.88 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.759 1.623 . . . . 0.0 111.682 178.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -76.24 -50.28 14.88 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.08 0.943 . . . . 0.0 111.195 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.527 0 O-C-N 119.93 -1.731 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 117.972 -1.013 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -69.56 141.67 46.67 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.397 2.065 . . . . 0.0 110.942 175.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.89 -21.5 15.68 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 118.033 -0.984 . . . . 0.0 113.029 175.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -36.95 94.65 0.08 OUTLIER Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 128.466 2.706 . . . . 0.0 112.504 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -76.3 102.87 1.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 122.432 2.088 . . . . 0.0 111.074 -171.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -82.32 66.8 8.08 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.588 0.755 . . . . 0.0 111.085 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -160.28 82.7 2.18 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 123.349 0.66 . . . . 0.0 110.635 175.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -72.57 143.31 37.9 Favored 'Trans proline' 0 C--O 1.24 0.615 0 C-N-CA 122.451 2.101 . . . . 0.0 111.628 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.19 -106.68 3.01 Favored Glycine 0 C--O 1.22 -0.734 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -175.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -170.1 145.63 2.87 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.01 1.324 . . . . 0.0 108.035 175.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -109.96 -151.24 0.47 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.672 1.589 . . . . 0.0 108.604 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 85.92 47.33 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.944 2.898 . . . . 0.0 111.27 175.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.87 149.74 57.17 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 123.733 0.813 . . . . 0.0 111.836 -176.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -72.03 -171.52 0.7 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.664 2.909 . . . . 0.0 111.725 176.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 62.49 19.1 10.95 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.051 1.34 . . . . 0.0 113.605 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -168.05 -52.33 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 127.003 2.121 . . . . 0.0 110.662 -174.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.463 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -60.69 -62.42 1.88 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.696 1.134 . . . . 0.0 111.334 176.494 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.44 -14.65 52.74 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.286 -0.884 . . . . 0.0 112.54 178.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -33.61 74.22 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 125.101 1.36 . . . . 0.0 111.71 173.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -67.59 -47.11 70.69 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.126 0.971 . . . . 0.0 110.476 173.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -62.38 -48.51 79.43 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.379 1.072 . . . . 0.0 110.939 178.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.68 -35.35 79.41 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.59 1.156 . . . . 0.0 112.487 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.99 -48.82 27.68 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.346 0.521 . . . . 0.0 112.122 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 tt -61.31 -33.11 73.05 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.555 0.616 . . . . 0.0 111.349 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.688 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.74 -26.11 32.03 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 125.881 1.673 . . . . 0.0 113.153 169.132 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -68.97 -62.16 1.49 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 120.36 1.436 . . . . 0.0 111.706 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -55.8 -48.44 75.38 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.358 0.663 . . . . 0.0 110.629 176.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.688 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.287 0.1 OUTLIER -57.07 -27.05 61.37 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 176.343 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -68.53 -59.74 2.93 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.352 1.461 . . . . 0.0 111.003 177.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.89 -17.0 64.69 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.939 0.896 . . . . 0.0 113.048 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.1 t -81.77 -37.71 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 C-N-CA 126.107 1.763 . . . . 0.0 111.962 169.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.8 p -66.75 -45.04 79.85 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 117.726 -1.13 . . . . 0.0 112.302 175.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 10.6 mtp180 -44.18 -39.79 4.6 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 125.078 1.351 . . . . 0.0 113.131 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -49.34 -38.16 27.15 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.09 1.756 . . . . 0.0 113.031 175.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 71.5 mtt180 -136.26 56.72 1.8 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.605 1.962 . . . . 0.0 111.299 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -109.74 54.2 0.67 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 123.198 1.475 . . . . 0.0 111.985 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.604 0 O-C-N 119.715 -1.866 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.2 62.14 5.96 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 124.15 3.234 . . . . 0.0 110.99 174.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.11 168.05 20.54 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.538 1.535 . . . . 0.0 109.824 175.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.0 ptpp? -55.89 151.42 24.18 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 123.919 0.887 . . . . 0.0 111.492 177.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -72.51 90.3 0.81 Allowed 'Trans proline' 0 CA--C 1.539 0.763 0 C-N-CA 123.171 2.581 . . . . 0.0 111.206 -178.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -99.01 82.64 2.77 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.978 1.311 . . . . 0.0 109.014 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -134.51 154.84 79.93 Favored Pre-proline 0 C--O 1.234 0.267 0 C-N-CA 123.987 0.915 . . . . 0.0 110.943 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -77.28 156.16 33.03 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 122.684 2.256 . . . . 0.0 112.041 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 70.5 156.73 1.89 Allowed Glycine 0 CA--C 1.534 1.227 0 C-N-CA 124.542 1.068 . . . . 