data_3lbk_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3lbk _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 120.579 0.228 . . . . 56.009999999999998 110.772 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.8 mt -135.62 152.45 51.25 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 114.146 1.165 . . . . 53.079999999999998 114.146 -172.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.0 m -142.15 157.05 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 121.671 0.748 . . . . 49.380000000000003 110.361 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . 0.468 ' CZ ' ' CB ' ' A' ' 29' ' ' ARG . 0.3 OUTLIER -117.25 113.39 39.12 Favored Pre-proline 0 C--O 1.243 0.763 0 N-CA-C 106.546 -1.65 . . . . 63.140000000000001 106.546 170.627 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -60.22 141.17 95.35 Favored 'Trans proline' 0 CA--C 1.491 -1.654 0 C-N-CA 117.755 -1.03 . . . . 46.950000000000003 110.569 176.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -67.68 154.77 92.8 Favored Pre-proline 0 N--CA 1.437 -1.083 0 C-N-CA 120.035 -0.666 . . . . 47.670000000000002 110.851 168.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.01 -37.74 37.95 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 N-CA-C 114.818 1.046 . . . . 46.140000000000001 114.818 -160.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.29 -41.24 70.23 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 113.591 0.96 . . . . 59.130000000000003 113.591 -172.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 tp -67.21 -39.6 86.32 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 118.744 -0.646 . . . . 48.719999999999999 110.768 170.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.2 tp -56.28 -42.07 76.89 Favored 'General case' 0 C--O 1.263 1.778 0 CA-C-N 119.199 0.909 . . . . 51.829999999999998 111.743 175.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -62.6 -46.6 87.52 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.148 -0.621 . . . . 56.490000000000002 109.752 176.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . 0.484 ' CD1' ' CD1' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -60.07 -43.45 95.45 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.507 -0.477 . . . . 48.390000000000001 111.906 175.736 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 16.6 mt -63.42 -38.01 89.47 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 118.749 0.704 . . . . 49.210000000000001 112.216 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -69.41 -32.08 70.85 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-O 118.13 -0.938 . . . . 56.340000000000003 111.936 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.7 p -62.64 -24.75 67.77 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.772 0.714 . . . . 53.159999999999997 111.407 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 2.0 m -94.99 21.87 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 N-CA-C 112.739 0.644 . . . . 56.420000000000002 112.739 170.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.88 36.48 52.46 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 116.639 1.416 . . . . 58.880000000000003 116.639 173.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.34 139.74 37.7 Favored 'General case' 0 C--O 1.247 0.939 0 N-CA-C 106.658 -1.608 . . . . 59.909999999999997 106.658 168.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . . . -103.06 -16.71 15.7 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 114.196 1.184 . . . . 60.899999999999999 114.196 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -92.55 -174.8 3.78 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.859 0.688 . . . . 61.530000000000001 112.859 -174.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . 0.517 ' O ' ' CG2' ' A' ' 47' ' ' THR . 0.9 OUTLIER -132.14 8.71 4.4 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.779 1.232 . . . . 59.789999999999999 110.689 166.709 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . 0.517 ' CG2' ' O ' ' A' ' 46' ' ' ASP . 8.1 p -153.55 123.12 6.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.393 -0.817 . . . . 54.960000000000001 110.885 170.526 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -124.0 164.85 18.5 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.335 -1.302 . . . . 53.939999999999998 108.666 -163.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . 0.454 ' OG1' ' OE1' ' A' ' 52' ' ' GLU . 1.4 p -76.13 158.74 31.43 Favored 'General case' 0 N--CA 1.418 -2.06 0 N-CA-C 107.649 -1.241 . . . . 46.079999999999998 107.649 154.8 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' MET . . . . . 0.477 ' O ' ' N ' ' A' ' 54' ' ' LEU . 41.9 mmm -55.32 -48.41 74.2 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.36 0.6 . . . . 51.350000000000001 110.884 172.861 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.94 -53.71 4.58 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 113.829 -1.532 . . . . 51.479999999999997 108.815 177.47 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . 0.454 ' OE1' ' OG1' ' A' ' 49' ' ' THR . 19.0 mt-10 -63.59 -33.94 76.72 Favored 'General case' 0 C--O 1.203 -1.385 0 N-CA-C 112.82 0.674 . . . . 51.210000000000001 112.82 176.542 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.4 t -67.11 -54.03 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 N-CA-C 107.923 -1.14 . . . . 40.810000000000002 107.923 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . 0.477 ' N ' ' O ' ' A' ' 50' ' ' MET . 16.5 mt -58.3 -41.43 84.41 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.524 -0.307 . . . . 37.759999999999998 110.947 -178.553 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -56.99 -55.12 38.83 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 115.327 1.603 . . . . 37.960000000000001 115.327 175.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -63.76 -28.51 69.93 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.664 -1.272 . . . . 48.259999999999998 113.765 176.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.32 -59.81 4.71 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 120.168 -0.613 . . . . 36.600000000000001 111.278 175.