data_3q1d_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 3q1d _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 ' 122' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 112.336 0.495 . . . . 69.230000000000004 112.336 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -138.64 149.64 45.41 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.066 0.765 . . . . 54.509999999999998 113.066 -175.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.6 mp -91.44 139.3 30.84 Favored 'General case' 0 CA--C 1.498 -1.046 0 N-CA-C 106.801 -1.555 . . . . 35.890000000000001 106.801 164.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 79.1 mmm -105.71 147.2 28.82 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.976 -0.749 . . . . 33.259999999999998 108.976 177.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 50.2 t -61.92 138.77 58.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.666 -0.697 . . . . 23.5 110.209 174.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . . . -64.35 -39.44 93.89 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.729 0.812 . . . . 41.189999999999998 112.644 175.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -84.56 -48.98 9.0 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.75 0.648 . . . . 25.829999999999998 112.75 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -98.65 81.15 2.64 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 107.885 -1.154 . . . . 22.329999999999998 107.885 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . . . -65.14 -15.41 62.38 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.846 1.424 . . . . 29.989999999999998 114.846 -163.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -98.66 1.08 45.91 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 112.857 0.688 . . . . 54.170000000000002 112.857 174.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -100.64 139.33 36.48 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 121.973 -0.454 . . . . 28.149999999999999 111.752 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 18.3 mtmm -79.95 140.82 36.5 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.619 -0.719 . . . . 44.090000000000003 111.329 174.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 26.7 mm -73.76 106.93 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 N-CA-C 105.726 -1.953 . . . . 20.719999999999999 105.726 170.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 38.9 p-10 -135.5 0.44 2.75 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 112.42 0.526 . . . . 24.52 112.42 -172.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 30.2 pt -130.48 167.77 24.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 120.614 0.245 . . . . 16.93 111.573 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -125.4 126.9 45.72 Favored 'General case' 0 C--O 1.222 -0.383 0 N-CA-C 108.838 -0.801 . . . . 25.370000000000001 108.838 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' CYS . . . . . . . . . . . . . 45.6 t -80.75 112.76 18.42 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 118.627 -1.229 . . . . 21.66 111.007 172.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 75.4 mt -73.68 -28.64 61.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.437 -0.801 . . . . 30.800000000000001 111.011 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 9.7 m -72.55 -47.18 50.31 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 112.227 0.454 . . . . 32.200000000000003 112.227 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' CYS . . . . . . . . . . . . . 60.4 m -92.01 -9.6 42.27 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.662 0.615 . . . . 32.310000000000002 112.662 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 57.07 56.7 5.08 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.247 0.832 . . . . 49.100000000000001 113.247 -176.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.5 p -150.07 136.01 10.41 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 115.578 -0.737 . . . . 27.530000000000001 110.305 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -64.31 144.03 84.86 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 N-CA-C 110.347 -0.674 . . . . 25.75 110.347 172.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 4.5 t -145.9 -177.35 5.55 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 119.952 -0.699 . . . . 19.52 112.412 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.29 165.1 11.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.03 0.532 . . . . 16.84 110.308 178.811 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 60.4 m -68.49 -25.15 64.82 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.034 0.753 . . . . 17.870000000000001 113.034 -175.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 39.5 mt -77.65 -27.74 51.04 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.291 0.369 . . . . 16.379999999999999 111.827 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 24.1 m -64.2 -32.08 73.53 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 109.561 -0.533 . . . . 19.800000000000001 109.561 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -83.63 -41.39 17.86 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 113.863 1.06 . . . . 25.329999999999998 113.863 175.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 78.4 t -69.29 -48.67 66.63 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.412 0 O-C-N 121.82 -0.55 . . . . 15.69 109.884 -178.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -120.55 -24.36 5.82 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 116.295 1.961 . . . . 17.309999999999999 116.295 -173.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -95.41 -145.16 18.3 Favored Glycine 0 CA--C 1.507 -0.445 0 N-CA-C 115.254 0.862 . . . . 18.399999999999999 115.254 -160.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.3 -21.43 62.94 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.144 0.794 . . . . 23.940000000000001 113.144 -167.