data_6l79_residue ############################ # Computer software used # ############################ 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 6l79 _Structure_validation_residue.Date_analyzed 2020-11-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.454 0 CA-C-O 120.961 0.41 . . . . 130.27 110.629 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . . . -60.02 -48.99 79.43 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 107.904 -1.147 . . . . 129.52 107.904 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . . . -44.61 -69.34 0.14 Allowed 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 115.504 1.668 . . . . 119.48 115.504 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -67.95 11.18 0.16 Allowed 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 117.043 2.238 . . . . 107.58 117.043 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . . . -44.57 -53.93 6.61 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 113.06 0.763 . . . . 94.46 113.06 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -66.44 -15.22 63.16 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 118.201 2.667 . . . . 98.9 118.201 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.3 pt -127.9 15.7 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 113.804 1.038 . . . . 66.2 113.804 -171.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.71 -48.78 79.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 96.4 110.764 179.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -49.58 -39.78 36.38 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.341 -0.39 . . . . 71.8 110.72 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.2 mt -68.66 -52.92 25.88 Favored 'General case' 0 C--O 1.207 -1.17 0 C-N-CA 125.439 1.496 . . . . 55.11 113.534 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.73 -24.24 66.67 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 115.286 1.587 . . . . 58.26 115.286 178.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -74.44 -30.25 61.81 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 119.348 -0.358 . . . . 82.76 110.472 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -80.31 -1.48 41.17 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 114.824 -2.751 . . . . 81.14 114.464 172.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.1 mt -91.51 123.13 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 O-C-N 119.637 -1.914 . . . . 62.87 114.285 171.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 75.1 t -126.33 122.79 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 112.848 0.685 . . . . 64.0 112.848 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -90.68 127.13 36.2 Favored 'General case' 0 C--O 1.197 -1.696 0 O-C-N 124.699 1.249 . . . . 60.04 112.201 171.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -133.89 67.59 1.51 Allowed 'General case' 0 C--O 1.209 -1.04 0 N-CA-C 106.329 -1.73 . . . . 68.51 106.329 -175.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.44 -32.07 68.36 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 114.468 1.284 . . . . 55.68 114.468 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . . . -64.04 -38.18 90.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.442 -0.344 . . . . 68.8 111.07 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -103.72 7.1 37.27 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.003 1.483 . . . . 73.78 115.003 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.99 32.89 62.98 Favored Glycine 0 C--O 1.216 -1.028 0 O-C-N 121.629 -0.669 . . . . 54.07 113.671 172.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -132.75 140.3 47.98 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 115.584 1.698 . . . . 65.1 115.584 -172.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 46.8 mt -128.95 133.48 66.03 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.976 0 O-C-N 121.26 -0.9 . . . . 49.12 108.789 165.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -117.61 137.95 52.28 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.614 1.339 . . . . 68.87 114.614 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -111.09 97.99 7.2 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.501 -0.555 . . . . 51.18 109.501 159.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.9 t70 60.07 -126.54 1.1 Allowed 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 105.509 -2.034 . . . . 81.94 105.509 -170.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -95.61 9.83 38.85 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.648 1.113 . . . . 123.3 110.38 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -93.2 126.58 38.38 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-O 118.605 -0.712 . . . . 71.53 109.603 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -79.78 131.05 35.81 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 113.823 1.045 . . . . 53.77 113.823 173.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.7 mmt -119.31 160.83 21.49 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.891 1.071 . . . . 47.5 113.891 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -127.47 144.16 51.1 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.674 -1.232 . . . . 54.81 107.674 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 14.5 tp -93.01 110.6 22.07 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 123.832 0.707 . . . . 48.21 111.23 166.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 12.5 mtp -117.68 158.46 24.65 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 113.224 0.824 . . . . 72.44 113.224 -173.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -79.69 128.43 33.4 Favored 'General case' 0 C--O 1.191 -2.01 0 O-C-N 124.465 1.103 . . . . 62.47 111.497 176.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.6 p -53.79 -38.27 64.33 Favored 'General case' 0 C--O 1.207 -1.143 0 O-C-N 120.904 -1.122 . . . . 68.43 110.113 176.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.73 -30.35 63.44 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-O 117.126 -1.416 . . . . 76.72 111.149 -177.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.18 -38.0 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 CA-C-O 117.637 -1.173 . . . . 74.58 110.615 178.541 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 mp -66.74 -28.92 68.8 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 117.896 -1.05 . . . . 67.55 111.334 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.96 -49.0 83.33 Favored Glycine 0 N--CA 1.471 1.023 0 CA-C-O 117.594 -1.67 . . . . 60.44 109.863 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -52.11 -52.69 49.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 117.987 0.894 . . . . 102.81 111.161 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . 0.915 ' CB ' ' O ' ' A' ' 703' ' ' HOH . 13.4 tp -54.93 -49.39 71.43 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.73 -0.47 . . . . 69.99 109.73 179.61 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ARG . . . . . 0.548 ' NH2' ' O ' ' A' ' 154' ' ' ALA . 9.9 ttt180 -57.4 -47.36 81.92 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 118.179 -0.915 . . . . 57.04 110.48 179.349 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . . . -66.97 -51.22 57.83 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-O 118.268 -0.873 . . . . 59.32 108.933 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -57.02 -44.41 82.81 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 121.212 1.824 . . . . 84.92 112.672 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . 0.624 ' CD1' ' CD1' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -59.89 -49.68 76.74 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.785 -0.45 . . . . 72.65 109.785 178.603 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -52.84 -45.69 67.47 Favored 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 121.436 0.636 . . . . 57.4 112.138 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -69.34 -43.34 73.85 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.596 -0.729 . . . . 75.61 112.262 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 17.8 mtt -71.84 -42.91 66.37 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-O 119.387 -0.34 . . . . 102.23 111.216 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . 0.624 ' CD1' ' CD1' ' A' ' 58' ' ' LEU . 2.7 mp -124.89 6.03 8.04 Favored 'General case' 0 C--O 1.25 1.099 0 C-N-CA 114.215 -2.994 . . . . 88.29 117.825 -173.374 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . 0.424 ' O ' ' OG1' ' A' ' 67' ' ' THR . . . 78.27 -174.48 55.0 Favored Glycine 0 N--CA 1.451 -0.34 0 O-C-N 121.274 -0.891 . . . . 70.48 112.155 179.263 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 24.2 tp -77.3 -49.41 15.07 Favored 'General case' 0 C--O 1.194 -1.851 0 N-CA-C 115.148 1.536 . . . . 64.03 115.148 -167.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -78.02 -24.39 47.87 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 114.566 -2.854 . . . . 92.64 111.621 -171.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 -65.2 -49.04 71.3 Favored 'General case' 0 C--O 1.213 -0.834 0 O-C-N 117.326 -3.359 . . . . 114.47 109.437 169.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 63' ' ' GLY . 16.2 m -57.49 -42.7 83.21 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 114.381 1.252 . . . . 56.86 114.381 176.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -60.79 -57.93 10.61 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 108.616 -0.883 . . . . 76.0 108.616 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -55.12 -35.96 65.21 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 114.596 1.332 . . . . 116.85 114.596 176.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -57.31 -49.79 74.98 Favored 'General case' 0 CA--C 1.505 -0.76 0 O-C-N 116.993 -3.567 . . . . 56.05 111.785 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -67.66 -34.69 77.44 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 124.217 0.948 . . . . 50.98 112.081 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.23 -48.57 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 N-CA-C 108.989 -0.745 . . . . 51.61 108.989 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.3 mtm105 -57.42 -44.5 84.69 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.064 1.135 . . . . 91.59 114.064 173.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 87.1 m -58.07 -45.83 86.46 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 117.678 -1.609 . . . . 58.6 108.538 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.73 -39.7 85.86 Favored Glycine 0 C--O 1.205 -1.678 0 N-CA-C 109.884 -1.286 . . . . 41.49 109.884 -172.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -58.86 -44.51 91.06 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 122.779 0.431 . . . . 62.65 111.344 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -66.54 -38.76 87.83 Favored 'General case' 0 C--O 1.204 -1.298 0 O-C-N 124.195 0.934 . . . . 84.77 111.34 176.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.85 -41.81 97.72 Favored 'General case' 0 N--CA 1.438 -1.033 0 O-C-N 119.857 -1.777 . . . . 44.7 112.024 177.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -58.67 -41.3 95.67 Favored Glycine 0 C--O 1.251 1.182 0 N-CA-C 111.274 -0.73 . . . . 47.2 111.274 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.2 mtt -65.29 -43.15 92.07 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 118.549 -0.739 . . . . 72.08 111.174 177.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . . . -62.83 -42.76 99.86 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 117.974 -1.013 . . . . 57.19 108.564 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -65.4 -41.49 93.61 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 117.475 -1.25 . . . . 51.35 110.451 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.33 -38.83 92.67 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 124.933 1.396 . . . . 51.33 110.255 -178.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -59.84 -45.61 91.87 Favored 'General case' 0 C--O 1.207 -1.168 0 N-CA-C 108.396 -0.965 . . . . 108.93 108.396 -179.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.0 t -68.17 -41.8 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-O 117.475 -1.25 . . . . 58.81 111.417 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 43.5 p -79.82 -23.93 41.7 Favored 'General case' 0 C--O 1.211 -0.953 0 O-C-N 123.854 0.721 . . . . 61.92 112.632 -171.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 80.3 p -76.39 -26.41 55.58 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 118.981 -1.087 . . . . 83.93 110.506 -179.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -77.0 -39.03 51.89 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 119.221 -0.991 . . . . 97.82 111.386 173.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp -64.92 -41.76 95.27 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 118.729 -0.653 . . . . 92.22 110.72 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -108.64 119.53 48.98 Favored Pre-proline 0 N--CA 1.483 1.179 0 N-CA-C 107.992 -1.114 . . . . 118.56 107.992 -178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -101.46 40.92 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 124.35 3.367 . . . . 158.34 109.615 -174.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 54.43 41.85 31.73 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 117.021 -1.466 . . . . 182.27 111.711 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . . . -59.59 -46.28 89.41 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 104.905 -2.257 . . . . 