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -52.12 -37.88 47.03 Favored Glycine 0 C--O 1.201 -1.932 0 O-C-N 123.323 0.389 . . . . 41.359999999999999 112.421 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -64.36 -41.91 96.49 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 122.203 -0.586 . . . . 44.420000000000002 110.769 176.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TYR . . . . . 0.484 ' CD1' ' CD1' ' A' ' 37' ' ' LEU . 79.6 t80 -60.58 -50.15 74.68 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 115.609 -0.723 . . . . 48.43 109.492 175.556 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 84.1 mt -54.71 -44.75 71.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 123.431 0.692 . . . . 48.369999999999997 110.317 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 66.2 mmm -65.79 -49.29 68.84 Favored 'General case' 0 CA--C 1.493 -1.24 0 CA-C-N 116.102 -0.499 . . . . 60.789999999999999 111.59 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 71.6 p -77.64 -15.92 58.88 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 114.725 1.379 . . . . 53.189999999999998 114.725 -174.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -96.4 -0.99 48.51 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 118.028 0.377 . . . . 58.210000000000001 111.959 172.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.76 50.97 4.06 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.706 0.403 . . . . 77.530000000000001 112.084 -179.674 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . 0.549 ' O ' ' N ' ' A' ' 76' ' ' TYR . 84.2 mt -93.62 -8.33 41.38 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.857 0.688 . . . . 57.93 112.857 -176.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -89.86 156.81 18.22 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.217 -0.593 . . . . 67.140000000000001 109.984 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -98.64 122.1 41.42 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 118.431 -1.307 . . . . 66.840000000000003 108.347 171.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 pm0 -62.45 -25.34 67.93 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 123.873 0.733 . . . . 73.640000000000001 112.52 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -99.11 -5.3 30.42 Favored 'General case' 0 CA--C 1.56 1.361 0 N-CA-C 117.013 2.227 . . . . 71.280000000000001 117.013 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -106.03 -29.36 9.97 Favored 'General case' 0 C--O 1.254 1.299 0 C-N-CA 124.165 0.986 . . . . 71.430000000000007 109.229 169.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . 0.271 . . 78.63 -26.09 0.18 Allowed 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 115.386 1.624 . . . . 65.099999999999994 115.386 161.319 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -141.96 38.51 1.62 Allowed 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 114.432 1.271 . . . . 62.189999999999998 114.432 160.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 39.9 mm -110.27 125.41 67.51 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.664 0 N-CA-C 106.693 -1.595 . . . . 50.030000000000001 106.693 168.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.8 t -98.51 118.9 45.78 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.208 0 N-CA-C 102.92 -2.993 . . . . 41.859999999999999 102.92 -176.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' TYR . . . . . 0.549 ' N ' ' O ' ' A' ' 66' ' ' LEU . 65.5 m-85 -95.32 99.91 11.77 Favored 'General case' 0 CA--C 1.473 -1.998 0 O-C-N 124.678 1.236 . . . . 38.630000000000003 107.756 174.854 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 3.9 p -105.59 7.94 33.01 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.973 0.892 . . . . 44.789999999999999 110.801 -176.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.59 147.2 27.83 Favored 'General case' 0 C--O 1.25 1.086 0 N-CA-C 107.299 -1.371 . . . . 50.939999999999998 107.299 175.543 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 54.4 57.33 5.92 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.963 -1.017 . . . . 49.68 108.945 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -166.51 153.49 9.26 Favored 'General case' 0 C--O 1.21 -1.024 0 N-CA-C 108.535 -0.913 . . . . 50.25 108.535 174.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.9 tp -50.46 -38.45 43.71 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.913 0.709 . . . . 44.399999999999999 112.913 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 64.7 tp -59.69 -44.61 93.57 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.14 -0.482 . . . . 41.859999999999999 110.5 -177.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.85 -39.79 95.23 Favored Glycine 0 C--O 1.221 -0.701 0 O-C-N 123.467 0.48 . . . . 43.490000000000002 112.381 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -58.53 -39.42 80.09 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 122.792 -0.24 . . . . 49.82 110.532 171.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.1 mt -72.65 -41.65 65.22 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 112.3 0.481 . . . . 46.520000000000003 112.3 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -82.16 -18.38 43.0 Favored 'General case' 0 C--O 1.245 0.868 0 N-CA-C 114.631 1.345 . . . . 44.219999999999999 114.631 -178.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.05 37.22 92.92 Favored Glycine 0 N--CA 1.485 1.957 0 O-C-N 123.593 0.558 . . . . 43.700000000000003 114.063 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 25.6 m -156.35 149.32 18.36 Favored Pre-proline 0 N--CA 1.432 -1.349 0 N-CA-C 107.268 -1.382 . . . . 41.469999999999999 107.268 -173.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -85.53 -20.07 3.32 Favored 'Trans proline' 0 C--O 1.251 1.15 0 O-C-N 122.375 0.671 . . . . 39.670000000000002 111.858 -176.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 88.5 p -170.64 167.93 7.71 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.395 -0.821 . . . . 36.159999999999997 109.217 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -166.16 156.45 12.5 Favored 'General case' 0 C--O 1.247 0.961 0 O-C-N 124.281 0.988 . . . . 