data_1cjq_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 1cjq _Structure_validation_residue.Date_analyzed 2016-10-12 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 ecloud orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt . . . . . 0 N--CA 1.497 1.876 0 N-CA-C 109.05 -0.722 . . . . 88.53 109.05 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -113.7 107.21 15.46 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.883 0.849 . . . . 70.99 112.51 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.9 p -61.14 172.6 1.0 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.62 -0.718 . . . . 51.49 111.14 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.75 -47.94 67.81 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.668 -0.696 . . . . 41.43 109.879 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.3 -17.45 63.73 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 112.617 0.599 . . . . 35.98 112.617 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.56 -42.03 17.24 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 106.73 -1.581 . . . . 30.83 106.73 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -61.23 -32.18 71.96 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 115.89 -0.595 . . . . 48.19 111.538 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -62.96 -59.69 4.48 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 105.346 -2.094 . . . . 35.17 105.346 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -45.61 -46.77 14.63 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 113.489 0.922 . . . . 38.46 113.489 -179.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' O ' ' NH1' ' B' ' 33' ' ' ARG . 9.0 ttp180 -69.3 -42.98 74.73 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.225 0.824 . . . . 48.5 113.225 179.454 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -70.55 -39.51 73.94 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 116.926 2.195 . . . . 61.88 116.926 -179.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -115.56 -39.08 3.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 117.157 2.28 . . . . 31.26 117.157 -175.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 tpp -60.79 127.39 31.39 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 114.265 1.209 . . . . 32.48 114.265 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -154.5 58.42 0.69 Allowed 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 106.665 -1.606 . . . . 33.58 106.665 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.32 -0.678 0 CA-C-N 114.308 -1.315 . . . . 68.09 107.646 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 . . . . . 0 N--CA 1.5 2.073 0 N-CA-C 112.016 0.376 . . . . 51.45 112.016 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -46.85 -45.13 20.05 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.07 0.948 . . . . 37.41 112.917 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' CYS . . . . . . . . . . . . . 68.0 m -62.94 -50.68 69.86 Favored 'General case' 0 CA--C 1.497 -1.071 0 C-N-CA 119.387 -0.925 . . . . 32.02 110.545 -178.714 -72.123 -79.365 -84.065 104.882 2.022 103.148 -60.765 -70.16 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -55.43 -33.09 63.26 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 119.047 -1.061 . . . . 47.5 110.851 179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -76.97 -62.82 1.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.01 1.115 . . . . 41.46 114.01 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 35.7 mmm -54.85 -47.31 74.33 Favored 'General case' 0 C--O 1.266 1.95 0 O-C-N 123.5 0.5 . . . . 24.23 111.739 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 42.1 mmm -59.02 -40.96 86.57 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-O 122.448 1.118 . . . . 37.24 109.392 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -61.38 -63.01 1.42 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 105.851 -1.907 . . . . 81.05 105.851 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 1.7 t -49.16 -55.82 11.19 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 115.015 1.487 . . . . 55.85 115.015 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ARG . . . . . 0.457 ' NH1' ' O ' ' A' ' 10' ' ' ARG . 12.7 mmt85 -63.51 9.54 0.06 Allowed 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 114.915 1.45 . . . . 44.7 114.915 -178.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 62.7 23.73 14.13 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.217 0.532 . . . . 59.06 110.886 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.11 -25.41 36.98 Favored 'General case' 0 C--O 1.242 0.668 0 C-N-CA 120.41 -0.516 . . . . 48.73 110.813 -179.743 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' THR . . . . . . . . . . . . . 30.9 p -136.1 33.5 2.85 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.543 -0.753 . . . . 61.61 111.662 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -94.24 -2.57 52.21 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.869 -0.605 . . . . 62.4 111.418 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -152.63 9.68 0.47 Allowed 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 120.977 -0.289 . . . . 70.29 111.45 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . 22.1 ptt-85 -179.59 164.13 1.25 Allowed 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 105.524 -2.028 . . . . 99.84 105.524 -179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 44.1 m -107.5 126.0 51.98 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.197 -1.409 . . . . 44.82 107.197 178.281 -52.758 -70.48 -63.615 104.412 2.016 101.522 -86.326 -31.315 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LYS . . . . . 0.406 ' O ' ' OH ' ' B' ' 97' ' ' TYR . 6.8 tttp -91.58 121.0 67.99 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-N 115.673 -0.694 . . . . 46.08 109.773 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -47.69 -64.75 0.21 Allowed 'Trans proline' 0 CA--C 1.513 -0.574 0 C-N-CA 122.415 2.077 . . . . 33.63 114.047 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -119.24 163.29 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.696 0 CA-C-N 116.209 -0.451 . . . . 30.0 110.058 -177.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -177.89 119.79 0.1 Allowed 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.847 0.717 . . . . 42.02 111.728 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' THR . . . . . . . . . . . . . 7.0 m -102.92 132.27 49.27 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 123.569 0.543 . . . . 43.01 111.015 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -109.02 123.05 48.52 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.805 -0.813 . . . . 35.53 108.805 178.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 2.3 t -91.01 136.4 24.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.93 0.787 . . . . 23.46 109.798 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -104.77 34.41 3.17 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 121.391 0.615 . . . . 42.63 112.102 -178.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -116.48 164.31 14.76 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.238 -0.892 . . . . 36.56 109.04 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 54.5 p -63.33 149.38 45.9 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.179 -0.608 . . . . 71.65 109.383 -179.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.4 -34.0 75.87 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.377 0.51 . . . . 40.24 112.377 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.91 72.9 Favored 'General case' 0 CA--C 1.496 -1.104 0 N-CA-C 109.285 -0.635 . . . . 27.56 109.285 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -56.43 -47.29 79.38 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 114.946 -1.025 . . . . 31.58 109.979 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 74.0 t -62.26 -43.54 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 O-C-N 124.56 1.162 . . . . 25.58 113.402 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -67.73 -31.42 71.33 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.816 -1.083 . . . . 49.49 110.295 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.02 -18.11 64.0 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 124.098 0.874 . . . . 