0.0 112.847 -172.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -170.48 134.13 1.1 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.807 0.843 . . . . 0.0 109.914 178.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -129.69 73.8 1.55 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.659 1.184 . . . . 0.0 111.1 -179.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.6 173.06 13.56 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.443 -0.786 . . . . 0.0 111.257 179.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.9 t -56.0 147.24 45.28 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 124.005 0.922 . . . . 0.0 111.091 173.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -72.63 54.67 2.51 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 124.383 3.389 . . . . 0.0 112.968 179.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -97.55 9.7 41.77 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.506 1.922 . . . . 0.0 113.237 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -163.4 -44.18 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.746 1.618 . . . . 0.0 111.473 -176.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.491 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -60.04 -64.63 0.88 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.2 1.0 . . . . 0.0 110.956 176.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.77 -15.13 52.14 Favored 'General case' 0 C--O 1.221 -0.397 0 CA-C-O 118.0 -1.0 . . . . 0.0 111.814 -178.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -32.64 71.46 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.582 1.153 . . . . 0.0 112.136 171.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -70.01 -49.5 50.81 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.358 1.063 . . . . 0.0 110.161 175.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -66.87 -46.36 75.22 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.299 1.039 . . . . 0.0 112.144 -179.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.72 -33.65 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.407 1.883 . . . . 0.0 112.385 174.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.0 t -69.01 -50.36 49.53 Favored 'General case' 0 C--N 1.34 0.173 0 C-N-CA 122.548 0.339 . . . . 0.0 111.84 173.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.7 -32.07 73.15 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.012 0.369 . . . . 0.0 111.774 178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.794 ' HA ' HD23 ' A' ' 28' ' ' LEU . 35.5 ttt180 -55.23 -31.35 61.42 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 125.815 1.646 . . . . 0.0 112.097 170.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.5 t60 -61.14 -59.82 4.73 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.886 1.221 . . . . 0.0 111.604 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.441 ' O ' HG23 ' A' ' 31' ' ' VAL . 64.4 t80 -56.24 -49.46 74.09 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.71 0.804 . . . . 0.0 110.592 175.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.794 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.266 0.1 OUTLIER -56.93 -26.78 60.08 Favored 'General case' 0 CA--C 1.557 1.244 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 177.168 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -68.8 -55.23 11.87 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.924 1.689 . . . . 0.0 111.035 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.98 -16.66 61.51 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 27' ' ' TYR . 46.0 t -75.26 -40.03 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 C-N-CA 126.078 1.751 . . . . 0.0 112.144 172.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p -82.23 -40.91 20.98 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 123.837 0.855 . . . . 0.0 111.964 177.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 10.1 mtt180 -47.75 -36.07 10.91 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.337 1.455 . . . . 0.0 113.397 178.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -35.03 11.96 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.816 1.246 . . . . 0.0 113.398 174.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.6 mmm180 -124.46 45.07 2.6 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.348 1.859 . . . . 0.0 111.421 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -136.4 36.58 2.72 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 122.848 1.309 . . . . 0.0 112.293 -178.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.575 0 O-C-N 118.867 -2.395 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 116.817 -1.563 . . . . 0.0 111.911 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.92 67.72 5.81 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 123.656 2.904 . . . . 0.0 111.44 -178.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -120.62 23.38 10.82 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.84 2.056 . . . . 0.0 110.715 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.83 156.75 79.09 Favored Pre-proline 0 CA--C 1.541 0.613 0 C-N-CA 125.508 1.523 . . . . 0.0 111.098 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.86 49.19 1.83 Allowed 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 124.649 3.566 . . . . 0.0 113.275 -178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -165.04 109.43 0.89 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.211 1.404 . . . . 0.0 109.677 179.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -142.58 154.81 63.62 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.036 0.935 . . . . 0.0 110.999 176.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -76.59 160.96 34.56 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 123.315 2.677 . . . . 0.0 112.51 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 74.42 151.06 2.24 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.121 1.344 . . . . 0.0 112.726 -172.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -76.24 67.54 2.52 Favored 'General case' 0 CA--C 1.549 0.937 0 O-C-N 121.385 -1.068 . . . . 0.0 111.204 174.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -110.04 83.03 1.69 Allowed 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.197 1.399 . . . . 0.0 111.239 -177.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.59 83.09 2.11 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.449 1.1 . . . . 0.0 110.156 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.86 151.06 16.56 Favored Pre-proline 0 CA--C 1.541 0.625 0 C-N-CA 124.63 1.172 . . . . 0.0 112.114 177.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -73.13 98.77 1.04 Allowed 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.986 2.457 . . . . 0.0 110.576 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -141.11 77.45 1.6 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 126.014 1.726 . . . . 0.0 109.099 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 63.9 11.48 6.04 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.463 1.105 . . . . 0.0 112.501 -179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.48 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -57.74 -63.34 1.28 Allowed 'General case' 0 C--N 1.347 0.476 0 C-N-CA 126.09 1.756 . . . . 0.0 110.837 179.464 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.51 -16.36 63.59 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 118.548 -0.739 . . . . 