162.78 104.905 175.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -126.82 110.48 13.12 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.609 -1.626 . . . . 156.43 106.609 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -41.45 -44.11 2.79 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 116.028 1.862 . . . . 138.37 116.028 -178.281 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.11 -44.58 19.71 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 118.397 -0.811 . . . . 99.03 111.11 -179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . 0.382 2.9 mm-40 -67.0 -32.42 73.64 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 117.477 -1.249 . . . . 103.27 110.439 -178.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.95 -43.66 98.17 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 118.762 -1.175 . . . . 68.11 109.47 177.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -62.29 -32.23 72.94 Favored 'General case' 0 C--O 1.195 -1.785 0 O-C-N 124.357 1.035 . . . . 58.49 112.152 -177.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 9.4 mmt -69.75 -5.38 24.84 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 116.184 1.92 . . . . 64.66 116.184 -174.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.46 -39.01 78.72 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 124.027 0.829 . . . . 47.11 112.525 175.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.19 -60.64 8.59 Favored Glycine 0 C--O 1.211 -1.312 0 N-CA-C 109.688 -1.365 . . . . 43.92 109.688 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.63 -40.76 82.66 Favored 'Trans proline' 0 C--O 1.177 -2.537 0 C-N-CA 123.01 2.473 . . . . 51.2 112.413 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -62.84 -40.42 97.38 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-O 117.925 -1.036 . . . . 51.94 108.959 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 67.3 mmm -65.77 -35.54 81.0 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-O 118.334 -0.841 . . . . 48.04 109.096 -179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HIS . . . . . 0.618 ' CD2' ' O1 ' ' A' ' 602' ' ' IPH . 0.0 OUTLIER -57.45 -36.02 70.88 Favored 'General case' 0 N--CA 1.525 3.312 0 CA-C-O 128.235 3.874 . . . . 46.89 113.387 177.157 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -78.5 -40.71 18.06 Favored Glycine 0 C--O 1.214 -1.118 0 O-C-N 118.14 -2.85 . . . . 38.81 112.131 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 34.1 mt -64.58 -32.87 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 CA-C-O 117.887 -1.054 . . . . 41.89 109.998 -178.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ARG . . . . . 0.621 ' NH1' ' O ' ' A' ' 702' ' ' HOH . 0.6 OUTLIER -84.26 -2.32 56.76 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 117.777 -1.106 . . . . 60.43 112.012 -179.032 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 81.03 23.06 59.97 Favored Glycine 0 C--O 1.199 -2.038 0 O-C-N 124.519 1.137 . . . . 39.39 110.796 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' MET . . . . . . . . . . . . . 3.1 mtt -91.13 -52.69 4.71 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 115.396 1.628 . . . . 59.59 115.396 -176.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 13.7 p -158.97 158.74 2.56 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.036 0 CA-C-O 121.165 0.507 . . . . 41.19 111.158 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -105.78 122.56 46.34 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 108.932 -0.766 . . . . 54.38 108.932 175.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 88.4 t -92.81 128.47 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 124.077 0.861 . . . . 53.83 108.931 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -114.96 125.96 54.22 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 106.702 -1.592 . . . . 105.33 106.702 169.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.7 p -99.39 117.1 44.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 1 C-N-CA 110.705 -4.398 . . . . 85.7 110.473 -179.725 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -68.35 -52.83 28.95 Favored 'General case' 0 N--CA 1.475 0.812 2 O-C-N 130.329 4.768 . . . . 82.89 110.285 168.674 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -147.16 129.71 15.93 Favored 'General case' 0 C--N 1.349 0.549 0 C-N-CA 125.52 1.528 . . . . 113.82 112.654 -176.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 59.6 tp -140.53 118.14 11.59 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 124.054 0.942 . . . . 79.54 109.449 174.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -134.88 140.12 45.54 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 115.509 -2.476 . . . . 115.67 107.117 161.108 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -149.89 155.14 39.5 Favored 'General case' 0 CA--C 1.527 0.095 1 O-C-N 129.733 4.396 . . . . 92.27 113.273 -179.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.4 t -158.41 119.85 3.49 Favored 'General case' 0 N--CA 1.416 -2.131 0 N-CA-C 102.164 -3.273 . . . . 94.94 102.164 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HIS . . . . . 0.627 ' CE1' ' CA ' ' A' ' 170' ' ' MET . 7.3 t60 -74.08 -28.26 61.3 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.277 0.473 . . . . 98.42 112.277 -179.485 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -75.68 -46.26 32.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.392 -0.367 . . . . 111.9 111.916 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 29.4 mt -82.88 1.54 38.9 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 116.948 -1.501 . . . . 98.37 112.385 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . . . 53.67 51.42 15.07 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 107.219 -1.4 . . . . 83.37 107.219 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . . . -121.79 135.12 54.92 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 125.07 1.481 . . . . 84.15 108.704 -177.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -154.6 127.44 8.16 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 118.741 -1.183 . . . . 69.06 110.652 -178.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -142.66 126.31 16.93 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 106.864 -1.532 . . . . 73.01 106.864 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -128.71 135.09 48.76 Favored 'General case' 0 C--O 1.202 -1.426 0 N-CA-C 107.099 -1.445 . . . . 64.87 107.099 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -136.17 104.36 5.63 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 103.164 -2.902 . . . . 84.52 103.164 172.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.06 143.37 51.14 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 124.543 1.152 . . . . 61.31 109.803 -175.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 31.5 m-20 -85.45 149.65 25.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.089 -1.414 . . . . 65.37 110.973 161.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' TRP . . . . . 0.433 ' N ' ' O ' ' A' ' 189' ' ' CYS . 3.0 m0 -120.8 113.78 20.66 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 104.334 -2.469 . . . . 50.13 104.334 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 27.9 mt -109.79 148.38 31.57 Favored 'General case' 0 C--O 1.205 -1.281 0 N-CA-C 108.974 -0.75 . . . . 54.96 108.974 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 57.17 38.22 28.81 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 115.17 1.545 . . . . 64.45 115.17 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 3.7 t -62.67 128.77 37.51 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 116.27 -2.172 . . . . 44.49 110.903 -176.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -68.29 -29.87 68.74 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 105.162 -2.162 . . . . 40.5 105.162 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -74.15 -37.42 64.03 Favored 'General case' 0 C--O 1.261 1.685 0 CA-C-O 122.342 1.068 . . . . 48.14 113.585 -171.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.4 -39.25 90.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.181 -0.918 . . . . 43.03 109.872 172.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -63.75 -44.75 92.56 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 124.019 0.824 . . . . 89.15 112.673 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.6 m -72.81 -36.0 51.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 119.122 -1.031 . . . . 45.99 111.723 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -57.52 -51.31 69.97 Favored 'General case' 0 CA--C 1.573 1.827 0 N-CA-C 112.847 0.684 . . . . 43.27 112.847 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 27.8 mt -68.13 -19.49 64.83 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 114.7 1.37 . . . . 53.16 114.7 179.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.8 p -78.43 -28.06 46.66 Favored 'General case' 0 CA--C 1.501 -0.935 0 O-C-N 121.053 -1.029 . . . . 56.81 109.833 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -92.41 -30.08 15.95 Favored 'General case' 0 CA--C 1.559 1.327 0 N-CA-C 116.701 2.111 . . . . 65.84 116.701 170.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -136.24 148.55 64.84 Favored Pre-proline 0 CA--C 1.516 -0.354 0 O-C-N 122.155 -0.341 . . . . 51.45 110.288 -169.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -64.85 164.93 22.71 Favored 'Trans proline' 0 CA--C 1.504 -1.019 0 O-C-N 122.435 0.703 . . . . 53.38 111.517 169.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -46.75 133.92 10.25 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.432 0.634 . . . . 57.91 111.406 176.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 91.4 p -93.77 162.72 13.81 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 128.359 2.664 . . . . 71.21 113.122 -167.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -69.0 -39.98 79.02 Favored 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 125.478 1.511 . . . . 89.53 112.383 170.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -117.35 166.99 11.79 Favored Pre-proline 0 CA--C 1.562 1.422 0 N-CA-C 112.685 0.624 . . . . 98.44 112.685 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -61.04 143.1 99.06 Favored 'Trans proline' 0 C--N 1.361 1.233 0 O-C-N 122.536 0.756 . . . . 58.2 111.587 175.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ALA . . . . . 0.548 ' O ' ' NH2' ' A' ' 55' ' ' ARG . . . -102.23 -5.9 23.79 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 118.562 2.801 . . . . 46.8 118.562 -173.313 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 96.2 m -93.52 69.83 4.2 Favored 'General case' 0 C--O 1.199 -1.569 0 CA-C-O 123.66 1.695 . . . . 41.03 111.501 -164.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' TRP . . . . . . . . . . . . . 14.6 m0 -79.57 -40.02 30.41 Favored 'General case' 0 C--O 1.19 -2.027 0 O-C-N 120.853 -1.155 . . . . 53.62 112.124 -163.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 7.8 ttp -71.38 -43.76 66.25 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 124.71 1.204 . . . . 56.85 109.03 -179.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 46.3 mt -56.22 -46.12 79.66 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 120.758 -0.377 . . . . 39.11 110.229 172.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 12.7 tp -59.92 -41.58 92.07 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-O 120.885 0.374 . . . . 51.82 111.746 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -63.47 -48.23 80.19 Favored Glycine 0 C--O 1.209 -1.411 0 N-CA-C 109.801 -1.32 . . . . 40.12 109.801 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -50.71 -52.42 40.5 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 118.128 -0.939 . . . . 41.7 111.229 172.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -54.42 -48.06 72.09 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.822 0.737 . . . . 49.22 110.79 -177.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' CYS . . . . . . . . . . . . . 62.9 m -65.52 -42.79 91.62 Favored 'General case' 0 C--O 1.244 0.81 0 O-C-N 124.227 0.954 . . . . 71.56 112.903 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -68.56 -51.69 29.75 Favored Glycine 0 N--CA 1.476 1.34 0 CA-C-O 122.525 1.069 . . . . 45.18 112.961 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -55.55 -51.09 68.23 Favored 'General case' 0 N--CA 1.421 -1.876 0 O-C-N 121.642 -0.917 . . . . 50.68 110.613 172.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 57.8 m -73.93 -34.11 64.22 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 116.833 -1.947 . . . . 53.32 112.528 -172.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 1.7 m -75.62 -10.03 59.09 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 115.846 -2.342 . . . . 65.72 115.474 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -80.19 -48.24 13.44 Favored 'General case' 0 C--O 1.208 -1.085 0 O-C-N 118.659 -2.526 . . . . 63.38 110.305 171.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' VAL . . . . . . . . . . . . . 2.7 m -71.11 -28.87 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 120.199 -0.601 . . . . 62.74 111.9 -173.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' MET . . . . . 0.627 ' CA ' ' CE1' ' A' ' 123' ' ' HIS . 6.3 mmt -96.21 -3.48 44.18 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 120.155 -1.591 . . . . 92.29 114.825 178.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . 62.87 18.46 59.72 Favored Glycine 0 C--O 1.216 -1.001 0 N-CA-C 118.223 2.049 . . . . 