42.17 110.641 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' VAL . . . . . . . . . . . . . 90.3 t -61.68 -25.85 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 116.27 -0.423 . . . . 34.57 110.585 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 99.6 m -60.09 -9.9 3.73 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 115.272 1.582 . . . . 33.15 115.272 179.996 -69.505 -63.231 -84.65 102.032 2.041 104.54 -118.289 -49.749 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.51 32.67 5.9 Favored 'General case' 0 CA--C 1.509 -0.597 0 O-C-N 123.6 0.563 . . . . 34.73 110.056 177.935 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -116.31 -151.34 0.48 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.762 0.653 . . . . 41.19 112.762 -179.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.28 107.21 0.22 Allowed 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.376 1.621 . . . . 75.66 115.376 -178.529 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -82.44 119.36 24.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.089 -0.959 . . . . 43.5 111.394 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 18.8 m -139.24 168.48 18.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 123.569 0.748 . . . . 43.28 109.181 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -77.03 150.86 35.76 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.704 0.764 . . . . 24.79 110.158 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.2 m -90.04 178.87 6.08 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 105.08 -2.193 . . . . 43.27 105.08 178.451 -36.436 -87.425 108.148 105.04 2.03 103.53 103.359 -85.639 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -66.77 -27.59 67.71 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.161 -1.051 . . . . 69.78 108.161 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -81.38 12.2 3.84 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.029 0.752 . . . . 72.4 113.029 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.87 -45.27 3.45 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 116.771 1.468 . . . . 67.33 116.771 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -49.42 132.59 20.58 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.462 0.705 . . . . 65.75 110.65 -179.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' THR . . . . . . . . . . . . . 19.3 p -97.11 53.36 1.18 Allowed 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 115.143 1.534 . . . . 79.54 115.143 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -126.34 35.55 4.64 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.169 -1.419 . . . . 52.82 107.169 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' CYS . . . . . . . . . . . . . 5.9 m -110.86 148.76 31.74 Favored 'General case' 0 C--O 1.245 0.836 0 N-CA-C 108.209 -1.034 . . . . 36.2 108.209 178.509 -85.639 103.359 108.148 103.53 2.03 105.04 -87.425 -36.436 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -134.49 112.81 11.22 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.787 0.803 . . . . 42.67 112.708 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -75.31 141.32 43.41 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 108.741 -0.837 . . . . 59.56 108.741 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 66.1 p -69.05 147.5 51.42 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.069 0.461 . . . . 31.47 110.419 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -66.29 -56.03 13.19 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 105.913 -1.884 . . . . 46.89 105.913 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 79.2 p -91.04 -176.51 4.64 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 113.972 1.101 . . . . 32.95 113.972 -179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' THR . . . . . . . . . . . . . 37.5 p -105.75 131.88 52.56 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 123.859 0.724 . . . . 38.73 109.652 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 13.3 mmm -99.91 158.14 16.03 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.925 -0.769 . . . . 27.11 108.925 -178.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 34.2 t -81.49 121.58 26.46 Favored 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.25 -2.13 . . . . 25.93 105.25 177.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 31.8 pt -130.28 -172.77 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.847 0 C-N-CA 119.134 -1.027 . . . . 49.08 113.681 179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' THR . . . . . . . . . . . . . 98.1 m -153.2 96.84 2.11 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.174 0.99 . . . . 32.86 111.733 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -71.8 118.06 14.18 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 109.096 -0.705 . . . . 31.26 109.096 178.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 91.4 m -106.28 102.63 12.02 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.507 0.723 . . . . 31.44 110.245 178.192 -70.16 -60.765 -84.065 103.148 2.022 104.882 -79.365 -72.123 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -101.46 140.1 36.22 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.643 0.777 . . . . 43.69 112.674 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -84.2 123.93 30.64 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 105.972 -1.862 . . . . 43.77 105.972 178.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 69.6 p -71.69 145.19 49.02 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.49 -0.93 . . . . 52.43 108.49 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.28 -26.69 51.18 Favored Glycine 0 N--CA 1.454 -0.132 0 N-CA-C 118.481 2.153 . . . . 63.52 118.481 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 7.3 p -74.89 -9.42 58.52 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 117.354 2.353 . . . . 83.43 117.354 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 1.8 p -91.77 152.86 19.96 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 117.262 2.319 . . . . 69.58 117.262 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -148.89 141.55 24.47 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.64 -0.709 . . . . 57.54 109.38 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -54.34 144.4 41.6 Favored Pre-proline 0 CA--C 1.555 1.162 0 N-CA-C 107.882 -1.155 . . . . 68.5 107.882 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -76.19 8.1 14.14 Favored 'Cis proline' 0 N--CA 1.463 -0.277 0 N-CA-C 116.83 1.819 . . . . 55.42 116.83 0.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -109.97 95.52 5.65 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.075 -0.65 . . . . 81.77 111.453 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 1.8 m -98.77 116.18 30.42 Favored 'General case' 0 CA--C 1.509 -0.624 0 C-N-CA 120.018 -0.673 . . . . 43.1 109.516 179.713 -31.315 -86.326 -63.615 101.522 2.016 104.412 -70.48 -52.758 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -89.64 150.89 22.17 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 107.627 -1.249 . . . . 57.98 107.627 179.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' TYR . . . . . 0.406 ' OH ' ' O ' ' B' ' 41' ' ' LYS . 55.7 m-85 -135.58 132.79 37.6 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 114.396 1.258 . . . . 41.97 114.396 179.504 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.05 113.33 24.93 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 106.848 -1.538 . . . . 41.94 106.848 178.063 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 19.5 m -85.6 125.93 33.5 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 114.905 -1.043 . . . . 34.44 111.118 -178.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.39 108.56 9.71 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 123.857 0.723 . . . . 46.73 110.902 178.858 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -76.86 152.93 35.25 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.394 -0.965 . . . . 77.48 108.394 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -170.01 174.46 5.51 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 112.484 0.55 . . . . 