0.0 111.688 -177.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -26.91 68.59 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 125.84 1.656 . . . . 0.0 112.197 171.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -73.73 -50.19 21.96 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.175 0.99 . . . . 0.0 109.663 172.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -61.94 -48.18 81.56 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 124.422 1.089 . . . . 0.0 111.613 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.72 77.41 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.293 1.437 . . . . 0.0 113.282 175.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -55.05 17.55 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.332 0.653 . . . . 0.0 111.202 174.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.13 -33.9 75.35 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.588 0.355 . . . . 0.0 111.487 178.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.777 ' HA ' HD23 ' A' ' 28' ' ' LEU . 4.9 tmm_? -56.12 -34.12 65.78 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 126.212 1.805 . . . . 0.0 111.857 171.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -59.66 -60.3 4.06 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 120.19 1.359 . . . . 0.0 110.956 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -55.57 -49.03 73.79 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 123.365 0.666 . . . . 0.0 110.932 175.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.777 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.297 0.1 OUTLIER -56.11 -28.71 58.91 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-O 119.004 -0.522 . . . . 0.0 112.391 176.112 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -68.07 -58.76 3.96 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 125.681 1.592 . . . . 0.0 111.358 178.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.67 -17.69 64.68 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.838 0.855 . . . . 0.0 112.822 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 62.1 t -76.69 -41.17 33.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 C-N-CA 125.492 1.517 . . . . 0.0 111.501 168.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.5 p -71.85 -37.69 70.21 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -48.76 -33.98 11.34 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.799 1.24 . . . . 0.0 113.44 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -111.45 19.58 18.06 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.133 1.773 . . . . 0.0 111.966 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.87 85.04 0.1 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.713 1.605 . . . . 0.0 111.781 -176.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 51.7 t80 -155.4 -50.48 0.08 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.71 0.767 . . . . 0.0 112.385 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.467 0 O-C-N 119.358 -2.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 117.646 -1.169 . . . . 0.0 112.016 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.0 Cg_endo -72.02 0.52 7.09 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.636 2.891 . . . . 0.0 114.05 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.32 147.34 37.98 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 127.985 2.514 . . . . 0.0 108.558 177.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.7 mtpt -72.31 -56.04 4.44 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 125.005 1.322 . . . . 0.0 112.422 170.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -72.77 99.35 1.06 Allowed 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.3 2.0 . . . . 0.0 109.572 176.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -84.18 168.62 15.6 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 123.88 0.872 . . . . 0.0 110.748 172.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.521 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . 64.37 169.09 0.1 Allowed Pre-proline 0 CA--C 1.552 1.047 0 C-N-CA 125.348 1.459 . . . . 0.0 111.797 -174.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 19.8 Cg_endo -70.08 169.88 18.28 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 121.226 1.284 . . . . 0.0 111.072 172.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.82 -164.23 1.34 Allowed Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.068 0.842 . . . . 0.0 112.407 172.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.85 120.16 8.4 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.74 -0.859 . . . . 0.0 111.319 -178.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -107.15 86.79 2.37 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.775 1.63 . . . . 0.0 110.12 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -150.19 139.13 20.97 Favored 'General case' 0 C--N 1.333 -0.124 0 O-C-N 121.53 -0.731 . . . . 0.0 109.296 177.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t 39.22 83.25 0.21 Allowed Pre-proline 0 N--CA 1.468 0.442 0 C-N-CA 126.419 1.887 . . . . 0.0 111.774 -176.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -72.15 63.42 3.42 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.704 2.936 . . . . 0.0 111.906 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -86.7 18.87 3.15 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.551 1.94 . . . . 0.0 113.096 -178.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -166.3 -45.15 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.451 1.5 . . . . 0.0 110.495 -175.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.525 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -54.93 -64.99 0.66 Allowed 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.082 0.953 . . . . 0.0 110.669 176.946 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.59 -20.3 65.54 Favored 'General case' 0 N--CA 1.462 0.155 0 O-C-N 121.383 -0.823 . . . . 0.0 111.897 -178.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.87 -31.62 71.08 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.536 1.134 . . . . 0.0 111.838 174.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -72.48 -48.72 38.52 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.488 1.115 . . . . 0.0 110.748 175.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -62.23 -46.74 87.5 Favored 'General case' 0 C--O 1.217 -0.641 0 C-N-CA 124.15 0.98 . . . . 0.0 110.62 178.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.09 -38.2 73.01 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.094 1.357 . . . . 0.0 112.421 176.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.7 t -65.19 -55.55 17.93 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 123.546 0.738 . . . . 0.0 111.245 175.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 tt -62.88 -31.25 72.26 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.928 -0.482 . . . . 0.0 111.503 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.842 ' HA ' HD23 ' A' ' 28' ' ' LEU . 39.2 ttt180 -61.41 -28.56 69.34 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 126.189 1.796 . . . . 0.0 111.766 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -63.6 -61.36 2.37 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 120.061 1.3 . . . . 0.0 111.009 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.478 ' O ' HG23 ' A' ' 31' ' ' VAL . 