83.36 118.223 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -151.75 162.51 40.91 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.976 0.91 . . . . 83.99 110.682 175.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 2.1 m -76.46 112.19 12.72 Favored 'General case' 0 C--O 1.245 0.844 0 C-N-CA 115.31 -2.556 . . . . 72.29 113.516 -175.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 47.0 mm -98.79 121.37 49.29 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 O-C-N 129.005 3.941 . . . . 61.41 107.912 172.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ILE . . . . . . . . . . . . . 30.9 mm -108.17 138.5 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 N-CA-C 107.818 -1.179 . . . . 59.48 107.818 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -118.17 154.38 32.26 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.91 0.862 . . . . 49.34 112.538 173.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -134.89 140.37 45.73 Favored 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 105.15 -2.167 . . . . 95.24 105.15 171.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -84.32 104.77 14.63 Favored 'General case' 0 N--CA 1.434 -1.239 1 O-C-N 129.336 4.147 . . . . 55.47 109.651 -179.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 43.1 p -92.73 -31.24 15.15 Favored 'General case' 0 CA--C 1.497 -1.073 1 C-N-CA 110.078 -4.649 . . . . 65.3 112.988 -173.12 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HIS . . . . . 0.615 ' O ' ' N ' ' A' ' 190' ' ' ARG . 2.2 m-70 -122.61 125.39 45.55 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 117.775 -1.107 . . . . 80.39 109.613 172.611 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' CYS . . . . . . . . . . . . . 8.6 t -129.19 130.28 46.13 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 125.315 1.634 . . . . 52.43 110.016 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 42.4 t -46.73 -39.4 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 124.802 1.314 . . . . 47.25 108.722 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' ALA . . . . . . . . . . . . . . . -70.9 -12.26 61.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.307 1.225 . . . . 56.05 114.307 -176.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -90.07 -5.78 56.2 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 118.666 -0.683 . . . . 74.33 110.625 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 103.23 -8.65 53.31 Favored Glycine 0 N--CA 1.441 -0.968 0 CA-C-O 119.346 -0.697 . . . . 68.97 113.856 -174.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -66.74 154.66 40.17 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 117.575 0.687 . . . . 65.05 110.274 176.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -57.35 -50.41 73.05 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 128.424 2.69 . . . . 113.21 111.909 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -142.56 -178.71 5.9 Favored 'General case' 0 C--O 1.261 1.663 0 N-CA-C 105.855 -1.905 . . . . 59.37 105.855 172.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' CYS . . . . . 0.433 ' O ' ' N ' ' A' ' 134' ' ' TRP . 93.0 m -100.7 145.05 28.93 Favored 'General case' 1 N--CA 1.556 4.835 0 N-CA-C 105.838 -1.912 . . . . 53.77 105.838 -174.101 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' ARG . . . . . 0.615 ' N ' ' O ' ' A' ' 180' ' ' HIS . 2.9 tmm_? -138.63 142.81 39.08 Favored 'General case' 0 CA--C 1.479 -1.76 0 CA-C-N 114.02 -1.445 . . . . 73.89 110.99 -177.201 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' ILE . . . . . . . . . . . . . 18.7 pt -134.45 143.1 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 122.526 0.33 . . . . 60.75 111.059 -176.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 2.1 mm -122.08 130.39 74.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 107.954 -1.128 . . . . 62.23 107.954 169.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -122.27 126.25 6.35 Favored Glycine 0 N--CA 1.478 1.471 0 O-C-N 125.385 1.678 . . . . 63.96 115.293 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 75.1 mttt -134.14 164.5 43.56 Favored Pre-proline 0 N--CA 1.468 0.464 0 N-CA-C 107.005 -1.48 . . . . 83.21 107.005 -178.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -66.4 152.63 80.51 Favored 'Trans proline' 0 C--O 1.198 -1.517 0 N-CA-C 107.347 -1.828 . . . . 71.05 107.347 174.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' LEU . . . . . . . . . . . . . 23.4 tp -53.55 -36.61 62.03 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 124.209 0.943 . . . . 85.2 110.957 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' SER . . . . . . . . . . . . . 4.7 m -51.46 -48.26 62.86 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 117.455 -1.259 . . . . 103.84 111.179 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -70.37 -4.07 20.54 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 115.409 1.633 . . . . 106.02 115.409 -174.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -92.51 -33.27 14.54 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 120.762 1.619 . . . . 119.81 108.864 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' GLU . . . . . . . . . . . . . . . 61.2 37.95 17.07 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 125.021 1.451 . . . . 155.73 110.04 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -149.53 76.93 1.33 Allowed 'General case' 0 N--CA 1.485 1.291 0 O-C-N 125.097 1.498 . . . . 143.77 107.532 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ALA . . . . . . . . . . . . . . . -74.61 72.93 1.97 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 107.675 -1.232 . . . . 155.31 107.675 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ASP . . . . . . . . . . . . . . . -118.56 2.84 11.79 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 125.311 1.632 . . . . 159.99 109.832 179.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -82.69 125.99 31.85 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 106.619 -1.622 . . . . 162.97 106.619 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.35 77.89 9.08 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 124.644 1.215 . . . . 125.05 110.299 -177.22 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' ILE . . . . . . . . . . . . . . . -66.54 -37.37 79.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 123.661 0.6 . . . . 153.86 111.196 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ARG . . . . . . . . . . . . . . . -123.96 105.86 9.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 186.81 111.161 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' PHE . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 166.33 111.168 -179.991 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' IPH . . . . . 0.618 ' O1 ' ' CD2' ' A' ' 106' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 701' ' ' HOH . . . . . 0.704 ' O ' ' O ' ' A' ' 54' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 702' ' ' HOH . . . . . 0.621 ' O ' ' NH1' ' A' ' 109' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 703' ' ' HOH . . . . . 0.915 ' O ' ' CB ' ' A' ' 54' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 704' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 705' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 706' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 708' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 709' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 710' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 711' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 712' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 713' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 714' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 715' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 716' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 717' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 718' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 719' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 720' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 721' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 722' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 723' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.454 0 CA-C-O 120.961 0.41 . . . . 130.27 110.629 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . . . -60.02 -48.99 79.43 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 107.904 -1.147 . . . . 129.52 107.904 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . . . -44.61 -69.34 0.14 Allowed 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 115.504 1.668 . . . . 119.48 115.504 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -67.95 11.18 0.16 Allowed 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 117.043 2.238 . . . . 107.58 117.043 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . . . -44.57 -53.93 6.61 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 113.06 0.763 . . . . 94.46 113.06 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -66.44 -15.22 63.16 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 118.201 2.667 . . . . 98.9 118.201 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.3 pt -127.9 15.7 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 113.804 1.038 . . . . 66.2 113.804 -171.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.71 -48.78 79.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 96.4 110.764 179.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -49.58 -39.78 36.38 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.341 -0.39 . . . . 71.8 110.72 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.2 mt -68.66 -52.92 25.88 Favored 'General case' 0 C--O 1.207 -1.17 0 C-N-CA 125.439 1.496 . . . . 55.11 113.534 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.73 -24.24 66.67 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 115.286 1.587 . . . . 58.26 115.286 178.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -74.44 -30.25 61.81 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 119.348 -0.358 . . . . 82.76 110.472 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -80.31 -1.48 41.17 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 114.824 -2.751 . . . . 81.14 114.464 172.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.1 mt -91.51 123.13 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 O-C-N 119.637 -1.914 . . . . 62.87 114.285 171.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 75.1 t -126.33 122.79 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 112.848 0.685 . . . . 64.0 112.848 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -90.68 127.13 36.2 Favored 'General case' 0 C--O 1.197 -1.696 0 O-C-N 124.699 1.249 . . . . 60.04 112.201 171.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -133.89 67.59 1.51 Allowed 'General case' 0 C--O 1.209 -1.04 0 N-CA-C 106.329 -1.73 . . . . 68.51 106.329 -175.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.44 -32.07 68.36 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 114.468 1.284 . . . . 55.68 114.468 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . . . -64.04 -38.18 90.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.442 -0.344 . . . . 68.8 111.07 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -103.72 7.1 37.27 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.003 1.483 . . . . 73.78 115.003 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.99 32.89 62.98 Favored Glycine 0 C--O 1.216 -1.028 0 O-C-N 121.629 -0.669 . . . . 54.07 113.671 172.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . 0.414 HE21 ' HE1' ' A' ' 37' ' ' TRP . 10.1 mt-30 -132.75 140.3 47.98 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 115.584 1.698 . . . . 65.1 115.584 -172.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 46.8 mt -128.95 133.48 66.03 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.976 0 O-C-N 121.26 -0.9 . . . . 49.12 108.789 165.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' TRP . . . . . 0.414 ' HE1' HE21 ' A' ' 35' ' ' GLN . 88.4 m95 -117.61 137.95 52.28 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.614 1.339 . . . . 68.87 114.614 178.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -111.09 97.99 7.2 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.501 -0.555 . . . . 51.18 109.501 159.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.9 t70 60.07 -126.54 1.1 Allowed 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 105.509 -2.034 . . . . 81.94 105.509 -170.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -95.61 9.83 38.85 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.648 1.113 . . . . 123.3 110.38 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -93.2 126.58 38.38 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-O 118.605 -0.712 . . . . 71.53 109.603 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -79.78 131.05 35.81 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 113.823 1.045 . . . . 53.77 113.823 173.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.7 mmt -119.31 160.83 21.49 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.891 1.071 . . . . 47.5 113.891 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -127.47 144.16 51.1 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.674 -1.232 . . . . 54.81 107.674 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 14.5 tp -93.01 110.6 22.07 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 123.832 0.707 . . . . 48.21 111.23 166.