35.72 112.484 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -139.09 95.99 3.04 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 105.427 -2.064 . . . . 49.83 105.427 178.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -134.51 163.02 30.66 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-O 121.247 0.546 . . . . 70.8 111.857 -177.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 -73.45 143.17 46.79 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.322 -1.732 . . . . 40.97 106.322 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 7.8 pt -106.18 155.86 6.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 118.369 -1.332 . . . . 26.47 110.564 178.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 71.0 mt -134.91 116.12 20.05 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.394 0 N-CA-C 104.887 -2.264 . . . . 28.62 104.887 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' VAL . . . . . . . . . . . . . 10.7 m -123.81 157.38 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 O-C-N 124.584 1.178 . . . . 35.29 110.356 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -100.04 114.01 27.01 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 107.143 -1.429 . . . . 27.81 107.143 179.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' CYS . . . . . . . . . . . . . 29.6 m -93.59 145.86 24.23 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 119.813 -0.755 . . . . 47.21 111.409 178.997 -49.749 -118.289 -84.65 104.54 2.041 102.032 -63.231 -69.505 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -157.49 159.53 37.33 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.282 -0.636 . . . . 63.02 109.282 177.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . 81.96 -177.56 53.81 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 115.871 1.108 . . . . 63.38 115.871 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -130.96 119.38 17.93 Favored Pre-proline 0 C--O 1.225 -0.191 0 N-CA-C 106.498 -1.667 . . . . 59.52 106.498 -179.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -68.12 144.96 74.38 Favored 'Cis proline' 0 CA--C 1.53 0.286 0 C-N-CA 124.992 -0.837 . . . . 56.02 112.778 -1.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.64 116.19 3.25 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 108.007 -1.109 . . . . 45.27 108.007 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' VAL . . . . . . . . . . . . . 3.1 m -141.76 154.93 66.41 Favored Pre-proline 0 C--O 1.243 0.717 0 O-C-N 122.168 -0.333 . . . . 29.42 110.919 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -62.17 129.81 28.39 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.247 2.631 . . . . 33.95 112.26 -179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 5.6 m -127.48 -9.37 4.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 120.729 -0.388 . . . . 38.6 111.95 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -147.5 137.71 23.1 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.621 -1.251 . . . . 64.33 107.621 -179.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -85.85 174.47 9.28 Favored 'General case' 0 N--CA 1.448 -0.565 1 N-CA-C 99.777 -4.157 . . . . 43.76 99.777 175.473 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -154.62 -25.0 0.12 Allowed 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 115.691 1.737 . . . . 61.23 115.691 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . 170.61 168.62 0.07 Allowed 'General case' 0 CA--C 1.508 -0.635 0 O-C-N 123.987 0.804 . . . . 32.55 111.95 -179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 5.2 p -132.51 91.83 2.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.427 -0.806 . . . . 52.74 109.598 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 24.9 t . . . . . 0 C--O 1.25 1.125 0 CA-C-N 115.372 -0.831 . . . . 51.46 111.56 178.913 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt . . . . . 0 N--CA 1.497 1.876 0 N-CA-C 109.05 -0.722 . . . . 88.53 109.05 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -113.7 107.21 15.46 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.883 0.849 . . . . 70.99 112.51 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.9 p -61.14 172.6 1.0 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.62 -0.718 . . . . 51.49 111.14 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.75 -47.94 67.81 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.668 -0.696 . . . . 41.43 109.879 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.3 -17.45 63.73 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 112.617 0.599 . . . . 35.98 112.617 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.56 -42.03 17.24 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 106.73 -1.581 . . . . 30.83 106.73 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . 0.455 ' HG3' HH21 ' A' ' 10' ' ' ARG . 5.3 ttmt -61.23 -32.18 71.96 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 115.89 -0.595 . . . . 48.19 111.538 179.477 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -62.96 -59.69 4.48 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 105.346 -2.094 . . . . 35.17 105.346 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -45.61 -46.77 14.63 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 113.489 0.922 . . . . 38.46 113.489 -179.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' O ' ' NH1' ' B' ' 33' ' ' ARG . 9.0 ttp180 -69.3 -42.98 74.73 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.225 0.824 . . . . 48.5 113.225 179.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . 0.444 ' HA ' HD11 ' B' ' 35' ' ' LEU . 4.3 mt-30 -70.55 -39.51 73.94 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 116.926 2.195 . . . . 61.88 116.926 -179.664 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -115.56 -39.08 3.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 117.157 2.28 . . . . 31.26 117.157 -175.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 tpp -60.79 127.39 31.39 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 114.265 1.209 . . . . 32.48 114.265 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -154.5 58.42 0.69 Allowed 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 106.665 -1.606 . . . . 33.58 106.665 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.32 -0.678 0 CA-C-N 114.308 -1.315 . . . . 68.09 107.646 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ASN . . . . . 0.519 ' HB3' ' OD1' ' B' ' 27' ' ' ASN . 20.2 t-20 . . . . . 0 N--CA 1.5 2.073 0 N-CA-C 112.016 0.376 . . . . 51.45 112.016 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' TYR . . . . . 0.403 ' CE1' HG21 ' B' ' 82' ' ' THR . 14.1 t80 -46.85 -45.13 20.05 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.07 0.948 . . . . 37.41 112.917 178.6 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' CYS . . . . . 0.431 ' HB2' ' OD1' ' B' ' 24' ' ' ASN . 68.0 m -62.94 -50.68 69.86 Favored 'General case' 0 CA--C 1.497 -1.071 0 C-N-CA 119.387 -0.925 . . . . 32.02 110.545 -178.714 -72.123 -79.365 -84.065 104.882 2.022 103.148 -60.765 -70.16 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASN . . . . . 0.519 ' OD1' ' HB3' ' B' ' 24' ' ' ASN . 33.0 m120 -55.43 -33.09 63.26 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 119.047 -1.061 . . . . 47.5 110.851 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -76.97 -62.82 1.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.01 1.115 . . . . 41.46 114.01 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 35.7 mmm -54.85 -47.31 74.33 Favored 'General case' 0 C--O 1.266 1.95 0 O-C-N 123.5 0.5 . . . . 24.23 111.739 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' MET . . . . . 0.455 ' HE2' ' CZ ' ' B' ' 97' ' ' TYR . 42.1 mmm -59.02 -40.96 86.57 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-O 122.448 1.118 . . . . 37.24 109.392 -179.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' B' ' 27' ' ' ASN . 27.2 tptp -61.38 -63.01 1.42 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 105.851 -1.907 . . . . 81.05 105.851 -178.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 1.7 t -49.16 -55.82 11.19 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 115.015 1.487 . . . . 55.85 115.015 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ARG . . . . . 0.585 HH11 ' HG3' ' B' ' 33' ' ' ARG . 