61.3 t80 -53.81 -49.53 68.15 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 123.293 0.637 . . . . 0.0 110.989 174.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.842 HD23 ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -57.92 -22.34 48.24 Favored 'General case' 0 CA--C 1.557 1.213 0 O-C-N 121.179 -0.95 . . . . 0.0 113.39 177.219 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.97 -52.58 12.37 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.357 1.863 . . . . 0.0 111.062 176.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -74.45 -12.02 60.39 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 177.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 27' ' ' TYR . 55.6 t -83.16 -33.58 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 C-N-CA 125.536 1.535 . . . . 0.0 112.451 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.6 p -86.26 -38.18 17.83 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 124.592 1.157 . . . . 0.0 111.806 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -44.51 -42.35 7.11 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 125.235 1.414 . . . . 0.0 113.56 176.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.64 -42.22 56.09 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.728 1.211 . . . . 0.0 112.004 176.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mtp-105 -122.76 53.27 1.28 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.242 1.817 . . . . 0.0 111.536 178.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -104.07 55.76 0.73 Allowed 'General case' 0 C--O 1.223 -0.317 0 CA-C-O 123.28 1.515 . . . . 0.0 110.716 178.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.566 0 O-C-N 119.361 -2.087 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 . . . . . 0 N--CA 1.475 0.794 0 CA-C-O 119.289 -0.386 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -77.29 53.16 4.14 Favored 'Trans proline' 0 CA--C 1.551 1.355 0 C-N-CA 124.186 3.258 . . . . 0.0 112.583 178.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.39 142.22 12.62 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.291 1.436 . . . . 0.0 109.336 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.7 mttt 166.49 -57.39 0.0 OUTLIER Pre-proline 0 N--CA 1.481 1.117 0 C-N-CA 128.552 2.741 . . . . 0.0 111.328 -176.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -76.43 90.18 1.22 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 122.582 2.188 . . . . 0.0 110.897 178.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -139.41 146.35 40.03 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.936 1.294 . . . . 0.0 109.365 176.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -87.94 153.03 51.81 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 123.358 0.663 . . . . 0.0 111.277 175.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -72.55 109.63 2.81 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.94 2.426 . . . . 0.0 111.219 177.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.02 92.07 0.55 Allowed Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.396 1.474 . . . . 0.0 111.296 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -145.05 99.68 3.36 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.735 0.814 . . . . 0.0 110.7 -178.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.9 p30 -127.0 83.26 2.15 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.463 1.905 . . . . 0.0 111.431 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -103.96 101.38 11.16 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.796 0.838 . . . . 0.0 109.657 178.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.41 163.85 2.3 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 125.251 1.421 . . . . 0.0 112.213 176.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -69.39 -172.22 0.52 Allowed 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.409 2.072 . . . . 0.0 110.447 173.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . 0.264 11.9 pt-20 53.09 18.16 1.09 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 125.05 1.34 . . . . 0.0 114.454 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -162.54 -38.84 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 127.042 2.137 . . . . 0.0 111.257 -175.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.466 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -57.45 -60.18 4.04 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.473 1.488 . . . . 0.0 111.006 177.009 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.3 t -62.7 -19.51 63.96 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.179 -0.95 . . . . 0.0 112.518 -177.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -34.42 72.36 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.78 1.632 . . . . 0.0 111.25 173.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -67.78 -51.95 42.91 Favored 'General case' 0 C--O 1.222 -0.385 0 C-N-CA 124.179 0.991 . . . . 0.0 110.507 172.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -55.33 -47.78 75.17 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.356 1.062 . . . . 0.0 111.212 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.55 -36.8 76.87 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.02 0.928 . . . . 0.0 112.66 177.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -45.78 54.23 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.929 0.892 . . . . 0.0 111.64 174.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.26 -34.19 76.05 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.9 1.28 . . . . 0.0 111.333 177.16 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.645 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -58.71 -21.01 53.86 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 125.343 1.457 . . . . 0.0 112.711 170.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.74 -59.08 3.17 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 120.572 1.533 . . . . 0.0 111.146 174.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -55.9 -47.91 76.58 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.213 0.605 . . . . 0.0 111.048 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.645 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.279 0.1 OUTLIER -60.61 -18.66 54.49 Favored 'General case' 0 CA--C 1.558 1.264 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 175.819 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -76.76 -56.09 4.91 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 119.904 -1.748 . . . . 0.0 111.313 175.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 pp -70.21 -11.75 61.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 113.013 0.745 . . . . 0.0 113.013 177.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.8 t -86.96 -37.77 11.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 125.74 1.616 . . . . 0.0 112.539 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 p -70.72 -43.03 69.76 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.795 0.725 . . . . 0.0 111.915 175.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.8 ttt85 -46.54 -40.71 13.14 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.999 1.32 . . . . 0.0 112.812 -178.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -46.85 -33.28 4.37 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.664 1.986 . . . . 0.0 114.251 175.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.5 mtt85 -135.3 46.68 2.38 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 127.408 2.283 . . . . 