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 12.5 mtp -117.68 158.46 24.65 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 113.224 0.824 . . . . 72.44 113.224 -173.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -79.69 128.43 33.4 Favored 'General case' 0 C--O 1.191 -2.01 0 O-C-N 124.465 1.103 . . . . 62.47 111.497 176.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.6 p -53.79 -38.27 64.33 Favored 'General case' 0 C--O 1.207 -1.143 0 O-C-N 120.904 -1.122 . . . . 68.43 110.113 176.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.73 -30.35 63.44 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-O 117.126 -1.416 . . . . 76.72 111.149 -177.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.18 -38.0 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 CA-C-O 117.637 -1.173 . . . . 74.58 110.615 178.541 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 mp -66.74 -28.92 68.8 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 117.896 -1.05 . . . . 67.55 111.334 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.96 -49.0 83.33 Favored Glycine 0 N--CA 1.471 1.023 0 CA-C-O 117.594 -1.67 . . . . 60.44 109.863 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -52.11 -52.69 49.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 117.987 0.894 . . . . 102.81 111.161 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . 0.915 ' CB ' ' O ' ' A' ' 703' ' ' HOH . 13.4 tp -54.93 -49.39 71.43 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.73 -0.47 . . . . 69.99 109.73 179.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' A' ' 154' ' ' ALA . 9.9 ttt180 -57.4 -47.36 81.92 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 118.179 -0.915 . . . . 57.04 110.48 179.349 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . . . -66.97 -51.22 57.83 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-O 118.268 -0.873 . . . . 59.32 108.933 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . 0.488 ' O ' ' HG3' ' A' ' 61' ' ' MET . 11.3 m-20 -57.02 -44.41 82.81 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 121.212 1.824 . . . . 84.92 112.672 178.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . 1.045 HD13 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -59.89 -49.68 76.74 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.785 -0.45 . . . . 72.65 109.785 178.603 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -52.84 -45.69 67.47 Favored 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 121.436 0.636 . . . . 57.4 112.138 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -69.34 -43.34 73.85 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.596 -0.729 . . . . 75.61 112.262 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' MET . . . . . 0.488 ' HG3' ' O ' ' A' ' 57' ' ' ASP . 17.8 mtt -71.84 -42.91 66.37 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-O 119.387 -0.34 . . . . 102.23 111.216 179.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . 1.045 HD13 HD13 ' A' ' 58' ' ' LEU . 2.7 mp -124.89 6.03 8.04 Favored 'General case' 0 C--O 1.25 1.099 0 C-N-CA 114.215 -2.994 . . . . 88.29 117.825 -173.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 78.27 -174.48 55.0 Favored Glycine 0 N--CA 1.451 -0.34 0 O-C-N 121.274 -0.891 . . . . 70.48 112.155 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 24.2 tp -77.3 -49.41 15.07 Favored 'General case' 0 C--O 1.194 -1.851 0 N-CA-C 115.148 1.536 . . . . 64.03 115.148 -167.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -78.02 -24.39 47.87 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 114.566 -2.854 . . . . 92.64 111.621 -171.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ARG . . . . . 0.625 ' HD3' ' HB3' ' A' ' 62' ' ' LEU . 14.8 mtp180 -65.2 -49.04 71.3 Favored 'General case' 0 C--O 1.213 -0.834 0 O-C-N 117.326 -3.359 . . . . 114.47 109.437 169.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 58' ' ' LEU . 16.2 m -57.49 -42.7 83.21 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 114.381 1.252 . . . . 56.86 114.381 176.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -60.79 -57.93 10.61 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 108.616 -0.883 . . . . 76.0 108.616 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -55.12 -35.96 65.21 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 114.596 1.332 . . . . 116.85 114.596 176.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -57.31 -49.79 74.98 Favored 'General case' 0 CA--C 1.505 -0.76 0 O-C-N 116.993 -3.567 . . . . 56.05 111.785 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -67.66 -34.69 77.44 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 124.217 0.948 . . . . 50.98 112.081 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.23 -48.57 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 N-CA-C 108.989 -0.745 . . . . 51.61 108.989 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . 0.606 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 44.3 mtm105 -57.42 -44.5 84.69 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.064 1.135 . . . . 91.59 114.064 173.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 87.1 m -58.07 -45.83 86.46 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 117.678 -1.609 . . . . 58.6 108.538 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.73 -39.7 85.86 Favored Glycine 0 C--O 1.205 -1.678 0 N-CA-C 109.884 -1.286 . . . . 41.49 109.884 -172.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -58.86 -44.51 91.06 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 122.779 0.431 . . . . 62.65 111.344 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . 0.606 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 31.3 mm-40 -66.54 -38.76 87.83 Favored 'General case' 0 C--O 1.204 -1.298 0 O-C-N 124.195 0.934 . . . . 84.77 111.34 176.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.85 -41.81 97.72 Favored 'General case' 0 N--CA 1.438 -1.033 0 O-C-N 119.857 -1.777 . . . . 44.7 112.024 177.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -58.67 -41.3 95.67 Favored Glycine 0 C--O 1.251 1.182 0 N-CA-C 111.274 -0.73 . . . . 47.2 111.274 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' MET . . . . . 0.732 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 5.2 mtt -65.29 -43.15 92.07 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 118.549 -0.739 . . . . 72.08 111.174 177.044 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . 0.5 ' HA ' ' CD ' ' A' ' 84' ' ' GLU . . . -62.83 -42.76 99.86 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 117.974 -1.013 . . . . 57.19 108.564 179.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -65.4 -41.49 93.61 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 117.475 -1.25 . . . . 51.35 110.451 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.33 -38.83 92.67 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 124.933 1.396 . . . . 51.33 110.255 -178.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . 0.732 ' HG3' ' O ' ' A' ' 80' ' ' MET . 19.7 mt-10 -59.84 -45.61 91.87 Favored 'General case' 0 C--O 1.207 -1.168 0 N-CA-C 108.396 -0.965 . . . . 108.93 108.396 -179.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.0 t -68.17 -41.8 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-O 117.475 -1.25 . . . . 58.81 111.417 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 43.5 p -79.82 -23.93 41.7 Favored 'General case' 0 C--O 1.211 -0.953 0 O-C-N 123.854 0.721 . . . . 61.92 112.632 -171.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 80.3 p -76.39 -26.41 55.58 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 118.981 -1.087 . . . . 83.93 110.506 -179.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -77.0 -39.03 51.89 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 119.221 -0.991 . . . . 97.82 111.386 173.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp -64.92 -41.76 95.27 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 118.729 -0.653 . . . . 92.22 110.72 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -108.64 119.53 48.98 Favored Pre-proline 0 N--CA 1.483 1.179 0 N-CA-C 107.992 -1.114 . . . . 118.56 107.992 -178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -101.46 40.92 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 124.35 3.367 . . . . 158.34 109.615 -174.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 54.43 41.85 31.73 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 117.021 -1.466 . . . . 182.27 111.711 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . . . -59.59 -46.28 89.41 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 104.905 -2.257 . . . . 162.78 104.905 175.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASN . . . . . 0.515 ' ND2' ' HB2' ' A' ' 97' ' ' GLU . 17.7 t30 -126.82 110.48 13.12 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.609 -1.626 . . . . 156.43 106.609 177.215 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -41.45 -44.11 2.79 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 116.028 1.862 . . . . 138.37 116.028 -178.281 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . 0.57 ' HA ' HD21 ' A' ' 121' ' ' LEU . . . -80.11 -44.58 19.71 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 118.397 -0.811 . . . . 99.03 111.11 -179.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . 0.515 ' HB2' ' ND2' ' A' ' 94' ' ' ASN 0.382 2.9 mm-40 -67.0 -32.42 73.64 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 117.477 -1.249 . . . . 103.27 110.439 -178.839 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.95 -43.66 98.17 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 118.762 -1.175 . . . . 68.11 109.47 177.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -62.29 -32.23 72.94 Favored 'General case' 0 C--O 1.195 -1.785 0 O-C-N 124.357 1.035 . . . . 58.49 112.152 -177.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' MET . . . . . 0.579 ' CE ' HD22 ' A' ' 119' ' ' LEU . 9.4 mmt -69.75 -5.38 24.84 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 116.184 1.92 . . . . 64.66 116.184 -174.237 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.46 -39.01 78.72 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 124.027 0.829 . . . . 47.11 112.525 175.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.19 -60.64 8.59 Favored Glycine 0 C--O 1.211 -1.312 0 N-CA-C 109.688 -1.365 . . . . 43.92 109.688 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.63 -40.76 82.66 Favored 'Trans proline' 0 C--O 1.177 -2.537 0 C-N-CA 123.01 2.473 . . . . 51.2 112.413 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -62.84 -40.42 97.38 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-O 117.925 -1.036 . . . . 51.94 108.959 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . 0.424 ' O ' ' HG3' ' A' ' 109' ' ' ARG . 67.3 mmm -65.77 -35.54 81.0 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-O 118.334 -0.841 . . . . 48.04 109.096 -179.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.45 -36.02 70.88 Favored 'General case' 0 N--CA 1.525 3.312 0 CA-C-O 128.235 3.874 . . . . 46.89 113.387 177.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -78.5 -40.71 18.06 Favored Glycine 0 C--O 1.214 -1.118 0 O-C-N 118.14 -2.85 . . . . 38.81 112.131 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 34.1 mt -64.58 -32.87 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 CA-C-O 117.887 -1.054 . . . . 41.89 109.998 -178.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 105' ' ' MET . 0.6 OUTLIER -84.26 -2.32 56.76 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 117.777 -1.106 . . . . 60.43 112.012 -179.032 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 81.03 23.06 59.97 Favored Glycine 0 C--O 1.199 -2.038 0 O-C-N 124.519 1.137 . . . . 39.39 110.796 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' MET . . . . . 0.42 ' HE1' ' O ' ' A' ' 702' ' ' HOH . 3.1 mtt -91.13 -52.69 4.71 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 115.396 1.628 . . . . 59.59 115.396 -176.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 13.7 p -158.97 158.74 2.56 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.036 0 CA-C-O 121.165 0.507 . . . . 41.19 111.158 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -105.78 122.56 46.34 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 108.932 -0.766 . . . . 54.38 108.932 175.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 88.4 t -92.81 128.47 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 124.077 0.861 . . . . 53.83 108.931 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -114.96 125.96 54.22 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 106.702 -1.592 . . . . 105.33 106.702 169.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' VAL . . . . . 0.453 ' O ' HG13 ' A' ' 116' ' ' VAL . 2.7 p -99.39 117.1 44.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 1 C-N-CA 110.705 -4.398 . . . . 85.7 110.473 -179.725 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -68.35 -52.83 28.95 Favored 'General case' 0 N--CA 1.475 0.812 2 O-C-N 130.329 4.768 . . . . 82.89 110.285 168.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -147.16 129.71 15.93 Favored 'General case' 0 C--N 1.349 0.549 0 C-N-CA 125.52 1.528 . . . . 113.82 112.654 -176.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . 0.579 HD22 ' CE ' ' A' ' 100' ' ' MET . 59.6 tp -140.53 118.14 11.59 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 124.054 0.942 . . . . 79.54 109.449 174.414 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -134.88 140.12 45.54 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 115.509 -2.476 . . . . 115.67 107.117 161.