37.990000000000002 108.474 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.8 t -83.22 140.32 32.61 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 121.643 -0.66 . . . . 40.659999999999997 110.793 172.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.9 m -68.2 -10.85 13.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 O-C-N 120.996 -1.065 . . . . 45.270000000000003 111.61 171.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -75.94 -14.25 60.25 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 114.283 1.216 . . . . 53.57 114.283 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -91.02 86.93 6.4 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 118.777 0.717 . . . . 47.560000000000002 109.643 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -69.59 -38.32 77.29 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.667 -0.697 . . . . 46.969999999999999 112.473 -169.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . 0.517 ' CG ' ' O1 ' ' A' ' 112' ' ' SO4 . 6.4 mtt180 -73.53 -42.21 62.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.563 -0.744 . . . . 49.119999999999997 111.289 -178.874 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -55.4 -51.15 67.8 Favored 'General case' 0 C--O 1.211 -0.935 0 N-CA-C 107.481 -1.303 . . . . 47.469999999999999 107.481 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 15.7 mt -64.87 -41.73 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.392 0 CA-C-N 115.704 -0.68 . . . . 36.840000000000003 112.434 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -59.68 -48.4 81.81 Favored 'General case' 0 CA--C 1.491 -1.304 0 N-CA-C 109.095 -0.706 . . . . 39.130000000000003 109.095 177.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.4 m -52.28 -46.22 65.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.058 0.456 . . . . 36.810000000000002 111.637 175.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 60.5 mtm -71.49 -43.27 66.86 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.786 -1.561 . . . . 37.450000000000003 106.786 -167.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 59.7 mt -56.04 -47.08 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 O-C-N 123.879 0.737 . . . . 39.859999999999999 112.848 173.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -68.1 -19.06 64.81 Favored 'General case' 0 CA--C 1.49 -1.355 0 N-CA-C 113.756 1.021 . . . . 53.920000000000002 113.756 -176.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -66.37 -24.33 66.48 Favored 'General case' 0 C--O 1.218 -0.597 0 C-N-CA 119.059 -1.057 . . . . 60.890000000000001 109.158 174.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -105.24 22.14 15.9 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.007 1.114 . . . . 52.640000000000001 114.007 -174.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 43.2 mt -133.17 165.25 25.2 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.826 -1.079 . . . . 51.960000000000001 110.538 -169.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 50.0 t -141.25 111.65 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 108.183 -1.043 . . . . 55.200000000000003 108.183 167.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 14.7 t -65.56 113.28 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 N-CA-C 112.613 0.597 . . . . 56.670000000000002 112.613 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 109.855 -0.424 . . . . 58.5 109.855 -177.671 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' K23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' SO4 . . . . . 0.517 ' O1 ' ' CG ' ' A' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . 0.516 ' HB ' ' HZ1' ' A' ' 51' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 120.579 0.228 . . . . 56.009999999999998 110.772 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.8 mt -135.62 152.45 51.25 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 114.146 1.165 . . . . 53.079999999999998 114.146 -172.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.0 m -142.15 157.05 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 121.671 0.748 . . . . 49.380000000000003 110.361 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . 0.715 ' CZ ' ' HB2' ' A' ' 29' ' ' ARG . 0.3 OUTLIER -117.25 113.39 39.12 Favored Pre-proline 0 C--O 1.243 0.763 0 N-CA-C 106.546 -1.65 . . . . 63.140000000000001 106.546 170.627 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -60.22 141.17 95.35 Favored 'Trans proline' 0 CA--C 1.491 -1.654 0 C-N-CA 117.755 -1.03 . . . . 46.950000000000003 110.569 176.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -67.68 154.77 92.8 Favored Pre-proline 0 N--CA 1.437 -1.083 0 C-N-CA 120.035 -0.666 . . . . 47.670000000000002 110.851 168.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.01 -37.74 37.95 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 N-CA-C 114.818 1.046 . . . . 46.140000000000001 114.818 -160.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . 0.53 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 15.1 mm-40 -71.29 -41.24 70.23 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 113.591 0.96 . . . . 59.130000000000003 113.591 -172.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 tp -67.21 -39.6 86.32 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 118.744 -0.646 . . . . 48.719999999999999 110.768 170.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.2 tp -56.28 -42.07 76.89 Favored 'General case' 0 C--O 1.263 1.778 0 CA-C-N 119.199 0.909 . . . . 51.829999999999998 111.743 175.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -62.6 -46.6 87.52 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.148 -0.621 . . . . 56.490000000000002 109.752 176.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . 0.775 HD13 ' CD1' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -60.07 -43.45 95.45 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.507 -0.477 . . . . 48.390000000000001 111.906 175.736 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 16.6 mt -63.42 -38.01 89.47 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 118.749 0.704 . . . . 49.210000000000001 112.216 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -69.41 -32.08 70.85 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-O 118.13 -0.938 . . . . 