12.7 mmt85 -63.51 9.54 0.06 Allowed 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 114.915 1.45 . . . . 44.7 114.915 -178.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 62.7 23.73 14.13 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.217 0.532 . . . . 59.06 110.886 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LEU . . . . . 0.553 HD22 ' ND2' ' B' ' 44' ' ' ASN . 0.1 OUTLIER -81.11 -25.41 36.98 Favored 'General case' 0 C--O 1.242 0.668 0 C-N-CA 120.41 -0.516 . . . . 48.73 110.813 -179.743 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 36' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' B' ' 39' ' ' ARG . 30.9 p -136.1 33.5 2.85 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.543 -0.753 . . . . 61.61 111.662 -178.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -94.24 -2.57 52.21 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.869 -0.605 . . . . 62.4 111.418 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -152.63 9.68 0.47 Allowed 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 120.977 -0.289 . . . . 70.29 111.45 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' B' ' 36' ' ' THR . 22.1 ptt-85 -179.59 164.13 1.25 Allowed 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 105.524 -2.028 . . . . 99.84 105.524 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 44.1 m -107.5 126.0 51.98 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.197 -1.409 . . . . 44.82 107.197 178.281 -52.758 -70.48 -63.615 104.412 2.016 101.522 -86.326 -31.315 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LYS . . . . . 0.555 ' HE3' ' O ' ' B' ' 43' ' ' VAL . 6.8 tttp -91.58 121.0 67.99 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-N 115.673 -0.694 . . . . 46.08 109.773 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -47.69 -64.75 0.21 Allowed 'Trans proline' 0 CA--C 1.513 -0.574 0 C-N-CA 122.415 2.077 . . . . 33.63 114.047 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' VAL . . . . . 0.555 ' O ' ' HE3' ' B' ' 41' ' ' LYS . 2.1 t -119.24 163.29 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.696 0 CA-C-N 116.209 -0.451 . . . . 30.0 110.058 -177.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ASN . . . . . 0.553 ' ND2' HD22 ' B' ' 35' ' ' LEU . 53.3 t30 -177.89 119.79 0.1 Allowed 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.847 0.717 . . . . 42.02 111.728 178.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' THR . . . . . . . . . . . . . 7.0 m -102.92 132.27 49.27 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 123.569 0.543 . . . . 43.01 111.015 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -109.02 123.05 48.52 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.805 -0.813 . . . . 35.53 108.805 178.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 2.3 t -91.01 136.4 24.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.93 0.787 . . . . 23.46 109.798 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' HIS . . . . . 0.439 ' HB2' ' HB3' ' B' ' 80' ' ' SER . 96.1 m-70 -104.77 34.41 3.17 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 121.391 0.615 . . . . 42.63 112.102 -178.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLU . . . . . 0.498 ' HG3' ' HB3' ' B' ' 79' ' ' MET . 78.0 mm-40 -116.48 164.31 14.76 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.238 -0.892 . . . . 36.56 109.04 178.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' SER . . . . . 0.499 ' O ' HG23 ' B' ' 54' ' ' VAL . 54.5 p -63.33 149.38 45.9 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.179 -0.608 . . . . 71.65 109.383 -179.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.4 -34.0 75.87 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.377 0.51 . . . . 40.24 112.377 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.91 72.9 Favored 'General case' 0 CA--C 1.496 -1.104 0 N-CA-C 109.285 -0.635 . . . . 27.56 109.285 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -56.43 -47.29 79.38 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 114.946 -1.025 . . . . 31.58 109.979 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' VAL . . . . . 0.499 HG23 ' O ' ' B' ' 50' ' ' SER . 74.0 t -62.26 -43.54 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 O-C-N 124.56 1.162 . . . . 25.58 113.402 -179.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -67.73 -31.42 71.33 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.816 -1.083 . . . . 49.49 110.295 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.02 -18.11 64.0 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 124.098 0.874 . . . . 42.17 110.641 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' VAL . . . . . 0.601 ' HA ' ' HG3' ' B' ' 60' ' ' GLN . 90.3 t -61.68 -25.85 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 116.27 -0.423 . . . . 34.57 110.585 179.852 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 99.6 m -60.09 -9.9 3.73 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 115.272 1.582 . . . . 33.15 115.272 179.996 -69.505 -63.231 -84.65 102.032 2.041 104.54 -118.289 -49.749 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.51 32.67 5.9 Favored 'General case' 0 CA--C 1.509 -0.597 0 O-C-N 123.6 0.563 . . . . 34.73 110.056 177.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLN . . . . . 0.601 ' HG3' ' HA ' ' B' ' 57' ' ' VAL . 12.4 mt-30 -116.31 -151.34 0.48 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.762 0.653 . . . . 41.19 112.762 -179.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LYS . . . . . 0.564 ' O ' ' HA ' ' B' ' 73' ' ' TYR . 0.1 OUTLIER -53.28 107.21 0.22 Allowed 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.376 1.621 . . . . 75.66 115.376 -178.529 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -82.44 119.36 24.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.089 -0.959 . . . . 43.5 111.394 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 18.8 m -139.24 168.48 18.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 123.569 0.748 . . . . 43.28 109.181 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ALA . . . . . 0.423 ' HB2' HG22 ' B' ' 70' ' ' THR . . . -77.03 150.86 35.76 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.704 0.764 . . . . 24.79 110.158 178.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' CYS . . . . . 0.753 ' HB2' HD21 ' B' ' 67' ' ' ASN . 3.2 m -90.04 178.87 6.08 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 105.08 -2.193 . . . . 43.27 105.08 178.451 -36.436 -87.425 108.148 105.04 2.03 103.53 103.359 -85.639 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . 0.463 ' HE2' ' O ' ' B' ' 121' ' ' ASP . 49.3 mtmt -66.77 -27.59 67.71 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.161 -1.051 . . . . 69.78 108.161 179.759 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ASN . . . . . 0.753 HD21 ' HB2' ' B' ' 65' ' ' CYS . 0.2 OUTLIER -81.38 12.2 3.84 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.029 0.752 . . . . 72.4 113.029 -179.529 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.87 -45.27 3.45 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 116.771 1.468 . . . . 67.33 116.771 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLN . . . . . 0.408 ' HG3' ' OD1' ' B' ' 67' ' ' ASN . 1.7 mm-40 -49.42 132.59 20.58 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.462 0.705 . . . . 65.75 110.65 -179.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' THR . . . . . 0.423 HG22 ' HB2' ' B' ' 64' ' ' ALA . 19.3 p -97.11 53.36 1.18 Allowed 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 115.143 1.534 . . . . 79.54 115.143 -178.361 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -126.34 35.55 4.64 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.169 -1.419 . . . . 52.82 107.169 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' CYS . . . . . . . . . . . . . 5.9 m -110.86 148.76 31.74 Favored 'General case' 0 C--O 1.245 0.836 0 N-CA-C 108.209 -1.034 . . . . 36.2 108.209 178.509 -85.639 103.359 108.148 103.53 2.03 105.04 -87.425 -36.436 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' TYR . . . . . 0.564 ' HA ' ' O ' ' B' ' 61' ' ' LYS . 48.7 m-85 -134.49 112.81 11.22 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.787 0.803 . . . . 42.67 112.708 -178.