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 96' ' ' ALA . 1.4 pt? -149.89 155.14 39.5 Favored 'General case' 0 CA--C 1.527 0.095 1 O-C-N 129.733 4.396 . . . . 92.27 113.273 -179.061 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.4 t -158.41 119.85 3.49 Favored 'General case' 0 N--CA 1.416 -2.131 0 N-CA-C 102.164 -3.273 . . . . 94.94 102.164 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HIS . . . . . 0.667 ' NE2' ' HA ' ' A' ' 170' ' ' MET . 1.9 t-80 -74.08 -28.26 61.3 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.277 0.473 . . . . 98.42 112.277 -179.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -75.68 -46.26 32.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.392 -0.367 . . . . 111.9 111.916 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 29.4 mt -82.88 1.54 38.9 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 116.948 -1.501 . . . . 98.37 112.385 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . . . 53.67 51.42 15.07 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 107.219 -1.4 . . . . 83.37 107.219 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . . . -121.79 135.12 54.92 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 125.07 1.481 . . . . 84.15 108.704 -177.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -154.6 127.44 8.16 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 118.741 -1.183 . . . . 69.06 110.652 -178.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -142.66 126.31 16.93 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 106.864 -1.532 . . . . 73.01 106.864 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -128.71 135.09 48.76 Favored 'General case' 0 C--O 1.202 -1.426 0 N-CA-C 107.099 -1.445 . . . . 64.87 107.099 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -136.17 104.36 5.63 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 103.164 -2.902 . . . . 84.52 103.164 172.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.06 143.37 51.14 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 124.543 1.152 . . . . 61.31 109.803 -175.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 31.5 m-20 -85.45 149.65 25.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.089 -1.414 . . . . 65.37 110.973 161.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' TRP . . . . . 0.468 ' CE2' HD13 ' A' ' 191' ' ' ILE . 3.0 m0 -120.8 113.78 20.66 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 104.334 -2.469 . . . . 50.13 104.334 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 27.9 mt -109.79 148.38 31.57 Favored 'General case' 0 C--O 1.205 -1.281 0 N-CA-C 108.974 -0.75 . . . . 54.96 108.974 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 57.17 38.22 28.81 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 115.17 1.545 . . . . 64.45 115.17 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 3.7 t -62.67 128.77 37.51 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 116.27 -2.172 . . . . 44.49 110.903 -176.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -68.29 -29.87 68.74 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 105.162 -2.162 . . . . 40.5 105.162 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -74.15 -37.42 64.03 Favored 'General case' 0 C--O 1.261 1.685 0 CA-C-O 122.342 1.068 . . . . 48.14 113.585 -171.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.4 -39.25 90.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.181 -0.918 . . . . 43.03 109.872 172.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -63.75 -44.75 92.56 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 124.019 0.824 . . . . 89.15 112.673 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.6 m -72.81 -36.0 51.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 119.122 -1.031 . . . . 45.99 111.723 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -57.52 -51.31 69.97 Favored 'General case' 0 CA--C 1.573 1.827 0 N-CA-C 112.847 0.684 . . . . 43.27 112.847 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 183' ' ' ALA . 27.8 mt -68.13 -19.49 64.83 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 114.7 1.37 . . . . 53.16 114.7 179.07 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.8 p -78.43 -28.06 46.66 Favored 'General case' 0 CA--C 1.501 -0.935 0 O-C-N 121.053 -1.029 . . . . 56.81 109.833 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -92.41 -30.08 15.95 Favored 'General case' 0 CA--C 1.559 1.327 0 N-CA-C 116.701 2.111 . . . . 65.84 116.701 170.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -136.24 148.55 64.84 Favored Pre-proline 0 CA--C 1.516 -0.354 0 O-C-N 122.155 -0.341 . . . . 51.45 110.288 -169.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -64.85 164.93 22.71 Favored 'Trans proline' 0 CA--C 1.504 -1.019 0 O-C-N 122.435 0.703 . . . . 53.38 111.517 169.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -46.75 133.92 10.25 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.432 0.634 . . . . 57.91 111.406 176.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 91.4 p -93.77 162.72 13.81 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 128.359 2.664 . . . . 71.21 113.122 -167.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -69.0 -39.98 79.02 Favored 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 125.478 1.511 . . . . 89.53 112.383 170.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLN . . . . . 0.411 ' HB3' ' CD ' ' A' ' 153' ' ' PRO . 36.0 mt-30 -117.35 166.99 11.79 Favored Pre-proline 0 CA--C 1.562 1.422 0 N-CA-C 112.685 0.624 . . . . 98.44 112.685 -178.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 152' ' ' GLN . 12.3 Cg_exo -61.04 143.1 99.06 Favored 'Trans proline' 0 C--N 1.361 1.233 0 O-C-N 122.536 0.756 . . . . 58.2 111.587 175.099 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ALA . . . . . 0.51 ' O ' ' NH2' ' A' ' 55' ' ' ARG . . . -102.23 -5.9 23.79 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 118.562 2.801 . . . . 46.8 118.562 -173.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 96.2 m -93.52 69.83 4.2 Favored 'General case' 0 C--O 1.199 -1.569 0 CA-C-O 123.66 1.695 . . . . 41.03 111.501 -164.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' TRP . . . . . . . . . . . . . 14.6 m0 -79.57 -40.02 30.41 Favored 'General case' 0 C--O 1.19 -2.027 0 O-C-N 120.853 -1.155 . . . . 53.62 112.124 -163.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 7.8 ttp -71.38 -43.76 66.25 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 124.71 1.204 . . . . 56.85 109.03 -179.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 46.3 mt -56.22 -46.12 79.66 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 120.758 -0.377 . . . . 39.11 110.229 172.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 12.7 tp -59.92 -41.58 92.07 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-O 120.885 0.374 . . . . 51.82 111.746 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -63.47 -48.23 80.19 Favored Glycine 0 C--O 1.209 -1.411 0 N-CA-C 109.801 -1.32 . . . . 40.12 109.801 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -50.71 -52.42 40.5 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 118.128 -0.939 . . . . 41.7 111.229 172.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -54.42 -48.06 72.09 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.822 0.737 . . . . 49.22 110.79 -177.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' CYS . . . . . . . . . . . . . 62.9 m -65.52 -42.79 91.62 Favored 'General case' 0 C--O 1.244 0.81 0 O-C-N 124.227 0.954 . . . . 71.56 112.903 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -68.56 -51.69 29.75 Favored Glycine 0 N--CA 1.476 1.34 0 CA-C-O 122.525 1.069 . . . . 45.18 112.961 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' TYR . . . . . 0.433 ' O ' HG13 ' A' ' 169' ' ' VAL . 87.0 t80 -55.55 -51.09 68.23 Favored 'General case' 0 N--CA 1.421 -1.876 0 O-C-N 121.642 -0.917 . . . . 50.68 110.613 172.067 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 57.8 m -73.93 -34.11 64.22 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 116.833 -1.947 . . . . 53.32 112.528 -172.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 1.7 m -75.62 -10.03 59.09 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 115.846 -2.342 . . . . 65.72 115.474 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -80.19 -48.24 13.44 Favored 'General case' 0 C--O 1.208 -1.085 0 O-C-N 118.659 -2.526 . . . . 63.38 110.305 171.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' VAL . . . . . 0.433 HG13 ' O ' ' A' ' 165' ' ' TYR . 2.7 m -71.11 -28.87 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 120.199 -0.601 . . . . 62.74 111.9 -173.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 170' ' ' MET . . . . . 0.667 ' HA ' ' NE2' ' A' ' 123' ' ' HIS . 6.3 mmt -96.21 -3.48 44.18 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 120.155 -1.591 . . . . 92.29 114.825 178.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . 62.87 18.46 59.72 Favored Glycine 0 C--O 1.216 -1.001 0 N-CA-C 118.223 2.049 . . . . 83.36 118.223 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -151.75 162.51 40.91 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.976 0.91 . . . . 83.99 110.682 175.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 2.1 m -76.46 112.19 12.72 Favored 'General case' 0 C--O 1.245 0.844 0 C-N-CA 115.31 -2.556 . . . . 72.29 113.516 -175.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 47.0 mm -98.79 121.37 49.29 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 O-C-N 129.005 3.941 . . . . 61.41 107.912 172.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ILE . . . . . . . . . . . . . 30.9 mm -108.17 138.5 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 N-CA-C 107.818 -1.179 . . . . 59.48 107.818 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -118.17 154.38 32.26 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.91 0.862 . . . . 49.34 112.538 173.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -134.89 140.37 45.73 Favored 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 105.15 -2.167 . . . . 95.24 105.15 171.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -84.32 104.77 14.63 Favored 'General case' 0 N--CA 1.434 -1.239 1 O-C-N 129.336 4.147 . . . . 55.47 109.651 -179.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 43.1 p -92.73 -31.24 15.15 Favored 'General case' 0 CA--C 1.497 -1.073 1 C-N-CA 110.078 -4.649 . . . . 65.3 112.988 -173.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HIS . . . . . 0.657 ' O ' ' HA ' ' A' ' 189' ' ' CYS . 2.2 m-70 -122.61 125.39 45.55 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 117.775 -1.107 . . . . 80.39 109.613 172.611 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 181' ' ' CYS . . . . . . . . . . . . . 8.6 t -129.19 130.28 46.13 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 125.315 1.634 . . . . 52.43 110.016 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 42.4 t -46.73 -39.4 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 124.802 1.314 . . . . 47.25 108.722 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' ALA . . . . . 0.54 ' HA ' HD21 ' A' ' 144' ' ' LEU . . . -70.9 -12.26 61.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.307 1.225 . . . . 56.05 114.307 -176.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -90.07 -5.78 56.2 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 118.666 -0.683 . . . . 74.33 110.625 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 103.23 -8.65 53.31 Favored Glycine 0 N--CA 1.441 -0.968 0 CA-C-O 119.346 -0.697 . . . . 68.97 113.856 -174.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -66.74 154.66 40.17 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 117.575 0.687 . . . . 65.05 110.274 176.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -57.35 -50.41 73.05 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 128.424 2.69 . . . . 113.21 111.909 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -142.56 -178.71 5.9 Favored 'General case' 0 C--O 1.261 1.663 0 N-CA-C 105.855 -1.905 . . . . 59.37 105.855 172.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' CYS . . . . . 0.657 ' HA ' ' O ' ' A' ' 180' ' ' HIS . 93.0 m -100.7 145.05 28.93 Favored 'General case' 1 N--CA 1.556 4.835 0 N-CA-C 105.838 -1.912 . . . . 53.77 105.838 -174.101 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 190' ' ' ARG . . . . . 0.591 ' N ' ' O ' ' A' ' 180' ' ' HIS . 2.9 tmm_? -138.63 142.81 39.08 Favored 'General case' 0 CA--C 1.479 -1.76 0 CA-C-N 114.02 -1.445 . . . . 73.89 110.99 -177.201 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 191' ' ' ILE . . . . . 0.475 ' N ' ' HD2' ' A' ' 190' ' ' ARG . 18.7 pt -134.45 143.1 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 122.526 0.33 . . . . 60.75 111.059 -176.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 2.1 mm -122.08 130.39 74.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 107.954 -1.128 . . . . 62.23 107.954 169.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -122.27 126.25 6.35 Favored Glycine 0 N--CA 1.478 1.471 0 O-C-N 125.385 1.678 . . . . 63.96 115.293 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 75.1 mttt -134.14 164.5 43.56 Favored Pre-proline 0 N--CA 1.468 0.464 0 N-CA-C 107.005 -1.48 . . . . 83.21 107.005 -178.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -66.4 152.63 80.51 Favored 'Trans proline' 0 C--O 1.198 -1.517 0 N-CA-C 107.347 -1.828 . . . . 71.05 107.347 174.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' LEU . . . . . . . . . . . . . 