56.340000000000003 111.936 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.7 p -62.64 -24.75 67.77 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.772 0.714 . . . . 53.159999999999997 111.407 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . 0.484 HG11 ' CA ' ' A' ' 60' ' ' TYR . 2.0 m -94.99 21.87 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 N-CA-C 112.739 0.644 . . . . 56.420000000000002 112.739 170.2 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.88 36.48 52.46 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 116.639 1.416 . . . . 58.880000000000003 116.639 173.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.34 139.74 37.7 Favored 'General case' 0 C--O 1.247 0.939 0 N-CA-C 106.658 -1.608 . . . . 59.909999999999997 106.658 168.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . . . -103.06 -16.71 15.7 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 114.196 1.184 . . . . 60.899999999999999 114.196 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -92.55 -174.8 3.78 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.859 0.688 . . . . 61.530000000000001 112.859 -174.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . 0.553 ' O ' HG22 ' A' ' 47' ' ' THR . 0.9 OUTLIER -132.14 8.71 4.4 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.779 1.232 . . . . 59.789999999999999 110.689 166.709 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . 0.553 HG22 ' O ' ' A' ' 46' ' ' ASP . 8.1 p -153.55 123.12 6.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.393 -0.817 . . . . 54.960000000000001 110.885 170.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -124.0 164.85 18.5 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.335 -1.302 . . . . 53.939999999999998 108.666 -163.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . 0.969 ' HB ' ' HD2' ' A' ' 51' ' ' LYS . 1.4 p -76.13 158.74 31.43 Favored 'General case' 0 N--CA 1.418 -2.06 0 N-CA-C 107.649 -1.241 . . . . 46.079999999999998 107.649 154.8 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 41.9 mmm -55.32 -48.41 74.2 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.36 0.6 . . . . 51.350000000000001 110.884 172.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . 0.969 ' HD2' ' HB ' ' A' ' 49' ' ' THR . 0.0 OUTLIER -42.94 -53.71 4.58 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 113.829 -1.532 . . . . 51.479999999999997 108.815 177.47 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . 0.454 ' OE1' ' OG1' ' A' ' 49' ' ' THR . 19.0 mt-10 -63.59 -33.94 76.72 Favored 'General case' 0 C--O 1.203 -1.385 0 N-CA-C 112.82 0.674 . . . . 51.210000000000001 112.82 176.542 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.4 t -67.11 -54.03 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 N-CA-C 107.923 -1.14 . . . . 40.810000000000002 107.923 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.5 mt -58.3 -41.43 84.41 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.524 -0.307 . . . . 37.759999999999998 110.947 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PHE . . . . . 0.583 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 89.3 t80 -56.99 -55.12 38.83 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 115.327 1.603 . . . . 37.960000000000001 115.327 175.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -63.76 -28.51 69.93 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.664 -1.272 . . . . 48.259999999999998 113.765 176.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 57' ' ' LEU . 34.4 mt -61.32 -59.81 4.71 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 120.168 -0.613 . . . . 36.600000000000001 111.278 175.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -52.12 -37.88 47.03 Favored Glycine 0 C--O 1.201 -1.932 0 O-C-N 123.323 0.389 . . . . 41.359999999999999 112.421 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 55' ' ' PHE . 29.8 mm100 -64.36 -41.91 96.49 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 122.203 -0.586 . . . . 44.420000000000002 110.769 176.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TYR . . . . . 0.775 ' CD1' HD13 ' A' ' 37' ' ' LEU . 79.6 t80 -60.58 -50.15 74.68 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 115.609 -0.723 . . . . 48.43 109.492 175.556 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 84.1 mt -54.71 -44.75 71.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 123.431 0.692 . . . . 48.369999999999997 110.317 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 66.2 mmm -65.79 -49.29 68.84 Favored 'General case' 0 CA--C 1.493 -1.24 0 CA-C-N 116.102 -0.499 . . . . 60.789999999999999 111.59 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 71.6 p -77.64 -15.92 58.88 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 114.725 1.379 . . . . 53.189999999999998 114.725 -174.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -96.4 -0.99 48.51 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 118.028 0.377 . . . . 58.210000000000001 111.959 172.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . 0.461 ' NH1' ' HG2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER 61.76 50.97 4.06 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.706 0.403 . . . . 77.530000000000001 112.084 -179.674 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . 0.505 ' O ' ' N ' ' A' ' 76' ' ' TYR . 84.2 mt -93.62 -8.33 41.38 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.857 0.688 . . . . 57.93 112.857 -176.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -89.86 156.81 18.22 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.217 -0.593 . . . . 67.140000000000001 109.984 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . 0.481 ' HB3' ' HB2' ' A' ' 71' ' ' GLN . 24.0 t0 -98.64 122.1 41.42 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 118.431 -1.307 . . . . 66.840000000000003 108.347 171.067 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 pm0 -62.45 -25.34 67.93 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 123.873 0.733 . . . . 73.640000000000001 112.52 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -99.11 -5.3 30.42 Favored 'General case' 0 CA--C 1.56 1.361 0 N-CA-C 117.013 2.227 . . . . 