0.0 110.835 179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -114.51 73.95 0.85 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.835 1.302 . . . . 0.0 111.372 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.597 0 O-C-N 119.617 -1.927 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 117.642 -1.17 . . . . 0.0 111.466 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -68.08 135.67 35.47 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 121.954 1.769 . . . . 0.0 110.232 179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.35 -92.21 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 124.657 1.183 . . . . 0.0 111.459 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -143.05 65.15 15.25 Favored Pre-proline 0 CA--C 1.539 0.531 0 C-N-CA 124.529 1.132 . . . . 0.0 110.065 172.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -71.96 169.02 22.33 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.365 2.044 . . . . 0.0 110.638 176.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 62.13 171.92 0.13 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.364 1.465 . . . . 0.0 112.376 -173.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.06 80.64 10.2 Favored Pre-proline 0 C--O 1.241 0.627 0 O-C-N 120.994 -1.066 . . . . 0.0 110.007 176.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -68.06 147.61 73.92 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.511 2.141 . . . . 0.0 110.577 179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.75 52.66 0.01 OUTLIER Glycine 0 CA--C 1.528 0.886 0 C-N-CA 123.435 0.54 . . . . 0.0 113.0 -177.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.38 46.08 0.41 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.228 1.411 . . . . 0.0 113.34 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 36.7 t0 59.25 77.55 0.3 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.816 1.646 . . . . 0.0 113.394 -178.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.32 78.91 1.44 Allowed 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.54 -0.725 . . . . 0.0 110.264 -174.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.1 t 36.12 76.35 0.45 Allowed Pre-proline 0 N--CA 1.475 0.823 0 C-N-CA 125.845 1.658 . . . . 0.0 112.158 -175.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.59 49.4 1.15 Allowed 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 124.478 3.452 . . . . 0.0 113.767 -176.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -74.31 0.47 14.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.481 2.312 . . . . 0.0 113.387 176.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -133.21 -44.1 0.85 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.745 2.018 . . . . 0.0 112.378 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.519 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -66.86 -59.96 3.08 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.891 0.769 . . . . 0.0 109.691 -179.47 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.0 m -63.45 -15.0 56.39 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 119.243 -0.408 . . . . 0.0 111.663 179.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -29.95 69.58 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.095 1.358 . . . . 0.0 112.352 170.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -75.25 -45.04 42.65 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.697 1.199 . . . . 0.0 110.456 172.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -65.44 -46.48 79.74 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 124.188 0.995 . . . . 0.0 112.141 -179.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.72 -39.71 85.6 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.065 1.346 . . . . 0.0 112.569 175.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.0 -49.03 55.58 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 122.952 0.501 . . . . 0.0 111.356 175.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -63.22 -34.11 76.95 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.126 0.57 . . . . 0.0 111.497 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.831 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.8 OUTLIER -58.33 -32.97 69.01 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 126.031 1.733 . . . . 0.0 111.625 172.139 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -59.37 -61.87 2.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 119.725 1.148 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -54.55 -48.99 71.35 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 123.273 0.629 . . . . 0.0 111.025 176.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.831 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.285 0.1 OUTLIER -56.33 -26.95 54.16 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 176.413 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -69.03 -60.0 2.65 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.425 1.89 . . . . 0.0 111.148 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -67.54 -14.53 63.02 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 178.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -84.38 -34.4 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 126.3 1.84 . . . . 0.0 112.092 170.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.9 p -71.29 -42.51 68.61 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 118.141 -0.933 . . . . 0.0 112.92 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 -44.1 -39.88 4.54 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.17 1.388 . . . . 0.0 112.168 179.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.21 -42.51 30.31 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.887 1.675 . . . . 0.0 112.813 176.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.45 58.54 1.77 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.774 2.03 . . . . 0.0 110.971 177.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -114.35 78.75 1.18 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 122.984 1.373 . . . . 0.0 110.098 177.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.531 0 O-C-N 119.638 -1.914 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 118.409 -0.805 . . . . 0.0 109.869 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.61 103.63 1.33 Allowed 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 123.544 2.829 . . . . 0.0 109.976 174.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.55 128.39 36.32 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.743 0.817 . . . . 0.0 109.975 172.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.04 85.19 0.17 Allowed Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 125.467 1.507 . . . . 0.0 111.406 -176.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -73.03 84.87 1.26 Allowed 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 123.449 2.766 . . . . 0.0 110.94 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 53.91 87.85 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.079 1.752 . . . . 0.0 112.88 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.3 147.64 86.85 Favored Pre-proline 0 CA--C 1.55 0.955 0 O-C-N 121.671 -0.643 . . . . 0.0 111.453 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -71.26 170.51 18.12 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.867 2.378 . . . . 0.0 111.35 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -70.77 101.32 0.91 Allowed Glycine 0 CA--C 1.528 0.886 0 CA-C-O 119.109 -0.828 . . . . 