23.4 tp -53.55 -36.61 62.03 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 124.209 0.943 . . . . 85.2 110.957 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' SER . . . . . . . . . . . . . 4.7 m -51.46 -48.26 62.86 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 117.455 -1.259 . . . . 103.84 111.179 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -70.37 -4.07 20.54 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 115.409 1.633 . . . . 106.02 115.409 -174.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -92.51 -33.27 14.54 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 120.762 1.619 . . . . 119.81 108.864 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' GLU . . . . . . . . . . . . . . . 61.2 37.95 17.07 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 125.021 1.451 . . . . 155.73 110.04 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -149.53 76.93 1.33 Allowed 'General case' 0 N--CA 1.485 1.291 0 O-C-N 125.097 1.498 . . . . 143.77 107.532 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ALA . . . . . . . . . . . . . . . -74.61 72.93 1.97 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 107.675 -1.232 . . . . 155.31 107.675 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ASP . . . . . . . . . . . . . . . -118.56 2.84 11.79 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 125.311 1.632 . . . . 159.99 109.832 179.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -82.69 125.99 31.85 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 106.619 -1.622 . . . . 162.97 106.619 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' LEU . . . . . 0.722 HD13 ' O ' ' A' ' 205' ' ' LEU . 0.9 OUTLIER -82.35 77.89 9.08 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 124.644 1.215 . . . . 125.05 110.299 -177.22 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 206' ' ' ILE . . . . . . . . . . . . . . . -66.54 -37.37 79.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 123.661 0.6 . . . . 153.86 111.196 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ARG . . . . . . . . . . . . . . . -123.96 105.86 9.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 186.81 111.161 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' PHE . . . . . 0.605 ' HA ' HD11 ' A' ' 205' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 166.33 111.168 -179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 601' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 602' ' ' IPH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 701' ' ' HOH . . . . . 0.704 ' O ' ' O ' ' A' ' 54' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 702' ' ' HOH . . . . . 0.42 ' O ' ' HE1' ' A' ' 111' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 703' ' ' HOH . . . . . 0.915 ' O ' ' CB ' ' A' ' 54' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 704' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 705' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 706' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 708' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 709' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 710' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 711' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 712' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 713' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 714' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 715' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 716' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 717' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 718' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 719' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 720' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 721' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 722' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 723' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.454 0 CA-C-O 120.961 0.41 . . . . 130.27 110.629 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . . . -60.02 -48.99 79.43 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 107.904 -1.147 . . . . 129.52 107.904 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . . . -44.61 -69.34 0.14 Allowed 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 115.504 1.668 . . . . 119.48 115.504 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 -67.95 11.18 0.16 Allowed 'General case' 0 CA--C 1.551 0.997 0 N-CA-C 117.043 2.238 . . . . 107.58 117.043 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . . . -44.57 -53.93 6.61 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 113.06 0.763 . . . . 94.46 113.06 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -66.44 -15.22 63.16 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 118.201 2.667 . . . . 98.9 118.201 -176.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.3 pt -127.9 15.7 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 113.804 1.038 . . . . 66.2 113.804 -171.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.71 -48.78 79.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 96.4 110.764 179.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -49.58 -39.78 36.38 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.341 -0.39 . . . . 71.8 110.72 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.2 mt -68.66 -52.92 25.88 Favored 'General case' 0 C--O 1.207 -1.17 0 C-N-CA 125.439 1.496 . . . . 55.11 113.534 178.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 36.1 mt -61.73 -24.24 66.67 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 115.286 1.587 . . . . 58.26 115.286 178.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -74.44 -30.25 61.81 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 119.348 -0.358 . . . . 82.76 110.472 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.5 mmpt? -80.31 -1.48 41.17 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 114.824 -2.751 . . . . 81.14 114.464 172.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.1 mt -91.51 123.13 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 O-C-N 119.637 -1.914 . . . . 62.87 114.285 171.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 75.1 t -126.33 122.79 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 112.848 0.685 . . . . 64.0 112.848 177.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -90.68 127.13 36.2 Favored 'General case' 0 C--O 1.197 -1.696 0 O-C-N 124.699 1.249 . . . . 60.04 112.201 171.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.1 t0 -133.89 67.59 1.51 Allowed 'General case' 0 C--O 1.209 -1.04 0 N-CA-C 106.329 -1.73 . . . . 68.51 106.329 -175.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.44 -32.07 68.36 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 114.468 1.284 . . . . 55.68 114.468 179.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . . . -64.04 -38.18 90.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.442 -0.344 . . . . 68.8 111.07 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -103.72 7.1 37.27 Favored 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 115.003 1.483 . . . . 73.78 115.003 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 71.99 32.89 62.98 Favored Glycine 0 C--O 1.216 -1.028 0 O-C-N 121.629 -0.669 . . . . 54.07 113.671 172.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.414 HE21 ' HE1' ' A' ' 37' ' ' TRP . 10.1 mt-30 -132.75 140.3 47.98 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 115.584 1.698 . . . . 65.1 115.584 -172.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 46.8 mt -128.95 133.48 66.03 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.976 0 O-C-N 121.26 -0.9 . . . . 49.12 108.789 165.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.414 ' HE1' HE21 ' A' ' 35' ' ' GLN . 88.4 m95 -117.61 137.95 52.28 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.614 1.339 . . . . 68.87 114.614 178.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -111.09 97.99 7.2 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.501 -0.555 . . . . 51.18 109.501 159.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.9 t70 60.07 -126.54 1.1 Allowed 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 105.509 -2.034 . . . . 81.94 105.509 -170.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -95.61 9.83 38.85 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 119.648 1.113 . . . . 123.3 110.38 -178.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -93.2 126.58 38.38 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-O 118.605 -0.712 . . . . 71.53 109.603 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.6 ttt180 -79.78 131.05 35.81 Favored 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 113.823 1.045 . . . . 53.77 113.823 173.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.7 mmt -119.31 160.83 21.49 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 113.891 1.071 . . . . 47.5 113.891 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -127.47 144.16 51.1 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.674 -1.232 . . . . 54.81 107.674 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 14.5 tp -93.01 110.6 22.07 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 123.832 0.707 . . . . 48.21 111.23 166.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 12.5 mtp -117.68 158.46 24.65 Favored 'General case' 0 C--O 1.217 -0.613 0 N-CA-C 113.224 0.824 . . . . 72.44 113.224 -173.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -79.69 128.43 33.4 Favored 'General case' 0 C--O 1.191 -2.01 0 O-C-N 124.465 1.103 . . . . 62.47 111.497 176.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.6 p -53.79 -38.27 64.33 Favored 'General case' 0 C--O 1.207 -1.143 0 O-C-N 120.904 -1.122 . . . . 68.43 110.113 176.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.73 -30.35 63.44 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-O 117.126 -1.416 . . . . 76.72 111.149 -177.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.18 -38.0 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 CA-C-O 117.637 -1.173 . . . . 74.58 110.615 178.541 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 mp -66.74 -28.92 68.8 Favored 'General case' 0 N--CA 1.491 1.605 0 CA-C-O 117.896 -1.05 . . . . 67.55 111.334 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.96 -49.0 83.33 Favored Glycine 0 N--CA 1.471 1.023 0 CA-C-O 117.594 -1.67 . . . . 60.44 109.863 175.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -52.11 -52.69 49.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 117.987 0.894 . . . . 102.81 111.161 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.915 ' CB ' ' O ' ' A' ' 703' ' ' HOH . 13.4 tp -54.93 -49.39 71.43 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.73 -0.47 . . . . 69.99 109.73 179.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.51 ' NH2' ' O ' ' A' ' 154' ' ' ALA . 9.9 ttt180 -57.4 -47.36 81.92 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-O 118.179 -0.915 . . . . 57.04 110.48 179.349 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . . . -66.97 -51.22 57.83 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-O 118.268 -0.873 . . . . 59.32 108.933 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.488 ' O ' ' HG3' ' A' ' 61' ' ' MET . 11.3 m-20 -57.02 -44.41 82.81 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 121.212 1.824 . . . . 84.92 112.672 178.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.045 HD13 HD13 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -59.89 -49.68 76.74 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.785 -0.45 . . . . 72.65 109.785 178.603 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -52.84 -45.69 67.47 Favored 'General case' 0 N--CA 1.486 1.333 0 CA-C-O 121.436 0.636 . . . . 57.4 112.138 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -69.34 -43.34 73.85 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.596 -0.729 . . . . 75.61 112.262 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' MET . . . . . 0.488 ' HG3' ' O ' ' A' ' 57' ' ' ASP . 17.8 mtt -71.84 -42.91 66.37 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-O 119.387 -0.34 . . . . 102.23 111.216 179.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.045 HD13 HD13 ' A' ' 58' ' ' LEU . 2.7 mp -124.89 6.03 8.04 Favored 'General case' 0 C--O 1.25 1.099 0 C-N-CA 114.215 -2.994 . . . . 88.29 117.825 -173.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 78.27 -174.48 55.0 Favored Glycine 0 N--CA 1.451 -0.34 0 O-C-N 121.274 -0.891 . . . . 70.48 112.155 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 24.2 tp -77.3 -49.41 15.07 Favored 'General case' 0 C--O 1.194 -1.851 0 N-CA-C 115.148 1.536 . . . . 64.03 115.148 -167.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -78.02 -24.39 47.87 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 114.566 -2.854 . . . . 92.64 111.621 -171.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.625 ' HD3' ' HB3' ' A' ' 62' ' ' LEU . 14.8 mtp180 -65.2 -49.04 71.3 Favored 'General case' 0 C--O 1.213 -0.834 0 O-C-N 117.326 -3.359 . . . . 114.47 109.437 169.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 58' ' ' LEU . 16.2 m -57.49 -42.7 83.21 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 114.381 1.252 . . . . 56.86 114.381 176.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -60.79 -57.93 10.61 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 108.616 -0.883 . . . . 76.0 108.616 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 7.6 mtp180 -55.12 -35.96 65.21 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 114.596 1.332 . . . . 