71.280000000000001 117.013 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLN . . . . . 0.481 ' HB2' ' HB3' ' A' ' 68' ' ' ASP . 15.7 mm-40 -106.03 -29.36 9.97 Favored 'General case' 0 C--O 1.254 1.299 0 C-N-CA 124.165 0.986 . . . . 71.430000000000007 109.229 169.211 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . 0.271 . . 78.63 -26.09 0.18 Allowed 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 115.386 1.624 . . . . 65.099999999999994 115.386 161.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HIS . . . . . 0.821 ' HB2' HG22 ' A' ' 93' ' ' VAL . 2.8 p-80 -141.96 38.51 1.62 Allowed 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 114.432 1.271 . . . . 62.189999999999998 114.432 160.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 39.9 mm -110.27 125.41 67.51 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.664 0 N-CA-C 106.693 -1.595 . . . . 50.030000000000001 106.693 168.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.8 t -98.51 118.9 45.78 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.208 0 N-CA-C 102.92 -2.993 . . . . 41.859999999999999 102.92 -176.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' TYR . . . . . 0.505 ' N ' ' O ' ' A' ' 66' ' ' LEU . 65.5 m-85 -95.32 99.91 11.77 Favored 'General case' 0 CA--C 1.473 -1.998 0 O-C-N 124.678 1.236 . . . . 38.630000000000003 107.756 174.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 3.9 p -105.59 7.94 33.01 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.973 0.892 . . . . 44.789999999999999 110.801 -176.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.59 147.2 27.83 Favored 'General case' 0 C--O 1.25 1.086 0 N-CA-C 107.299 -1.371 . . . . 50.939999999999998 107.299 175.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 54.4 57.33 5.92 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.963 -1.017 . . . . 49.68 108.945 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -166.51 153.49 9.26 Favored 'General case' 0 C--O 1.21 -1.024 0 N-CA-C 108.535 -0.913 . . . . 50.25 108.535 174.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . 0.57 ' O ' HD12 ' A' ' 81' ' ' LEU . 5.9 tp -50.46 -38.45 43.71 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.913 0.709 . . . . 44.399999999999999 112.913 -179.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 64.7 tp -59.69 -44.61 93.57 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.14 -0.482 . . . . 41.859999999999999 110.5 -177.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.85 -39.79 95.23 Favored Glycine 0 C--O 1.221 -0.701 0 O-C-N 123.467 0.48 . . . . 43.490000000000002 112.381 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -58.53 -39.42 80.09 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 122.792 -0.24 . . . . 49.82 110.532 171.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.1 mt -72.65 -41.65 65.22 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 112.3 0.481 . . . . 46.520000000000003 112.3 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -82.16 -18.38 43.0 Favored 'General case' 0 C--O 1.245 0.868 0 N-CA-C 114.631 1.345 . . . . 44.219999999999999 114.631 -178.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.05 37.22 92.92 Favored Glycine 0 N--CA 1.485 1.957 0 O-C-N 123.593 0.558 . . . . 43.700000000000003 114.063 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 25.6 m -156.35 149.32 18.36 Favored Pre-proline 0 N--CA 1.432 -1.349 0 N-CA-C 107.268 -1.382 . . . . 41.469999999999999 107.268 -173.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -85.53 -20.07 3.32 Favored 'Trans proline' 0 C--O 1.251 1.15 0 O-C-N 122.375 0.671 . . . . 39.670000000000002 111.858 -176.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 88.5 p -170.64 167.93 7.71 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.395 -0.821 . . . . 36.159999999999997 109.217 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -166.16 156.45 12.5 Favored 'General case' 0 C--O 1.247 0.961 0 O-C-N 124.281 0.988 . . . . 37.990000000000002 108.474 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.8 t -83.22 140.32 32.61 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 121.643 -0.66 . . . . 40.659999999999997 110.793 172.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . 0.821 HG22 ' HB2' ' A' ' 73' ' ' HIS . 3.9 m -68.2 -10.85 13.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 O-C-N 120.996 -1.065 . . . . 45.270000000000003 111.61 171.225 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -75.94 -14.25 60.25 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 114.283 1.216 . . . . 53.57 114.283 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -91.02 86.93 6.4 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 118.777 0.717 . . . . 47.560000000000002 109.643 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -69.59 -38.32 77.29 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.667 -0.697 . . . . 46.969999999999999 112.473 -169.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . 0.896 ' HG3' ' O1 ' ' A' ' 112' ' ' SO4 . 6.4 mtt180 -73.53 -42.21 62.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.563 -0.744 . . . . 49.119999999999997 111.289 -178.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . 0.431 ' HG2' ' CE ' ' A' ' 102' ' ' MET . 60.4 tttp -55.4 -51.15 67.8 Favored 'General case' 0 C--O 1.211 -0.935 0 N-CA-C 107.481 -1.303 . . . . 47.469999999999999 107.481 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 15.7 mt -64.87 -41.73 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.392 0 CA-C-N 115.704 -0.68 . . . . 36.840000000000003 112.434 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -59.68 -48.4 81.81 Favored 'General case' 0 CA--C 1.491 -1.304 0 N-CA-C 109.095 -0.706 . . . . 39.130000000000003 109.095 177.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.4 m -52.28 -46.22 65.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.058 0.456 . . . . 36.810000000000002 111.637 175.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' MET . . . . . 0.431 ' CE ' ' HG2' ' A' ' 98' ' ' LYS . 60.5 mtm -71.49 -43.27 66.86 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.786 -1.561 . . . . 37.450000000000003 106.786 -167.