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -75.31 141.32 43.41 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 108.741 -0.837 . . . . 59.56 108.741 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 66.1 p -69.05 147.5 51.42 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.069 0.461 . . . . 31.47 110.419 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -66.29 -56.03 13.19 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 105.913 -1.884 . . . . 46.89 105.913 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 79.2 p -91.04 -176.51 4.64 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 113.972 1.101 . . . . 32.95 113.972 -179.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' THR . . . . . . . . . . . . . 37.5 p -105.75 131.88 52.56 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 123.859 0.724 . . . . 38.73 109.652 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' MET . . . . . 0.498 ' HB3' ' HG3' ' B' ' 49' ' ' GLU . 13.3 mmm -99.91 158.14 16.03 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.925 -0.769 . . . . 27.11 108.925 -178.603 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' SER . . . . . 0.439 ' HB3' ' HB2' ' B' ' 48' ' ' HIS . 34.2 t -81.49 121.58 26.46 Favored 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.25 -2.13 . . . . 25.93 105.25 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ILE . . . . . 1.031 HD11 ' HE3' ' B' ' 104' ' ' LYS . 31.8 pt -130.28 -172.77 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.847 0 C-N-CA 119.134 -1.027 . . . . 49.08 113.681 179.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' THR . . . . . 0.516 ' OG1' ' NE2' ' B' ' 101' ' ' GLN . 98.1 m -153.2 96.84 2.11 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.174 0.99 . . . . 32.86 111.733 179.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -71.8 118.06 14.18 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 109.096 -0.705 . . . . 31.26 109.096 178.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 91.4 m -106.28 102.63 12.02 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.507 0.723 . . . . 31.44 110.245 178.192 -70.16 -60.765 -84.065 103.148 2.022 104.882 -79.365 -72.123 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ARG . . . . . 0.419 ' O ' ' HA ' ' B' ' 97' ' ' TYR . 21.6 mmt180 -101.46 140.1 36.22 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.643 0.777 . . . . 43.69 112.674 -179.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLU . . . . . 0.454 ' HA ' ' O ' ' B' ' 96' ' ' ALA . 6.7 tt0 -84.2 123.93 30.64 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 105.972 -1.862 . . . . 43.77 105.972 178.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 69.6 p -71.69 145.19 49.02 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.49 -0.93 . . . . 52.43 108.49 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.28 -26.69 51.18 Favored Glycine 0 N--CA 1.454 -0.132 0 N-CA-C 118.481 2.153 . . . . 63.52 118.481 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 7.3 p -74.89 -9.42 58.52 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 117.354 2.353 . . . . 83.43 117.354 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' SER . . . . . 0.413 ' CB ' ' H ' ' B' ' 96' ' ' ALA . 1.8 p -91.77 152.86 19.96 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 117.262 2.319 . . . . 69.58 117.262 -179.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -148.89 141.55 24.47 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.64 -0.709 . . . . 57.54 109.38 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -54.34 144.4 41.6 Favored Pre-proline 0 CA--C 1.555 1.162 0 N-CA-C 107.882 -1.155 . . . . 68.5 107.882 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -76.19 8.1 14.14 Favored 'Cis proline' 0 N--CA 1.463 -0.277 0 N-CA-C 116.83 1.819 . . . . 55.42 116.83 0.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -109.97 95.52 5.65 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.075 -0.65 . . . . 81.77 111.453 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 1.8 m -98.77 116.18 30.42 Favored 'General case' 0 CA--C 1.509 -0.624 0 C-N-CA 120.018 -0.673 . . . . 43.1 109.516 179.713 -31.315 -86.326 -63.615 101.522 2.016 104.412 -70.48 -52.758 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ALA . . . . . 0.454 ' O ' ' HA ' ' B' ' 86' ' ' GLU . . . -89.64 150.89 22.17 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 107.627 -1.249 . . . . 57.98 107.627 179.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' TYR . . . . . 0.455 ' CZ ' ' HE2' ' B' ' 30' ' ' MET . 55.7 m-85 -135.58 132.79 37.6 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 114.396 1.258 . . . . 41.97 114.396 179.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.05 113.33 24.93 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 106.848 -1.538 . . . . 41.94 106.848 178.063 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 19.5 m -85.6 125.93 33.5 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 114.905 -1.043 . . . . 34.44 111.118 -178.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.39 108.56 9.71 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 123.857 0.723 . . . . 46.73 110.902 178.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLN . . . . . 0.516 ' NE2' ' OG1' ' B' ' 82' ' ' THR . 8.2 tp60 -76.86 152.93 35.25 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.394 -0.965 . . . . 77.48 108.394 178.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -170.01 174.46 5.51 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 112.484 0.55 . . . . 35.72 112.484 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ASN . . . . . 0.495 ' HA ' ' O ' ' B' ' 79' ' ' MET . 6.0 m120 -139.09 95.99 3.04 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 105.427 -2.064 . . . . 49.83 105.427 178.665 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LYS . . . . . 1.031 ' HE3' HD11 ' B' ' 81' ' ' ILE . 42.8 mtmt -134.51 163.02 30.66 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-O 121.247 0.546 . . . . 70.8 111.857 -177.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HIS . . . . . 0.926 ' HB2' ' HB ' ' B' ' 124' ' ' VAL . 44.1 m80 -73.45 143.17 46.79 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.322 -1.732 . . . . 40.97 106.322 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 7.8 pt -106.18 155.86 6.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 118.369 -1.332 . . . . 26.47 110.564 178.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ILE . . . . . 0.484 HD11 ' CG2' ' B' ' 124' ' ' VAL . 71.0 mt -134.91 116.12 20.05 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.394 0 N-CA-C 104.887 -2.264 . . . . 28.62 104.887 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' VAL . . . . . 0.439 HG12 ' HA ' ' B' ' 120' ' ' PHE . 10.7 m -123.81 157.38 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 O-C-N 124.584 1.178 . . . . 35.29 110.356 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ALA . . . . . 0.458 ' HB3' ' HB2' ' B' ' 119' ' ' HIS . . . -100.04 114.01 27.01 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 107.143 -1.429 . . . . 27.81 107.143 179.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 110' ' ' CYS . . . . . . . . . . . . . 29.6 m -93.59 145.86 24.23 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 119.813 -0.755 . . . . 47.21 111.409 178.997 -49.749 -118.289 -84.65 104.54 2.041 102.032 -63.231 -69.505 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLU . . . . . 0.409 ' HG2' HG11 ' B' ' 118' ' ' VAL . 6.9 pt-20 -157.49 159.53 37.33 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.282 -0.636 . . . . 63.02 109.282 177.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . 81.96 -177.56 53.81 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 115.871 1.108 . . . . 63.38 115.871 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -130.96 119.38 17.93 Favored Pre-proline 0 C--O 1.225 -0.191 0 N-CA-C 106.498 -1.667 . . . . 59.52 106.498 -179.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -68.12 144.96 74.38 Favored 'Cis proline' 0 CA--C 1.53 0.286 0 C-N-CA 124.992 -0.837 . . . . 56.02 112.778 -1.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.64 116.19 3.25 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 108.007 -1.109 . . . . 