0.0 112.084 179.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -69.47 42.48 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.652 1.581 . . . . 0.0 114.721 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -86.59 72.19 10.27 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.653 1.581 . . . . 0.0 111.25 -177.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -156.93 168.86 26.22 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.933 1.293 . . . . 0.0 111.021 175.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 t 42.23 78.74 0.36 Allowed Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 126.097 1.759 . . . . 0.0 112.66 178.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -68.43 117.02 4.68 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.484 2.123 . . . . 0.0 110.472 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -131.7 76.94 1.74 Allowed 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 126.974 2.11 . . . . 0.0 107.071 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 68.44 -6.59 0.78 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.75 1.62 . . . . 0.0 113.532 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.523 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -59.8 -59.95 4.61 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 120.352 -1.467 . . . . 0.0 110.352 174.328 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.4 t -62.03 -19.61 63.06 Favored 'General case' 0 C--O 1.218 -0.596 0 O-C-N 121.841 -0.537 . . . . 0.0 111.357 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -29.48 63.93 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 124.421 1.089 . . . . 0.0 112.446 172.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -73.82 -47.84 35.61 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.558 1.143 . . . . 0.0 110.939 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -70.93 -43.68 67.71 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 124.355 1.062 . . . . 0.0 112.841 -177.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.18 -38.89 91.94 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.726 2.011 . . . . 0.0 111.705 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 t -68.06 -49.1 63.43 Favored 'General case' 0 C--N 1.346 0.45 0 O-C-N 122.046 -0.409 . . . . 0.0 110.622 172.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tt -61.62 -34.39 75.57 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.312 0.505 . . . . 0.0 112.095 177.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.711 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.67 -29.75 53.52 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 126.126 1.771 . . . . 0.0 112.093 171.037 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -67.51 -59.83 3.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 120.112 1.324 . . . . 0.0 111.967 -178.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -56.55 -48.83 76.46 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 123.31 0.644 . . . . 0.0 110.853 175.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.711 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.301 0.1 OUTLIER -56.61 -26.11 54.83 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-O 118.547 -0.739 . . . . 0.0 112.691 175.735 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -54.75 9.51 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.996 1.718 . . . . 0.0 112.64 178.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 pp -71.63 -14.55 62.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.837 0.855 . . . . 0.0 112.935 177.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 52.9 t -83.63 -38.51 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 C-N-CA 126.1 1.76 . . . . 0.0 111.816 170.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 p -67.07 -44.44 80.06 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 118.359 -0.829 . . . . 0.0 112.173 175.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 -47.95 -41.66 25.55 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.008 0.923 . . . . 0.0 113.03 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -50.81 -40.02 54.43 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 125.181 1.393 . . . . 0.0 112.691 176.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -144.25 68.24 1.26 Allowed 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.152 0.981 . . . . 0.0 112.229 176.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -96.99 -52.45 3.86 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.889 0.852 . . . . 0.0 112.245 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.581 0 O-C-N 119.406 -2.059 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 117.387 -1.292 . . . . 0.0 111.699 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.64 174.88 10.36 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.053 1.835 . . . . 0.0 111.749 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -110.29 162.6 14.47 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.522 1.129 . . . . 0.0 110.467 175.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -153.2 87.62 3.89 Favored Pre-proline 0 CA--C 1.544 0.743 0 C-N-CA 123.698 0.799 . . . . 0.0 110.055 178.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -72.9 58.78 3.42 Favored 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 124.25 3.3 . . . . 0.0 112.733 -176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 55.24 177.63 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.076 1.751 . . . . 0.0 113.15 -168.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -156.32 87.28 2.94 Favored Pre-proline 0 CA--C 1.541 0.631 0 O-C-N 121.365 -0.834 . . . . 0.0 110.16 171.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -72.8 174.08 12.41 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 122.2 1.933 . . . . 0.0 111.587 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.14 68.58 0.01 OUTLIER Glycine 0 CA--C 1.525 0.716 0 CA-C-O 119.295 -0.725 . . . . 0.0 111.9 -179.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -167.56 136.86 2.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.595 1.158 . . . . 0.0 109.792 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 13.1 p30 -120.98 67.88 0.87 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 126.231 1.813 . . . . 0.0 111.013 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -143.63 178.84 7.51 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.783 0.833 . . . . 0.0 111.533 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.35 152.44 79.49 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 123.139 0.575 . . . . 0.0 111.264 177.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -75.65 66.39 6.57 Favored 'Trans proline' 0 CA--C 1.545 1.051 0 C-N-CA 123.326 2.684 . . . . 0.0 112.012 -178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -113.42 5.79 16.9 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.985 1.714 . . . . 0.0 113.524 -177.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -163.64 -52.31 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 126.03 1.732 . . . . 0.0 110.075 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.485 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -57.75 -62.85 1.5 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.36 0.982 . . . . 0.0 110.689 179.014 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.44 -17.48 64.58 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.21 -0.931 . . . . 