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . 0.426 HG22 HD11 ' A' ' 107' ' ' LEU . 59.7 mt -56.04 -47.08 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 O-C-N 123.879 0.737 . . . . 39.859999999999999 112.848 173.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TYR . . . . . 0.517 ' CD1' HD12 ' A' ' 107' ' ' LEU . 29.4 m-85 -68.1 -19.06 64.81 Favored 'General case' 0 CA--C 1.49 -1.355 0 N-CA-C 113.756 1.021 . . . . 53.920000000000002 113.756 -176.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -66.37 -24.33 66.48 Favored 'General case' 0 C--O 1.218 -0.597 0 C-N-CA 119.059 -1.057 . . . . 60.890000000000001 109.158 174.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -105.24 22.14 15.9 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.007 1.114 . . . . 52.640000000000001 114.007 -174.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . 0.517 HD12 ' CD1' ' A' ' 104' ' ' TYR . 43.2 mt -133.17 165.25 25.2 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.826 -1.079 . . . . 51.960000000000001 110.538 -169.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 50.0 t -141.25 111.65 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 108.183 -1.043 . . . . 55.200000000000003 108.183 167.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 14.7 t -65.56 113.28 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 N-CA-C 112.613 0.597 . . . . 56.670000000000002 112.613 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 109.855 -0.424 . . . . 58.5 109.855 -177.671 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' K23 . . . . . 0.463 ' H17' HG11 ' A' ' 93' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' SO4 . . . . . 0.896 ' O1 ' ' HG3' ' A' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . 0.421 ' O ' HG21 ' A' ' 26' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . 0.516 ' HB ' ' HZ1' ' A' ' 51' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 120.579 0.228 . . . . 56.009999999999998 110.772 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.8 mt -135.62 152.45 51.25 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 114.146 1.165 . . . . 53.079999999999998 114.146 -172.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.0 m -142.15 157.05 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 121.671 0.748 . . . . 49.380000000000003 110.361 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.715 ' CZ ' ' HB2' ' A' ' 29' ' ' ARG . 0.3 OUTLIER -117.25 113.39 39.12 Favored Pre-proline 0 C--O 1.243 0.763 0 N-CA-C 106.546 -1.65 . . . . 63.140000000000001 106.546 170.627 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -60.22 141.17 95.35 Favored 'Trans proline' 0 CA--C 1.491 -1.654 0 C-N-CA 117.755 -1.03 . . . . 46.950000000000003 110.569 176.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -67.68 154.77 92.8 Favored Pre-proline 0 N--CA 1.437 -1.083 0 C-N-CA 120.035 -0.666 . . . . 47.670000000000002 110.851 168.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -49.01 -37.74 37.95 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 N-CA-C 114.818 1.046 . . . . 46.140000000000001 114.818 -160.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.53 ' HA ' ' OE1' ' A' ' 33' ' ' GLU . 15.1 mm-40 -71.29 -41.24 70.23 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 113.591 0.96 . . . . 59.130000000000003 113.591 -172.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 tp -67.21 -39.6 86.32 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 118.744 -0.646 . . . . 48.719999999999999 110.768 170.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 44.2 tp -56.28 -42.07 76.89 Favored 'General case' 0 C--O 1.263 1.778 0 CA-C-N 119.199 0.909 . . . . 51.829999999999998 111.743 175.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -62.6 -46.6 87.52 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.148 -0.621 . . . . 56.490000000000002 109.752 176.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.775 HD13 ' CD1' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -60.07 -43.45 95.45 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.507 -0.477 . . . . 48.390000000000001 111.906 175.736 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 16.6 mt -63.42 -38.01 89.47 Favored 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 118.749 0.704 . . . . 49.210000000000001 112.216 178.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -69.41 -32.08 70.85 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-O 118.13 -0.938 . . . . 56.340000000000003 111.936 176.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.7 p -62.64 -24.75 67.77 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.772 0.714 . . . . 53.159999999999997 111.407 178.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.484 HG11 ' CA ' ' A' ' 60' ' ' TYR . 2.0 m -94.99 21.87 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 N-CA-C 112.739 0.644 . . . . 56.420000000000002 112.739 170.2 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 73.88 36.48 52.46 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 116.639 1.416 . . . . 58.880000000000003 116.639 173.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -79.34 139.74 37.7 Favored 'General case' 0 C--O 1.247 0.939 0 N-CA-C 106.658 -1.608 . . . . 59.909999999999997 106.658 168.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . . . -103.06 -16.71 15.7 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 114.196 1.184 . . . . 60.899999999999999 114.196 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 24.8 mtpt -92.55 -174.8 3.78 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 112.859 0.688 . . . . 61.530000000000001 112.859 -174.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.553 ' O ' HG22 ' A' ' 47' ' ' THR . 0.9 OUTLIER -132.14 8.71 4.4 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.779 1.232 . . . . 59.789999999999999 110.689 166.709 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . 0.553 HG22 ' O ' ' A' ' 46' ' ' ASP . 8.1 p -153.55 123.12 6.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.393 -0.817 . . . . 54.960000000000001 110.885 170.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -124.0 164.85 18.5 Favored 'General case' 0 N--CA 1.419 -1.977 0 CA-C-N 114.335 -1.302 . . . . 