116.85 114.596 176.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -57.31 -49.79 74.98 Favored 'General case' 0 CA--C 1.505 -0.76 0 O-C-N 116.993 -3.567 . . . . 56.05 111.785 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -67.66 -34.69 77.44 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 124.217 0.948 . . . . 50.98 112.081 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.23 -48.57 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 N-CA-C 108.989 -0.745 . . . . 51.61 108.989 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.606 ' O ' ' HG2' ' A' ' 77' ' ' GLN . 44.3 mtm105 -57.42 -44.5 84.69 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 114.064 1.135 . . . . 91.59 114.064 173.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 87.1 m -58.07 -45.83 86.46 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 117.678 -1.609 . . . . 58.6 108.538 177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.73 -39.7 85.86 Favored Glycine 0 C--O 1.205 -1.678 0 N-CA-C 109.884 -1.286 . . . . 41.49 109.884 -172.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -58.86 -44.51 91.06 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 122.779 0.431 . . . . 62.65 111.344 176.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . 0.606 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 1.5 mm100 -66.54 -38.76 87.83 Favored 'General case' 0 C--O 1.204 -1.298 0 O-C-N 124.195 0.934 . . . . 84.77 111.34 176.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.85 -41.81 97.72 Favored 'General case' 0 N--CA 1.438 -1.033 0 O-C-N 119.857 -1.777 . . . . 44.7 112.024 177.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -58.67 -41.3 95.67 Favored Glycine 0 C--O 1.251 1.182 0 N-CA-C 111.274 -0.73 . . . . 47.2 111.274 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' MET . . . . . 0.732 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 5.2 mtt -65.29 -43.15 92.07 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 118.549 -0.739 . . . . 72.08 111.174 177.044 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.5 ' HA ' ' CD ' ' A' ' 84' ' ' GLU . . . -62.83 -42.76 99.86 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 117.974 -1.013 . . . . 57.19 108.564 179.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -65.4 -41.49 93.61 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 117.475 -1.25 . . . . 51.35 110.451 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.33 -38.83 92.67 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 124.933 1.396 . . . . 51.33 110.255 -178.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.732 ' HG3' ' O ' ' A' ' 80' ' ' MET . 19.7 mt-10 -59.84 -45.61 91.87 Favored 'General case' 0 C--O 1.207 -1.168 0 N-CA-C 108.396 -0.965 . . . . 108.93 108.396 -179.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.0 t -68.17 -41.8 84.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 CA-C-O 117.475 -1.25 . . . . 58.81 111.417 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 43.5 p -79.82 -23.93 41.7 Favored 'General case' 0 C--O 1.211 -0.953 0 O-C-N 123.854 0.721 . . . . 61.92 112.632 -171.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 80.3 p -76.39 -26.41 55.58 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 118.981 -1.087 . . . . 83.93 110.506 -179.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -77.0 -39.03 51.89 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 119.221 -0.991 . . . . 97.82 111.386 173.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.8 tp -64.92 -41.76 95.27 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 118.729 -0.653 . . . . 92.22 110.72 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 20.5 mtt180 -108.64 119.53 48.98 Favored Pre-proline 0 N--CA 1.483 1.179 0 N-CA-C 107.992 -1.114 . . . . 118.56 107.992 -178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -101.46 40.92 0.05 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 124.35 3.367 . . . . 158.34 109.615 -174.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 54.43 41.85 31.73 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 117.021 -1.466 . . . . 182.27 111.711 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . . . -59.59 -46.28 89.41 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 104.905 -2.257 . . . . 162.78 104.905 175.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.515 ' ND2' ' HB2' ' A' ' 97' ' ' GLU . 17.7 t30 -126.82 110.48 13.12 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.609 -1.626 . . . . 156.43 106.609 177.215 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -41.45 -44.11 2.79 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 116.028 1.862 . . . . 138.37 116.028 -178.281 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.57 ' HA ' HD21 ' A' ' 121' ' ' LEU . . . -80.11 -44.58 19.71 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 118.397 -0.811 . . . . 99.03 111.11 -179.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.515 ' HB2' ' ND2' ' A' ' 94' ' ' ASN 0.382 2.9 mm-40 -67.0 -32.42 73.64 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 117.477 -1.249 . . . . 103.27 110.439 -178.839 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -62.95 -43.66 98.17 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 118.762 -1.175 . . . . 68.11 109.47 177.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -62.29 -32.23 72.94 Favored 'General case' 0 C--O 1.195 -1.785 0 O-C-N 124.357 1.035 . . . . 58.49 112.152 -177.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' MET . . . . . 0.579 ' CE ' HD22 ' A' ' 119' ' ' LEU . 9.4 mmt -69.75 -5.38 24.84 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 116.184 1.92 . . . . 64.66 116.184 -174.237 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -58.46 -39.01 78.72 Favored 'General case' 0 C--O 1.244 0.789 0 O-C-N 124.027 0.829 . . . . 47.11 112.525 175.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.19 -60.64 8.59 Favored Glycine 0 C--O 1.211 -1.312 0 N-CA-C 109.688 -1.365 . . . . 43.92 109.688 176.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -54.63 -40.76 82.66 Favored 'Trans proline' 0 C--O 1.177 -2.537 0 C-N-CA 123.01 2.473 . . . . 51.2 112.413 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -62.84 -40.42 97.38 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-O 117.925 -1.036 . . . . 51.94 108.959 178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . 0.424 ' O ' ' HG3' ' A' ' 109' ' ' ARG . 67.3 mmm -65.77 -35.54 81.0 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-O 118.334 -0.841 . . . . 48.04 109.096 -179.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.831 ' HD2' ' O1 ' ' A' ' 602' ' ' IPH . 0.0 OUTLIER -57.45 -36.02 70.88 Favored 'General case' 0 N--CA 1.525 3.312 0 CA-C-O 128.235 3.874 . . . . 46.89 113.387 177.157 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -78.5 -40.71 18.06 Favored Glycine 0 C--O 1.214 -1.118 0 O-C-N 118.14 -2.85 . . . . 38.81 112.131 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 34.1 mt -64.58 -32.87 59.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 CA-C-O 117.887 -1.054 . . . . 41.89 109.998 -178.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 105' ' ' MET . 0.6 OUTLIER -84.26 -2.32 56.76 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 117.777 -1.106 . . . . 60.43 112.012 -179.032 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 81.03 23.06 59.97 Favored Glycine 0 C--O 1.199 -2.038 0 O-C-N 124.519 1.137 . . . . 39.39 110.796 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' MET . . . . . 0.42 ' HE1' ' O ' ' A' ' 702' ' ' HOH . 3.1 mtt -91.13 -52.69 4.71 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 115.396 1.628 . . . . 59.59 115.396 -176.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 13.7 p -158.97 158.74 2.56 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.036 0 CA-C-O 121.165 0.507 . . . . 41.19 111.158 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 38.0 tt0 -105.78 122.56 46.34 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 108.932 -0.766 . . . . 54.38 108.932 175.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 88.4 t -92.81 128.47 44.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 124.077 0.861 . . . . 53.83 108.931 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -114.96 125.96 54.22 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 106.702 -1.592 . . . . 105.33 106.702 169.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.453 ' O ' HG13 ' A' ' 116' ' ' VAL . 2.7 p -99.39 117.1 44.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 1 C-N-CA 110.705 -4.398 . . . . 85.7 110.473 -179.725 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -68.35 -52.83 28.95 Favored 'General case' 0 N--CA 1.475 0.812 2 O-C-N 130.329 4.768 . . . . 82.89 110.285 168.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -147.16 129.71 15.93 Favored 'General case' 0 C--N 1.349 0.549 0 C-N-CA 125.52 1.528 . . . . 113.82 112.654 -176.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.579 HD22 ' CE ' ' A' ' 100' ' ' MET . 59.6 tp -140.53 118.14 11.59 Favored 'General case' 0 C--O 1.246 0.901 0 C-N-CA 124.054 0.942 . . . . 79.54 109.449 174.414 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -134.88 140.12 45.54 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 115.509 -2.476 . . . . 115.67 107.117 161.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 96' ' ' ALA . 1.4 pt? -149.89 155.14 39.5 Favored 'General case' 0 CA--C 1.527 0.095 1 O-C-N 129.733 4.396 . . . . 92.27 113.273 -179.061 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.4 t -158.41 119.85 3.49 Favored 'General case' 0 N--CA 1.416 -2.131 0 N-CA-C 102.164 -3.273 . . . . 94.94 102.164 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.863 ' CE1' ' HA ' ' A' ' 170' ' ' MET . 7.3 t60 -74.08 -28.26 61.3 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.277 0.473 . . . . 98.42 112.277 -179.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -75.68 -46.26 32.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.392 -0.367 . . . . 111.9 111.916 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 29.4 mt -82.88 1.54 38.9 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-O 116.948 -1.501 . . . . 98.37 112.385 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . . . 53.67 51.42 15.07 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 107.219 -1.4 . . . . 83.37 107.219 178.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . . . -121.79 135.12 54.92 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 125.07 1.481 . . . . 84.15 108.704 -177.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -154.6 127.44 8.16 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 118.741 -1.183 . . . . 69.06 110.652 -178.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -142.66 126.31 16.93 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 106.864 -1.532 . . . . 73.01 106.864 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -128.71 135.09 48.76 Favored 'General case' 0 C--O 1.202 -1.426 0 N-CA-C 107.099 -1.445 . . . . 64.87 107.099 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -136.17 104.36 5.63 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 103.164 -2.902 . . . . 84.52 103.164 172.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.06 143.37 51.14 Favored 'General case' 0 CA--C 1.5 -0.968 0 O-C-N 124.543 1.152 . . . . 61.31 109.803 -175.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 31.5 m-20 -85.45 149.65 25.26 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.089 -1.414 . . . . 65.37 110.973 161.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' TRP . . . . . 0.468 ' CE2' HD13 ' A' ' 191' ' ' ILE . 3.0 m0 -120.8 113.78 20.66 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 104.334 -2.469 . . . . 50.13 104.334 178.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 27.9 mt -109.79 148.38 31.57 Favored 'General case' 0 C--O 1.205 -1.281 0 N-CA-C 108.974 -0.75 . . . . 54.96 108.974 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 57.17 38.22 28.81 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 115.17 1.545 . . . . 64.45 115.17 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 3.7 t -62.67 128.77 37.51 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 116.27 -2.172 . . . . 44.49 110.903 -176.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -68.29 -29.87 68.74 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 105.162 -2.162 . . . . 40.5 105.162 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -74.15 -37.42 64.03 Favored 'General case' 0 C--O 1.261 1.685 0 CA-C-O 122.342 1.068 . . . . 48.14 113.585 -171.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.4 -39.25 90.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.181 -0.918 . . . . 43.03 109.872 172.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -63.75 -44.75 92.56 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 124.019 0.824 . . . . 89.15 112.673 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.6 m -72.81 -36.0 51.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 C-N-CA 119.122 -1.031 . . . . 45.99 111.723 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -57.52 -51.31 69.97 Favored 'General case' 0 CA--C 1.573 1.827 0 N-CA-C 112.847 0.684 . . . . 43.27 112.847 175.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 183' ' ' ALA . 27.8 mt -68.13 -19.49 64.83 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 114.7 1.37 . . . . 53.16 114.7 179.07 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 27.8 p -78.43 -28.06 46.66 Favored 'General case' 0 CA--C 1.501 -0.935 0 O-C-N 121.053 -1.029 . . . . 