0.0 112.078 -177.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.67 -32.58 71.77 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 126.109 1.764 . . . . 0.0 111.161 172.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -71.98 -48.65 43.37 Favored 'General case' 0 C--N 1.343 0.307 0 C-N-CA 124.46 1.104 . . . . 0.0 110.43 173.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -58.91 -47.85 83.54 Favored 'General case' 0 C--O 1.222 -0.365 0 C-N-CA 123.945 0.898 . . . . 0.0 110.619 178.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.33 -36.54 82.49 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 119.13 0.877 . . . . 0.0 112.835 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 t -71.59 -51.46 23.22 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 122.871 0.468 . . . . 0.0 111.398 175.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.0 tt -62.73 -31.59 72.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.901 0.88 . . . . 0.0 111.938 178.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.709 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -52.33 -30.63 29.41 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 126.27 1.828 . . . . 0.0 111.84 169.108 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -64.92 -64.26 0.91 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 119.994 1.27 . . . . 0.0 110.986 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.418 ' O ' HG23 ' A' ' 31' ' ' VAL . 68.1 t80 -54.0 -48.36 70.51 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.615 0.766 . . . . 0.0 110.969 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.709 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.283 0.1 OUTLIER -57.69 -27.4 62.87 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.329 177.044 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -68.42 -55.21 12.67 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.707 1.603 . . . . 0.0 111.345 176.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -71.36 -10.93 60.55 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 178.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 27' ' ' TYR . 76.9 t -88.02 -35.6 8.35 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 125.823 1.649 . . . . 0.0 111.624 170.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.7 p -65.96 -42.21 90.25 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.83 -26.5 35.52 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 175.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -73.34 -17.65 61.27 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.42 1.088 . . . . 0.0 111.767 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -146.26 59.9 1.23 Allowed 'General case' 0 C--N 1.343 0.32 0 C-N-CA 127.333 2.253 . . . . 0.0 112.048 -174.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -117.14 70.63 0.78 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 123.026 1.393 . . . . 0.0 110.095 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.755 0 O-C-N 119.285 -2.134 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 117.356 -1.307 . . . . 0.0 111.341 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.06 171.26 17.92 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 121.69 1.594 . . . . 0.0 110.673 177.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -164.29 179.01 7.1 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.761 1.624 . . . . 0.0 108.495 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 70.41 82.03 0.18 Allowed Pre-proline 0 CA--C 1.547 0.842 0 C-N-CA 125.22 1.408 . . . . 0.0 110.566 179.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -70.0 175.88 7.71 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.89 2.393 . . . . 0.0 111.574 178.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -99.16 155.09 17.65 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 123.867 0.867 . . . . 0.0 111.453 176.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.25 81.47 8.78 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 124.538 1.135 . . . . 0.0 108.959 177.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -72.72 47.44 1.19 Allowed 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 124.034 3.156 . . . . 0.0 113.427 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 47.5 -143.75 5.93 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.389 1.471 . . . . 0.0 112.236 -172.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -161.25 118.42 2.28 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.291 0.637 . . . . 0.0 109.892 170.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -113.45 93.65 4.49 Favored 'General case' 0 C--O 1.233 0.211 0 C-N-CA 125.068 1.347 . . . . 0.0 109.223 176.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -70.03 57.45 0.15 Allowed 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 124.935 1.294 . . . . 0.0 111.535 171.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.02 143.11 35.68 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 125.78 1.632 . . . . 0.0 110.672 -177.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -69.06 178.07 4.49 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.356 2.037 . . . . 0.0 111.95 176.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 67.64 15.02 9.68 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.107 1.363 . . . . 0.0 113.803 178.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -159.77 -52.04 0.06 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.691 1.596 . . . . 0.0 111.039 -176.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.451 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -60.71 -59.86 4.72 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 119.461 1.028 . . . . 0.0 111.326 176.232 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.2 m -60.61 -19.25 57.3 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.182 -0.949 . . . . 0.0 112.563 -179.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -38.44 77.95 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.822 1.249 . . . . 0.0 111.004 171.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -66.95 -46.06 75.87 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 124.439 1.095 . . . . 0.0 111.039 175.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -60.93 -48.89 79.72 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 124.251 1.021 . . . . 0.0 111.349 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.05 -40.01 92.03 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.782 0.833 . . . . 0.0 112.402 175.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -48.41 75.22 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.342 0.519 . . . . 0.0 111.641 174.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -34.02 77.06 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.614 0.765 . . . . 0.0 111.5 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.737 ' HA ' HD23 ' A' ' 28' ' ' LEU . 28.5 ttm-85 -56.4 -32.82 65.18 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 125.28 1.432 . . . . 0.0 112.495 168.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -59.33 -60.79 3.3 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 119.994 1.27 . . . . 0.0 111.11 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -54.57 -48.88 71.53 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.452 0.701 . . . . 