53.939999999999998 108.666 -163.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . 0.969 ' HB ' ' HD2' ' A' ' 51' ' ' LYS . 1.4 p -76.13 158.74 31.43 Favored 'General case' 0 N--CA 1.418 -2.06 0 N-CA-C 107.649 -1.241 . . . . 46.079999999999998 107.649 154.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 41.9 mmm -55.32 -48.41 74.2 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.36 0.6 . . . . 51.350000000000001 110.884 172.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.969 ' HD2' ' HB ' ' A' ' 49' ' ' THR . 0.0 OUTLIER -42.94 -53.71 4.58 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 113.829 -1.532 . . . . 51.479999999999997 108.815 177.47 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.454 ' OE1' ' OG1' ' A' ' 49' ' ' THR . 19.0 mt-10 -63.59 -33.94 76.72 Favored 'General case' 0 C--O 1.203 -1.385 0 N-CA-C 112.82 0.674 . . . . 51.210000000000001 112.82 176.542 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.4 t -67.11 -54.03 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 N-CA-C 107.923 -1.14 . . . . 40.810000000000002 107.923 177.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 16.5 mt -58.3 -41.43 84.41 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.524 -0.307 . . . . 37.759999999999998 110.947 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.583 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 89.3 t80 -56.99 -55.12 38.83 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 115.327 1.603 . . . . 37.960000000000001 115.327 175.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -63.76 -28.51 69.93 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.664 -1.272 . . . . 48.259999999999998 113.765 176.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 57' ' ' LEU . 34.4 mt -61.32 -59.81 4.71 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 120.168 -0.613 . . . . 36.600000000000001 111.278 175.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -52.12 -37.88 47.03 Favored Glycine 0 C--O 1.201 -1.932 0 O-C-N 123.323 0.389 . . . . 41.359999999999999 112.421 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 55' ' ' PHE . 29.8 mm100 -64.36 -41.91 96.49 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 122.203 -0.586 . . . . 44.420000000000002 110.769 176.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.775 ' CD1' HD13 ' A' ' 37' ' ' LEU . 79.6 t80 -60.58 -50.15 74.68 Favored 'General case' 0 C--O 1.215 -0.74 0 CA-C-N 115.609 -0.723 . . . . 48.43 109.492 175.556 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 84.1 mt -54.71 -44.75 71.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 123.431 0.692 . . . . 48.369999999999997 110.317 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 66.2 mmm -65.79 -49.29 68.84 Favored 'General case' 0 CA--C 1.493 -1.24 0 CA-C-N 116.102 -0.499 . . . . 60.789999999999999 111.59 177.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 71.6 p -77.64 -15.92 58.88 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 114.725 1.379 . . . . 53.189999999999998 114.725 -174.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -96.4 -0.99 48.51 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-N 118.028 0.377 . . . . 58.210000000000001 111.959 172.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.461 ' NH1' ' HG2' ' A' ' 65' ' ' ARG . 0.0 OUTLIER 61.76 50.97 4.06 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 122.706 0.403 . . . . 77.530000000000001 112.084 -179.674 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.505 ' O ' ' N ' ' A' ' 76' ' ' TYR . 84.2 mt -93.62 -8.33 41.38 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.857 0.688 . . . . 57.93 112.857 -176.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -89.86 156.81 18.22 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 120.217 -0.593 . . . . 67.140000000000001 109.984 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.481 ' HB3' ' HB2' ' A' ' 71' ' ' GLN . 24.0 t0 -98.64 122.1 41.42 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 118.431 -1.307 . . . . 66.840000000000003 108.347 171.067 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.0 pm0 -62.45 -25.34 67.93 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 123.873 0.733 . . . . 73.640000000000001 112.52 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -99.11 -5.3 30.42 Favored 'General case' 0 CA--C 1.56 1.361 0 N-CA-C 117.013 2.227 . . . . 71.280000000000001 117.013 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.481 ' HB2' ' HB3' ' A' ' 68' ' ' ASP . 15.7 mm-40 -106.03 -29.36 9.97 Favored 'General case' 0 C--O 1.254 1.299 0 C-N-CA 124.165 0.986 . . . . 71.430000000000007 109.229 169.211 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . 0.271 . . 78.63 -26.09 0.18 Allowed 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 115.386 1.624 . . . . 65.099999999999994 115.386 161.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.821 ' HB2' HG22 ' A' ' 93' ' ' VAL . 4.3 p80 -141.96 38.51 1.62 Allowed 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 114.432 1.271 . . . . 62.189999999999998 114.432 160.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 39.9 mm -110.27 125.41 67.51 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.664 0 N-CA-C 106.693 -1.595 . . . . 50.030000000000001 106.693 168.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 28.8 t -98.51 118.9 45.78 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.208 0 N-CA-C 102.92 -2.993 . . . . 41.859999999999999 102.92 -176.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.505 ' N ' ' O ' ' A' ' 66' ' ' LEU . 65.5 m-85 -95.32 99.91 11.77 Favored 'General case' 0 CA--C 1.473 -1.998 0 O-C-N 124.678 1.236 . . . . 38.630000000000003 107.756 174.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 3.9 p -105.59 7.94 33.01 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.973 0.892 . . . . 44.789999999999999 110.801 -176.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.59 147.2 27.83 Favored 'General case' 0 C--O 1.25 1.086 0 N-CA-C 107.299 -1.371 . . . . 50.939999999999998 107.299 175.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 54.4 57.33 5.92 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.963 -1.017 . . . . 