56.81 109.833 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -92.41 -30.08 15.95 Favored 'General case' 0 CA--C 1.559 1.327 0 N-CA-C 116.701 2.111 . . . . 65.84 116.701 170.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -136.24 148.55 64.84 Favored Pre-proline 0 CA--C 1.516 -0.354 0 O-C-N 122.155 -0.341 . . . . 51.45 110.288 -169.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -64.85 164.93 22.71 Favored 'Trans proline' 0 CA--C 1.504 -1.019 0 O-C-N 122.435 0.703 . . . . 53.38 111.517 169.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -46.75 133.92 10.25 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 121.432 0.634 . . . . 57.91 111.406 176.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' SER . . . . . . . . . . . . . 91.4 p -93.77 162.72 13.81 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 128.359 2.664 . . . . 71.21 113.122 -167.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -69.0 -39.98 79.02 Favored 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 125.478 1.511 . . . . 89.53 112.383 170.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.411 ' HB3' ' CD ' ' A' ' 153' ' ' PRO . 36.0 mt-30 -117.35 166.99 11.79 Favored Pre-proline 0 CA--C 1.562 1.422 0 N-CA-C 112.685 0.624 . . . . 98.44 112.685 -178.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 152' ' ' GLN . 12.3 Cg_exo -61.04 143.1 99.06 Favored 'Trans proline' 0 C--N 1.361 1.233 0 O-C-N 122.536 0.756 . . . . 58.2 111.587 175.099 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ALA . . . . . 0.51 ' O ' ' NH2' ' A' ' 55' ' ' ARG . . . -102.23 -5.9 23.79 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 118.562 2.801 . . . . 46.8 118.562 -173.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 96.2 m -93.52 69.83 4.2 Favored 'General case' 0 C--O 1.199 -1.569 0 CA-C-O 123.66 1.695 . . . . 41.03 111.501 -164.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' TRP . . . . . . . . . . . . . 14.6 m0 -79.57 -40.02 30.41 Favored 'General case' 0 C--O 1.19 -2.027 0 O-C-N 120.853 -1.155 . . . . 53.62 112.124 -163.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' MET . . . . . . . . . . . . . 7.8 ttp -71.38 -43.76 66.25 Favored 'General case' 0 N--CA 1.442 -0.862 0 C-N-CA 124.71 1.204 . . . . 56.85 109.03 -179.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 46.3 mt -56.22 -46.12 79.66 Favored 'General case' 0 C--O 1.206 -1.228 0 C-N-CA 120.758 -0.377 . . . . 39.11 110.229 172.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 12.7 tp -59.92 -41.58 92.07 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-O 120.885 0.374 . . . . 51.82 111.746 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' GLY . . . . . . . . . . . . . . . -63.47 -48.23 80.19 Favored Glycine 0 C--O 1.209 -1.411 0 N-CA-C 109.801 -1.32 . . . . 40.12 109.801 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -50.71 -52.42 40.5 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 118.128 -0.939 . . . . 41.7 111.229 172.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -54.42 -48.06 72.09 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.822 0.737 . . . . 49.22 110.79 -177.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' CYS . . . . . . . . . . . . . 62.9 m -65.52 -42.79 91.62 Favored 'General case' 0 C--O 1.244 0.81 0 O-C-N 124.227 0.954 . . . . 71.56 112.903 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -68.56 -51.69 29.75 Favored Glycine 0 N--CA 1.476 1.34 0 CA-C-O 122.525 1.069 . . . . 45.18 112.961 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' TYR . . . . . 0.433 ' O ' HG13 ' A' ' 169' ' ' VAL . 87.0 t80 -55.55 -51.09 68.23 Favored 'General case' 0 N--CA 1.421 -1.876 0 O-C-N 121.642 -0.917 . . . . 50.68 110.613 172.067 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 57.8 m -73.93 -34.11 64.22 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 116.833 -1.947 . . . . 53.32 112.528 -172.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 1.7 m -75.62 -10.03 59.09 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 115.846 -2.342 . . . . 65.72 115.474 173.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -80.19 -48.24 13.44 Favored 'General case' 0 C--O 1.208 -1.085 0 O-C-N 118.659 -2.526 . . . . 63.38 110.305 171.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' VAL . . . . . 0.433 HG13 ' O ' ' A' ' 165' ' ' TYR . 2.7 m -71.11 -28.87 34.33 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.135 0 C-N-CA 120.199 -0.601 . . . . 62.74 111.9 -173.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' MET . . . . . 0.863 ' HA ' ' CE1' ' A' ' 123' ' ' HIS . 6.3 mmt -96.21 -3.48 44.18 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 120.155 -1.591 . . . . 92.29 114.825 178.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' GLY . . . . . . . . . . . . . . . 62.87 18.46 59.72 Favored Glycine 0 C--O 1.216 -1.001 0 N-CA-C 118.223 2.049 . . . . 83.36 118.223 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -151.75 162.51 40.91 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.976 0.91 . . . . 83.99 110.682 175.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' THR . . . . . . . . . . . . . 2.1 m -76.46 112.19 12.72 Favored 'General case' 0 C--O 1.245 0.844 0 C-N-CA 115.31 -2.556 . . . . 72.29 113.516 -175.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' ILE . . . . . . . . . . . . . 47.0 mm -98.79 121.37 49.29 Favored 'Isoleucine or valine' 0 C--O 1.242 0.691 0 O-C-N 129.005 3.941 . . . . 61.41 107.912 172.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ILE . . . . . . . . . . . . . 30.9 mm -108.17 138.5 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 N-CA-C 107.818 -1.179 . . . . 59.48 107.818 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -118.17 154.38 32.26 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.91 0.862 . . . . 49.34 112.538 173.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -134.89 140.37 45.73 Favored 'General case' 0 CA--C 1.496 -1.112 0 N-CA-C 105.15 -2.167 . . . . 95.24 105.15 171.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 46.7 tt0 -84.32 104.77 14.63 Favored 'General case' 0 N--CA 1.434 -1.239 1 O-C-N 129.336 4.147 . . . . 55.47 109.651 -179.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 43.1 p -92.73 -31.24 15.15 Favored 'General case' 0 CA--C 1.497 -1.073 1 C-N-CA 110.078 -4.649 . . . . 65.3 112.988 -173.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HIS . . . . . 0.657 ' O ' ' HA ' ' A' ' 189' ' ' CYS . 2.2 m-70 -122.61 125.39 45.55 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 117.775 -1.107 . . . . 80.39 109.613 172.611 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' CYS . . . . . . . . . . . . . 8.6 t -129.19 130.28 46.13 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 125.315 1.634 . . . . 52.43 110.016 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 42.4 t -46.73 -39.4 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 124.802 1.314 . . . . 47.25 108.722 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' ALA . . . . . 0.54 ' HA ' HD21 ' A' ' 144' ' ' LEU . . . -70.9 -12.26 61.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 114.307 1.225 . . . . 56.05 114.307 -176.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -90.07 -5.78 56.2 Favored 'General case' 0 C--O 1.204 -1.311 0 CA-C-O 118.666 -0.683 . . . . 74.33 110.625 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' GLY . . . . . . . . . . . . . . . 103.23 -8.65 53.31 Favored Glycine 0 N--CA 1.441 -0.968 0 CA-C-O 119.346 -0.697 . . . . 68.97 113.856 -174.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -66.74 154.66 40.17 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 117.575 0.687 . . . . 65.05 110.274 176.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -57.35 -50.41 73.05 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 128.424 2.69 . . . . 113.21 111.909 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -142.56 -178.71 5.9 Favored 'General case' 0 C--O 1.261 1.663 0 N-CA-C 105.855 -1.905 . . . . 59.37 105.855 172.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' CYS . . . . . 0.657 ' HA ' ' O ' ' A' ' 180' ' ' HIS . 93.0 m -100.7 145.05 28.93 Favored 'General case' 1 N--CA 1.556 4.835 0 N-CA-C 105.838 -1.912 . . . . 53.77 105.838 -174.101 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.591 ' N ' ' O ' ' A' ' 180' ' ' HIS . 2.9 tmm_? -138.63 142.81 39.08 Favored 'General case' 0 CA--C 1.479 -1.76 0 CA-C-N 114.02 -1.445 . . . . 73.89 110.99 -177.201 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' ILE . . . . . 0.475 ' N ' ' HD2' ' A' ' 190' ' ' ARG . 18.7 pt -134.45 143.1 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 122.526 0.33 . . . . 60.75 111.059 -176.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' ILE . . . . . . . . . . . . . 2.1 mm -122.08 130.39 74.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 107.954 -1.128 . . . . 62.23 107.954 169.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' GLY . . . . . . . . . . . . . . . -122.27 126.25 6.35 Favored Glycine 0 N--CA 1.478 1.471 0 O-C-N 125.385 1.678 . . . . 63.96 115.293 177.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 75.1 mttt -134.14 164.5 43.56 Favored Pre-proline 0 N--CA 1.468 0.464 0 N-CA-C 107.005 -1.48 . . . . 83.21 107.005 -178.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -66.4 152.63 80.51 Favored 'Trans proline' 0 C--O 1.198 -1.517 0 N-CA-C 107.347 -1.828 . . . . 71.05 107.347 174.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' LEU . . . . . . . . . . . . . 23.4 tp -53.55 -36.61 62.03 Favored 'General case' 0 N--CA 1.484 1.241 0 O-C-N 124.209 0.943 . . . . 85.2 110.957 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' SER . . . . . . . . . . . . . 4.7 m -51.46 -48.26 62.86 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 117.455 -1.259 . . . . 103.84 111.179 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -70.37 -4.07 20.54 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 115.409 1.633 . . . . 106.02 115.409 -174.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -92.51 -33.27 14.54 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 120.762 1.619 . . . . 119.81 108.864 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' GLU . . . . . . . . . . . . . . . 61.2 37.95 17.07 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 125.021 1.451 . . . . 155.73 110.04 179.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -149.53 76.93 1.33 Allowed 'General case' 0 N--CA 1.485 1.291 0 O-C-N 125.097 1.498 . . . . 143.77 107.532 178.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ALA . . . . . . . . . . . . . . . -74.61 72.93 1.97 Allowed 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 107.675 -1.232 . . . . 155.31 107.675 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ASP . . . . . . . . . . . . . . . -118.56 2.84 11.79 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 125.311 1.632 . . . . 159.99 109.832 179.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -82.69 125.99 31.85 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 106.619 -1.622 . . . . 162.97 106.619 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' LEU . . . . . 0.722 HD13 ' O ' ' A' ' 205' ' ' LEU . 0.9 OUTLIER -82.35 77.89 9.08 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 124.644 1.215 . . . . 125.05 110.299 -177.22 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' ILE . . . . . . . . . . . . . . . -66.54 -37.37 79.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 O-C-N 123.661 0.6 . . . . 153.86 111.196 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ARG . . . . . . . . . . . . . . . -123.96 105.86 9.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 186.81 111.161 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' PHE . . . . . 0.605 ' HA ' HD11 ' A' ' 205' ' ' LEU . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.167 -0.469 . . . . 166.33 111.168 -179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' IPH . . . . . 0.831 ' O1 ' ' HD2' ' A' ' 106' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 701' ' ' HOH . . . . . 0.704 ' O ' ' O ' ' A' ' 54' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 702' ' ' HOH . . . . . 0.42 ' O ' ' HE1' ' A' ' 111' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 703' ' ' HOH . . . . . 0.915 ' O ' ' CB ' ' A' ' 54' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 704' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 705' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 706' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 708' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 709' ' ' HOH . . . . . 0.447 ' O ' ' HE1' ' A' ' 106' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 710' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 711' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 712' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 713' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 714' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 715' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 716' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 717' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 718' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 719' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 720' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 721' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 722' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 723' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_