45.27 108.007 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' VAL . . . . . . . . . . . . . 3.1 m -141.76 154.93 66.41 Favored Pre-proline 0 C--O 1.243 0.717 0 O-C-N 122.168 -0.333 . . . . 29.42 110.919 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -62.17 129.81 28.39 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.247 2.631 . . . . 33.95 112.26 -179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' VAL . . . . . 0.409 HG11 ' HG2' ' B' ' 111' ' ' GLU . 5.6 m -127.48 -9.37 4.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 120.729 -0.388 . . . . 38.6 111.95 179.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HIS . . . . . 0.458 ' HB2' ' HB3' ' B' ' 109' ' ' ALA . 17.1 m-70 -147.5 137.71 23.1 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.621 -1.251 . . . . 64.33 107.621 -179.717 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' PHE . . . . . 0.439 ' HA ' HG12 ' B' ' 108' ' ' VAL . 35.2 t80 -85.85 174.47 9.28 Favored 'General case' 0 N--CA 1.448 -0.565 1 N-CA-C 99.777 -4.157 . . . . 43.76 99.777 175.473 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' B' ' 122' ' ' ALA . 14.7 t70 -154.62 -25.0 0.12 Allowed 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 115.691 1.737 . . . . 61.23 115.691 -179.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' B' ' 121' ' ' ASP . . . 170.61 168.62 0.07 Allowed 'General case' 0 CA--C 1.508 -0.635 0 O-C-N 123.987 0.804 . . . . 32.55 111.95 -179.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' B' ' 105' ' ' HIS . 5.2 p -132.51 91.83 2.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.427 -0.806 . . . . 52.74 109.598 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' VAL . . . . . 0.926 ' HB ' ' HB2' ' B' ' 105' ' ' HIS . 24.9 t . . . . . 0 C--O 1.25 1.125 0 CA-C-N 115.372 -0.831 . . . . 51.46 111.56 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt . . . . . 0 N--CA 1.497 1.876 0 N-CA-C 109.05 -0.722 . . . . 88.53 109.05 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -113.7 107.21 15.46 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.883 0.849 . . . . 70.99 112.51 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.9 p -61.14 172.6 1.0 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.62 -0.718 . . . . 51.49 111.14 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.75 -47.94 67.81 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.668 -0.696 . . . . 41.43 109.879 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.3 -17.45 63.73 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 112.617 0.599 . . . . 35.98 112.617 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.56 -42.03 17.24 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 106.73 -1.581 . . . . 30.83 106.73 179.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.455 ' HG3' HH21 ' A' ' 10' ' ' ARG . 5.3 ttmt -61.23 -32.18 71.96 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 115.89 -0.595 . . . . 48.19 111.538 179.477 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -62.96 -59.69 4.48 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 105.346 -2.094 . . . . 35.17 105.346 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -45.61 -46.77 14.63 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 113.489 0.922 . . . . 38.46 113.489 -179.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.457 ' O ' ' NH1' ' B' ' 33' ' ' ARG . 9.0 ttp180 -69.3 -42.98 74.73 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.225 0.824 . . . . 48.5 113.225 179.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.444 ' HA ' HD11 ' B' ' 35' ' ' LEU . 4.3 mt-30 -70.55 -39.51 73.94 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 116.926 2.195 . . . . 61.88 116.926 -179.664 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -115.56 -39.08 3.6 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 117.157 2.28 . . . . 31.26 117.157 -175.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 5.9 tpp -60.79 127.39 31.39 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 114.265 1.209 . . . . 32.48 114.265 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -154.5 58.42 0.69 Allowed 'General case' 0 CA--C 1.492 -1.259 0 N-CA-C 106.665 -1.606 . . . . 33.58 106.665 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.32 -0.678 0 CA-C-N 114.308 -1.315 . . . . 68.09 107.646 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ASN . . . . . 0.519 ' HB3' ' OD1' ' B' ' 27' ' ' ASN . 20.2 t-20 . . . . . 0 N--CA 1.5 2.073 0 N-CA-C 112.016 0.376 . . . . 51.45 112.016 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' TYR . . . . . 0.403 ' CE1' HG21 ' B' ' 82' ' ' THR . 14.1 t80 -46.85 -45.13 20.05 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.07 0.948 . . . . 37.41 112.917 178.6 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' CYS . . . . . 0.431 ' HB2' ' OD1' ' B' ' 24' ' ' ASN . 68.0 m -62.94 -50.68 69.86 Favored 'General case' 0 CA--C 1.497 -1.071 0 C-N-CA 119.387 -0.925 . . . . 32.02 110.545 -178.714 -72.123 -79.365 -84.065 104.882 2.022 103.148 -60.765 -70.16 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASN . . . . . 0.519 ' OD1' ' HB3' ' B' ' 24' ' ' ASN . 33.0 m120 -55.43 -33.09 63.26 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 119.047 -1.061 . . . . 47.5 110.851 179.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -76.97 -62.82 1.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.01 1.115 . . . . 41.46 114.01 -178.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' MET . . . . . . . . . . . . . 35.7 mmm -54.85 -47.31 74.33 Favored 'General case' 0 C--O 1.266 1.95 0 O-C-N 123.5 0.5 . . . . 24.23 111.739 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' MET . . . . . 0.455 ' HE2' ' CZ ' ' B' ' 97' ' ' TYR . 42.1 mmm -59.02 -40.96 86.57 Favored 'General case' 0 C--O 1.25 1.092 0 CA-C-O 122.448 1.118 . . . . 37.24 109.392 -179.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' B' ' 27' ' ' ASN . 27.2 tptp -61.38 -63.01 1.42 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 105.851 -1.907 . . . . 81.05 105.851 -178.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 1.7 t -49.16 -55.82 11.19 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 115.015 1.487 . . . . 55.85 115.015 -178.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ARG . . . . . 0.585 HH11 ' HG3' ' B' ' 33' ' ' ARG . 12.7 mmt85 -63.51 9.54 0.06 Allowed 'General case' 0 N--CA 1.445 -0.725 0 N-CA-C 114.915 1.45 . . . . 44.7 114.915 -178.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 62.7 23.73 14.13 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.217 0.532 . . . . 59.06 110.886 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.553 HD22 ' ND2' ' B' ' 44' ' ' ASN . 0.1 OUTLIER -81.11 -25.41 36.98 Favored 'General case' 0 C--O 1.242 0.668 0 C-N-CA 120.41 -0.516 . . . . 48.73 110.813 -179.743 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' THR . . . . . 0.532 ' HA ' ' O ' ' B' ' 39' ' ' ARG . 30.9 p -136.1 33.5 2.85 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.543 -0.753 . . . . 61.61 111.662 -178.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -94.24 -2.57 52.21 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.869 -0.605 . . . . 62.4 111.418 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -152.63 9.68 0.47 Allowed 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 120.977 -0.289 . . . . 70.29 111.45 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ARG . . . . . 0.532 ' O ' ' HA ' ' B' ' 36' ' ' THR . 22.1 ptt-85 -179.59 164.13 1.25 Allowed 'General case' 0 C--O 1.215 -0.741 0 N-CA-C 105.524 -2.028 . . . . 99.84 105.524 -179.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 44.1 m -107.5 126.0 51.98 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 107.197 -1.409 . . . . 44.82 107.197 178.281 -52.758 -70.48 -63.615 104.412 2.016 101.522 -86.326 -31.315 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LYS . . . . . 0.555 ' HE3' ' O ' ' B' ' 43' ' ' VAL . 6.8 tttp -91.58 121.0 67.99 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-N 115.673 -0.694 . . . . 46.08 109.773 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -47.69 -64.75 0.21 Allowed 'Trans proline' 0 CA--C 1.513 -0.574 0 C-N-CA 122.415 2.077 . . . . 