49.68 108.945 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -166.51 153.49 9.26 Favored 'General case' 0 C--O 1.21 -1.024 0 N-CA-C 108.535 -0.913 . . . . 50.25 108.535 174.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.57 ' O ' HD12 ' A' ' 81' ' ' LEU . 5.9 tp -50.46 -38.45 43.71 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.913 0.709 . . . . 44.399999999999999 112.913 -179.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 64.7 tp -59.69 -44.61 93.57 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.14 -0.482 . . . . 41.859999999999999 110.5 -177.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -65.85 -39.79 95.23 Favored Glycine 0 C--O 1.221 -0.701 0 O-C-N 123.467 0.48 . . . . 43.490000000000002 112.381 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -58.53 -39.42 80.09 Favored 'General case' 0 C--N 1.319 -0.727 0 O-C-N 122.792 -0.24 . . . . 49.82 110.532 171.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.1 mt -72.65 -41.65 65.22 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 112.3 0.481 . . . . 46.520000000000003 112.3 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -82.16 -18.38 43.0 Favored 'General case' 0 C--O 1.245 0.868 0 N-CA-C 114.631 1.345 . . . . 44.219999999999999 114.631 -178.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.05 37.22 92.92 Favored Glycine 0 N--CA 1.485 1.957 0 O-C-N 123.593 0.558 . . . . 43.700000000000003 114.063 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 25.6 m -156.35 149.32 18.36 Favored Pre-proline 0 N--CA 1.432 -1.349 0 N-CA-C 107.268 -1.382 . . . . 41.469999999999999 107.268 -173.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -85.53 -20.07 3.32 Favored 'Trans proline' 0 C--O 1.251 1.15 0 O-C-N 122.375 0.671 . . . . 39.670000000000002 111.858 -176.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 88.5 p -170.64 167.93 7.71 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.395 -0.821 . . . . 36.159999999999997 109.217 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 46.0 p90 -166.16 156.45 12.5 Favored 'General case' 0 C--O 1.247 0.961 0 O-C-N 124.281 0.988 . . . . 37.990000000000002 108.474 -179.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.8 t -83.22 140.32 32.61 Favored 'General case' 0 CA--C 1.551 0.99 0 O-C-N 121.643 -0.66 . . . . 40.659999999999997 110.793 172.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.821 HG22 ' HB2' ' A' ' 73' ' ' HIS . 3.9 m -68.2 -10.85 13.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 O-C-N 120.996 -1.065 . . . . 45.270000000000003 111.61 171.225 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -75.94 -14.25 60.25 Favored 'General case' 0 CA--C 1.499 -0.981 0 N-CA-C 114.283 1.216 . . . . 53.57 114.283 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -91.02 86.93 6.4 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 118.777 0.717 . . . . 47.560000000000002 109.643 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -69.59 -38.32 77.29 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.667 -0.697 . . . . 46.969999999999999 112.473 -169.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.896 ' HG3' ' O1 ' ' A' ' 112' ' ' SO4 . 6.4 mtt180 -73.53 -42.21 62.04 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.563 -0.744 . . . . 49.119999999999997 111.289 -178.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.431 ' HG2' ' CE ' ' A' ' 102' ' ' MET . 60.4 tttp -55.4 -51.15 67.8 Favored 'General case' 0 C--O 1.211 -0.935 0 N-CA-C 107.481 -1.303 . . . . 47.469999999999999 107.481 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 15.7 mt -64.87 -41.73 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.392 0 CA-C-N 115.704 -0.68 . . . . 36.840000000000003 112.434 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -59.68 -48.4 81.81 Favored 'General case' 0 CA--C 1.491 -1.304 0 N-CA-C 109.095 -0.706 . . . . 39.130000000000003 109.095 177.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 4.4 m -52.28 -46.22 65.78 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.058 0.456 . . . . 36.810000000000002 111.637 175.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' MET . . . . . 0.431 ' CE ' ' HG2' ' A' ' 98' ' ' LYS . 60.5 mtm -71.49 -43.27 66.86 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.786 -1.561 . . . . 37.450000000000003 106.786 -167.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.426 HG22 HD11 ' A' ' 107' ' ' LEU . 59.7 mt -56.04 -47.08 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 O-C-N 123.879 0.737 . . . . 39.859999999999999 112.848 173.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.517 ' CD1' HD12 ' A' ' 107' ' ' LEU . 29.4 m-85 -68.1 -19.06 64.81 Favored 'General case' 0 CA--C 1.49 -1.355 0 N-CA-C 113.756 1.021 . . . . 53.920000000000002 113.756 -176.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.8 mtt85 -66.37 -24.33 66.48 Favored 'General case' 0 C--O 1.218 -0.597 0 C-N-CA 119.059 -1.057 . . . . 60.890000000000001 109.158 174.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -105.24 22.14 15.9 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.007 1.114 . . . . 52.640000000000001 114.007 -174.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . 0.517 HD12 ' CD1' ' A' ' 104' ' ' TYR . 43.2 mt -133.17 165.25 25.2 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.826 -1.079 . . . . 51.960000000000001 110.538 -169.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 50.0 t -141.25 111.65 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 N-CA-C 108.183 -1.043 . . . . 55.200000000000003 108.183 167.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 14.7 t -65.56 113.28 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 N-CA-C 112.613 0.597 . . . . 56.670000000000002 112.613 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 109.855 -0.424 . . . . 58.5 109.855 -177.671 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' K23 . . . . . 0.463 ' H17' HG11 ' A' ' 93' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' SO4 . . . . . 0.896 ' O1 ' ' HG3' ' A' ' 97' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . 0.421 ' O ' HG21 ' A' ' 26' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_