0.0 111.102 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.737 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.276 0.1 OUTLIER -58.55 -21.89 54.04 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 176.201 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -74.98 -54.77 6.61 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.651 1.58 . . . . 0.0 112.179 177.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.1 pp -68.44 -18.59 64.45 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.166 -0.959 . . . . 0.0 112.415 176.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.6 t -84.25 -28.26 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 126.2 1.8 . . . . 0.0 113.729 172.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.4 p -78.93 -43.41 24.76 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-O 117.629 -1.176 . . . . 0.0 111.709 172.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.13 -44.15 31.87 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 119.616 1.098 . . . . 0.0 113.654 176.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -70.86 -17.24 62.73 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.2 10.15 20.13 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.884 2.474 . . . . 0.0 112.806 178.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.9 38.53 0.71 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-O 123.586 1.66 . . . . 0.0 110.753 -176.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.528 0 O-C-N 118.708 -2.495 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 117.644 -1.17 . . . . 0.0 112.644 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -71.84 149.38 53.77 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.344 2.029 . . . . 0.0 110.287 179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 39.89 53.12 2.63 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.882 1.673 . . . . 0.0 112.914 -178.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -130.55 76.95 76.71 Favored Pre-proline 0 CA--C 1.539 0.524 0 C-N-CA 125.227 1.411 . . . . 0.0 108.556 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -79.07 156.0 26.22 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.93 2.42 . . . . 0.0 111.504 170.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -145.83 98.45 3.12 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 125.333 1.453 . . . . 0.0 109.433 -177.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -43.05 97.76 0.15 Allowed Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 125.333 1.453 . . . . 0.0 111.994 -175.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -78.6 121.18 5.03 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.84 1.693 . . . . 0.0 109.76 -169.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.53 59.05 0.51 Allowed Glycine 0 CA--C 1.522 0.482 0 CA-C-O 118.618 -1.101 . . . . 0.0 111.903 -174.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 66.08 124.78 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 127.168 2.187 . . . . 0.0 113.516 -176.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -113.39 93.06 4.22 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.323 1.049 . . . . 0.0 109.801 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.59 120.84 16.87 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.64 1.576 . . . . 0.0 109.856 177.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.79 147.67 41.57 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 124.146 0.978 . . . . 0.0 110.294 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.99 -171.96 0.45 Allowed 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.577 2.851 . . . . 0.0 111.054 175.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 52.0 20.44 1.25 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.509 1.524 . . . . 0.0 115.043 179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -163.62 -50.77 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.842 1.657 . . . . 0.0 110.649 -173.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.483 HD12 ' C ' ' A' ' 17' ' ' LEU . 0.4 OUTLIER -58.87 -62.56 1.79 Allowed 'General case' 0 C--N 1.347 0.48 0 CA-C-N 119.724 1.147 . . . . 0.0 110.909 176.747 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.5 t -62.79 -19.14 63.74 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 121.644 -0.66 . . . . 0.0 111.472 -178.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.57 -31.32 70.45 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 125.706 1.602 . . . . 0.0 112.098 172.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -71.4 -46.55 59.99 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.16 0.984 . . . . 0.0 110.467 172.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -67.6 -50.09 59.91 Favored 'General case' 0 C--O 1.222 -0.381 0 C-N-CA 124.593 1.157 . . . . 0.0 112.04 -178.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.14 -37.86 81.36 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.646 1.578 . . . . 0.0 112.623 177.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.2 t -69.9 -50.78 38.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 122.975 0.51 . . . . 0.0 111.423 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -36.6 77.07 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.334 0.516 . . . . 0.0 111.705 175.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.771 ' HA ' HD23 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -54.43 -35.24 62.75 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.74 1.616 . . . . 0.0 111.778 171.551 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -59.8 -57.98 10.55 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 119.834 1.197 . . . . 0.0 111.825 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -56.66 -49.65 74.42 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.04 0.536 . . . . 0.0 110.579 174.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.771 HD23 ' HA ' ' A' ' 25' ' ' ARG 0.293 0.1 OUTLIER -55.55 -27.97 52.09 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-O 118.629 -0.7 . . . . 0.0 112.2 176.946 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -68.93 -56.94 6.3 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 127.057 2.143 . . . . 0.0 112.242 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.63 -17.63 63.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.71 0.804 . . . . 0.0 112.37 178.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 63.1 t -78.49 -41.58 25.46 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 126.1 1.76 . . . . 0.0 111.444 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 p -68.55 -37.29 79.81 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.416 1.086 . . . . 0.0 113.27 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -19.69 12.95 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 175.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -116.67 21.17 13.61 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.278 1.831 . . . . 0.0 111.784 178.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -173.38 87.67 0.06 Allowed 'General case' 0 C--N 1.347 0.46 0 C-N-CA 126.755 2.022 . . . . 0.0 111.851 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -151.59 65.54 0.87 Allowed 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 123.072 1.415 . . . . 0.0 110.779 178.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 O-C-N 118.711 -2.493 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_