33.63 114.047 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' VAL . . . . . 0.555 ' O ' ' HE3' ' B' ' 41' ' ' LYS . 2.1 t -119.24 163.29 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.696 0 CA-C-N 116.209 -0.451 . . . . 30.0 110.058 -177.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ASN . . . . . 0.553 ' ND2' HD22 ' B' ' 35' ' ' LEU . 53.3 t30 -177.89 119.79 0.1 Allowed 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.847 0.717 . . . . 42.02 111.728 178.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' THR . . . . . . . . . . . . . 7.0 m -102.92 132.27 49.27 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 123.569 0.543 . . . . 43.01 111.015 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -109.02 123.05 48.52 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.805 -0.813 . . . . 35.53 108.805 178.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 2.3 t -91.01 136.4 24.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.93 0.787 . . . . 23.46 109.798 -179.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' HIS . . . . . 0.439 ' HB2' ' HB3' ' B' ' 80' ' ' SER . 96.1 m-70 -104.77 34.41 3.17 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 121.391 0.615 . . . . 42.63 112.102 -178.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLU . . . . . 0.498 ' HG3' ' HB3' ' B' ' 79' ' ' MET . 78.0 mm-40 -116.48 164.31 14.76 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.238 -0.892 . . . . 36.56 109.04 178.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' SER . . . . . 0.499 ' O ' HG23 ' B' ' 54' ' ' VAL . 54.5 p -63.33 149.38 45.9 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.179 -0.608 . . . . 71.65 109.383 -179.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.4 -34.0 75.87 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 112.377 0.51 . . . . 40.24 112.377 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.71 -48.91 72.9 Favored 'General case' 0 CA--C 1.496 -1.104 0 N-CA-C 109.285 -0.635 . . . . 27.56 109.285 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -56.43 -47.29 79.38 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 114.946 -1.025 . . . . 31.58 109.979 177.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' VAL . . . . . 0.499 HG23 ' O ' ' B' ' 50' ' ' SER . 74.0 t -62.26 -43.54 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 O-C-N 124.56 1.162 . . . . 25.58 113.402 -179.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -67.73 -31.42 71.33 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.816 -1.083 . . . . 49.49 110.295 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.02 -18.11 64.0 Favored 'General case' 0 C--O 1.244 0.783 0 O-C-N 124.098 0.874 . . . . 42.17 110.641 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' VAL . . . . . 0.601 ' HA ' ' HG3' ' B' ' 60' ' ' GLN . 90.3 t -61.68 -25.85 38.07 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 116.27 -0.423 . . . . 34.57 110.585 179.852 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 99.6 m -60.09 -9.9 3.73 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 115.272 1.582 . . . . 33.15 115.272 179.996 -69.505 -63.231 -84.65 102.032 2.041 104.54 -118.289 -49.749 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.51 32.67 5.9 Favored 'General case' 0 CA--C 1.509 -0.597 0 O-C-N 123.6 0.563 . . . . 34.73 110.056 177.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.601 ' HG3' ' HA ' ' B' ' 57' ' ' VAL . 12.4 mt-30 -116.31 -151.34 0.48 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.762 0.653 . . . . 41.19 112.762 -179.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LYS . . . . . 0.564 ' O ' ' HA ' ' B' ' 73' ' ' TYR . 0.1 OUTLIER -53.28 107.21 0.22 Allowed 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.376 1.621 . . . . 75.66 115.376 -178.529 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -82.44 119.36 24.09 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.089 -0.959 . . . . 43.5 111.394 179.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 18.8 m -139.24 168.48 18.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 123.569 0.748 . . . . 43.28 109.181 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.423 ' HB2' HG22 ' B' ' 70' ' ' THR . . . -77.03 150.86 35.76 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.704 0.764 . . . . 24.79 110.158 178.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' CYS . . . . . 0.488 ' HB2' ' OD1' ' B' ' 67' ' ' ASN . 3.2 m -90.04 178.87 6.08 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 105.08 -2.193 . . . . 43.27 105.08 178.451 -36.436 -87.425 108.148 105.04 2.03 103.53 103.359 -85.639 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . 0.463 ' HE2' ' O ' ' B' ' 121' ' ' ASP . 49.3 mtmt -66.77 -27.59 67.71 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 108.161 -1.051 . . . . 69.78 108.161 179.759 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ASN . . . . . 0.776 HD21 ' HG3' ' B' ' 69' ' ' GLN . 2.7 p-10 -81.38 12.2 3.84 Favored 'General case' 0 C--O 1.241 0.613 0 N-CA-C 113.029 0.752 . . . . 72.4 113.029 -179.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.87 -45.27 3.45 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 116.771 1.468 . . . . 67.33 116.771 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLN . . . . . 0.776 ' HG3' HD21 ' B' ' 67' ' ' ASN . 1.7 mm-40 -49.42 132.59 20.58 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.462 0.705 . . . . 65.75 110.65 -179.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' THR . . . . . 0.423 HG22 ' HB2' ' B' ' 64' ' ' ALA . 19.3 p -97.11 53.36 1.18 Allowed 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 115.143 1.534 . . . . 79.54 115.143 -178.361 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -126.34 35.55 4.64 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.169 -1.419 . . . . 52.82 107.169 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' CYS . . . . . . . . . . . . . 5.9 m -110.86 148.76 31.74 Favored 'General case' 0 C--O 1.245 0.836 0 N-CA-C 108.209 -1.034 . . . . 36.2 108.209 178.509 -85.639 103.359 108.148 103.53 2.03 105.04 -87.425 -36.436 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' TYR . . . . . 0.564 ' HA ' ' O ' ' B' ' 61' ' ' LYS . 48.7 m-85 -134.49 112.81 11.22 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 121.787 0.803 . . . . 42.67 112.708 -178.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -75.31 141.32 43.41 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 108.741 -0.837 . . . . 59.56 108.741 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 66.1 p -69.05 147.5 51.42 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-O 121.069 0.461 . . . . 31.47 110.419 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -66.29 -56.03 13.19 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 105.913 -1.884 . . . . 46.89 105.913 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 79.2 p -91.04 -176.51 4.64 Favored 'General case' 0 C--O 1.245 0.854 0 N-CA-C 113.972 1.101 . . . . 32.95 113.972 -179.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' THR . . . . . 0.489 HG22 ' CD2' ' B' ' 105' ' ' HIS . 37.5 p -105.75 131.88 52.56 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 123.859 0.724 . . . . 38.73 109.652 -179.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' MET . . . . . 0.498 ' HB3' ' HG3' ' B' ' 49' ' ' GLU . 13.3 mmm -99.91 158.14 16.03 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.925 -0.769 . . . . 27.11 108.925 -178.603 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' SER . . . . . 0.439 ' HB3' ' HB2' ' B' ' 48' ' ' HIS . 34.2 t -81.49 121.58 26.46 Favored 'General case' 0 CA--C 1.505 -0.782 0 N-CA-C 105.25 -2.13 . . . . 25.93 105.25 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ILE . . . . . 1.031 HD11 ' HE3' ' B' ' 104' ' ' LYS . 31.8 pt -130.28 -172.77 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.847 0 C-N-CA 119.134 -1.027 . . . . 49.08 113.681 179.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' THR . . . . . 0.403 HG21 ' CE1' ' B' ' 25' ' ' TYR . 98.1 m -153.2 96.84 2.11 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.174 0.99 . . . . 32.86 111.733 179.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -71.8 118.06 14.18 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 109.096 -0.705 . . . . 31.26 109.096 178.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' CYS . . . . . . . . . . . . . 91.4 m -106.28 102.63 12.02 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.507 0.723 . . . . 31.44 110.245 178.192 -70.16 -60.765 -84.065 103.148 2.022 104.882 -79.365 -72.123 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ARG . . . . . 0.419 ' O ' ' HA ' ' B' ' 97' ' ' TYR . 21.6 mmt180 -101.46 140.1 36.22 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.643 0.777 . . . . 43.69 112.674 -179.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.454 ' HA ' ' O ' ' B' ' 96' ' ' ALA . 6.7 tt0 -84.2 123.93 30.64 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 105.972 -1.862 . . . . 43.77 105.972 178.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 69.6 p -71.69 145.19 49.02 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.49 -0.93 . . . . 52.43 108.49 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.28 -26.69 51.18 Favored Glycine 0 N--CA 1.454 -0.132 0 N-CA-C 118.481 2.153 . . . . 63.52 118.481 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' SER . . . . . . . . . . . . . 7.3 p -74.89 -9.42 58.52 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 117.354 2.353 . . . . 83.43 117.354 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' SER . . . . . 0.413 ' CB ' ' H ' ' B' ' 96' ' ' ALA . 1.8 p -91.77 152.86 19.96 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 117.262 2.319 . . . . 69.58 117.262 -179.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 11.5 tttp -148.89 141.55 24.47 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.64 -0.709 . . . . 57.54 109.38 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -54.34 144.4 41.6 Favored Pre-proline 0 CA--C 1.555 1.162 0 N-CA-C 107.882 -1.155 . . . . 68.5 107.882 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -76.19 8.1 14.14 Favored 'Cis proline' 0 N--CA 1.463 -0.277 0 N-CA-C 116.83 1.819 . . . . 55.42 116.83 0.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -109.97 95.52 5.65 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 120.075 -0.65 . . . . 81.77 111.453 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 1.8 m -98.77 116.18 30.42 Favored 'General case' 0 CA--C 1.509 -0.624 0 C-N-CA 120.018 -0.673 . . . . 43.1 109.516 179.713 -31.315 -86.326 -63.615 101.522 2.016 104.412 -70.48 -52.758 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ALA . . . . . 0.454 ' O ' ' HA ' ' B' ' 86' ' ' GLU . . . -89.64 150.89 22.17 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 107.627 -1.249 . . . . 57.98 107.627 179.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' TYR . . . . . 0.455 ' CZ ' ' HE2' ' B' ' 30' ' ' MET . 55.7 m-85 -135.58 132.79 37.6 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 114.396 1.258 . . . . 41.97 114.396 179.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -96.05 113.33 24.93 Favored 'General case' 0 C--O 1.243 0.72 0 N-CA-C 106.848 -1.538 . . . . 41.94 106.848 178.063 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 19.5 m -85.6 125.93 33.5 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 114.905 -1.043 . . . . 34.44 111.118 -178.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.39 108.56 9.71 Favored 'General case' 0 C--O 1.22 -0.449 0 O-C-N 123.857 0.723 . . . . 46.73 110.902 178.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -76.86 152.93 35.25 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.394 -0.965 . . . . 77.48 108.394 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ALA . . . . . . . . . . . . . . . -170.01 174.46 5.51 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 112.484 0.55 . . . . 35.72 112.484 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ASN . . . . . 0.495 ' HA ' ' O ' ' B' ' 79' ' ' MET . 1.6 m-80 -139.09 95.99 3.04 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 105.427 -2.064 . . . . 49.83 105.427 178.665 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LYS . . . . . 1.031 ' HE3' HD11 ' B' ' 81' ' ' ILE . 42.8 mtmt -134.51 163.02 30.66 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-O 121.247 0.546 . . . . 70.8 111.857 -177.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HIS . . . . . 0.926 ' HB2' ' HB ' ' B' ' 124' ' ' VAL . 34.4 m-70 -73.45 143.17 46.79 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 106.322 -1.732 . . . . 40.97 106.322 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 7.8 pt -106.18 155.86 6.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 118.369 -1.332 . . . . 26.47 110.564 178.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.484 HD11 ' CG2' ' B' ' 124' ' ' VAL . 71.0 mt -134.91 116.12 20.05 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.394 0 N-CA-C 104.887 -2.264 . . . . 28.62 104.887 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' VAL . . . . . 0.439 HG12 ' HA ' ' B' ' 120' ' ' PHE . 10.7 m -123.81 157.38 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 O-C-N 124.584 1.178 . . . . 35.29 110.356 -179.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.458 ' HB3' ' HB2' ' B' ' 119' ' ' HIS . . . -100.04 114.01 27.01 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 107.143 -1.429 . . . . 27.81 107.143 179.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' CYS . . . . . . . . . . . . . 29.6 m -93.59 145.86 24.23 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 119.813 -0.755 . . . . 47.21 111.409 178.997 -49.749 -118.289 -84.65 104.54 2.041 102.032 -63.231 -69.505 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLU . . . . . 0.409 ' HG2' HG11 ' B' ' 118' ' ' VAL . 6.9 pt-20 -157.49 159.53 37.33 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.282 -0.636 . . . . 63.02 109.282 177.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . 81.96 -177.56 53.81 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 115.871 1.108 . . . . 63.38 115.871 178.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -130.96 119.38 17.93 Favored Pre-proline 0 C--O 1.225 -0.191 0 N-CA-C 106.498 -1.667 . . . . 59.52 106.498 -179.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -68.12 144.96 74.38 Favored 'Cis proline' 0 CA--C 1.53 0.286 0 C-N-CA 124.992 -0.837 . . . . 56.02 112.778 -1.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.64 116.19 3.25 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 108.007 -1.109 . . . . 45.27 108.007 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' VAL . . . . . . . . . . . . . 3.1 m -141.76 154.93 66.41 Favored Pre-proline 0 C--O 1.243 0.717 0 O-C-N 122.168 -0.333 . . . . 29.42 110.919 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -62.17 129.81 28.39 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 123.247 2.631 . . . . 33.95 112.26 -179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' VAL . . . . . 0.409 HG11 ' HG2' ' B' ' 111' ' ' GLU . 5.6 m -127.48 -9.37 4.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 120.729 -0.388 . . . . 38.6 111.95 179.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HIS . . . . . 0.458 ' HB2' ' HB3' ' B' ' 109' ' ' ALA . 17.1 m-70 -147.5 137.71 23.1 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 107.621 -1.251 . . . . 64.33 107.621 -179.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' PHE . . . . . 0.439 ' HA ' HG12 ' B' ' 108' ' ' VAL . 35.2 t80 -85.85 174.47 9.28 Favored 'General case' 0 N--CA 1.448 -0.565 1 N-CA-C 99.777 -4.157 . . . . 43.76 99.777 175.473 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' B' ' 122' ' ' ALA . 14.7 t70 -154.62 -25.0 0.12 Allowed 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 115.691 1.737 . . . . 61.23 115.691 -179.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' B' ' 121' ' ' ASP . . . 170.61 168.62 0.07 Allowed 'General case' 0 CA--C 1.508 -0.635 0 O-C-N 123.987 0.804 . . . . 32.55 111.95 -179.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' B' ' 105' ' ' HIS . 5.2 p -132.51 91.83 2.98 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.427 -0.806 . . . . 52.74 109.598 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' VAL . . . . . 0.926 ' HB ' ' HB2' ' B' ' 105' ' ' HIS . 24.9 t . . . . . 0 C--O 1.25 1.125 0 CA-C-N 115.372 -0.831 . . . . 51.46 111.56 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_