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -108.27 25.74 11.28 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 111.64 0.237 . . . . 28.48 111.64 -178.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 17.3 pttm -62.74 -33.39 75.04 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.203 0.816 . . . . 35.969999999999999 113.203 -171.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -102.05 19.08 19.17 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 113.508 0.929 . . . . 48.109999999999999 113.508 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 97.7 m -95.97 157.5 15.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 110.345 -0.242 . . . . 25.129999999999999 110.345 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -84.36 131.34 34.71 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.05 -0.66 . . . . 62.469999999999999 110.338 168.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 35.4 m -125.48 162.81 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 121.143 0.497 . . . . 19.68 111.64 -175.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -129.39 152.49 79.64 Favored Pre-proline 0 C--O 1.244 0.766 0 N-CA-C 108.052 -1.092 . . . . 19.489999999999998 108.052 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.95 145.77 28.66 Favored 'Trans proline' 0 C--N 1.35 0.658 0 O-C-N 122.52 0.747 . . . . 18.609999999999999 111.444 172.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 58.3 mt -86.01 156.29 57.81 Favored Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 108.192 -1.04 . . . . 20.140000000000001 108.192 166.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -51.6 -31.41 40.15 Favored 'Trans proline' 0 C--N 1.348 0.5 0 N-CA-C 114.75 1.019 . . . . 24.550000000000001 114.75 -172.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.5 t -54.58 -28.29 45.07 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.561 0.948 . . . . 34.990000000000002 113.561 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 11.0 mm -66.15 -35.35 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 112.956 0.725 . . . . 27.27 112.956 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -117.69 17.3 14.4 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 115.504 1.668 . . . . 32.159999999999997 115.504 -176.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' LYS . . . . . . . . . . . . . 53.9 pttt . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 114.359 1.244 . . . . 61.439999999999998 114.359 -176.454 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 112.336 0.495 . . . . 69.230000000000004 112.336 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HIS . . . . . 0.463 ' CD2' ' HD3' ' A' ' 133' ' ' LYS . 97.3 m-70 -138.64 149.64 45.41 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.066 0.765 . . . . 54.509999999999998 113.066 -175.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.6 mp -91.44 139.3 30.84 Favored 'General case' 0 CA--C 1.498 -1.046 0 N-CA-C 106.801 -1.555 . . . . 35.890000000000001 106.801 164.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 79.1 mmm -105.71 147.2 28.82 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.976 -0.749 . . . . 33.259999999999998 108.976 177.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 50.2 t -61.92 138.77 58.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.666 -0.697 . . . . 23.5 110.209 174.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . . . -64.35 -39.44 93.89 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.729 0.812 . . . . 41.189999999999998 112.644 175.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -84.56 -48.98 9.0 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.75 0.648 . . . . 25.829999999999998 112.75 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -98.65 81.15 2.64 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 107.885 -1.154 . . . . 22.329999999999998 107.885 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . . . -65.14 -15.41 62.38 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.846 1.424 . . . . 29.989999999999998 114.846 -163.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -98.66 1.08 45.91 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 112.857 0.688 . . . . 54.170000000000002 112.857 174.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -100.64 139.33 36.48 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 121.973 -0.454 . . . . 28.149999999999999 111.752 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . 0.463 ' HD3' ' CD2' ' A' ' 123' ' ' HIS . 18.3 mtmm -79.95 140.82 36.5 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.619 -0.719 . . . . 44.090000000000003 111.329 174.17 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 26.7 mm -73.76 106.93 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 N-CA-C 105.726 -1.953 . . . . 20.719999999999999 105.726 170.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 38.9 p-10 -135.5 0.44 2.75 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 112.42 0.526 . . . . 24.52 112.42 -172.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 30.2 pt -130.48 167.77 24.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 120.614 0.245 . . . . 16.93 111.573 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -125.4 126.9 45.72 Favored 'General case' 0 C--O 1.222 -0.383 0 N-CA-C 108.838 -0.801 . . . . 25.370000000000001 108.838 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' CYS . . . . . . . . . . . . . 45.6 t -80.75 112.76 18.42 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 118.627 -1.229 . . . . 21.66 111.007 172.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 75.4 mt -73.68 -28.64 61.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.437 -0.801 . . . . 30.800000000000001 111.011 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 9.7 m -72.55 -47.18 50.31 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 112.227 0.454 . . . . 32.200000000000003 112.227 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' CYS . . . . . . . . . . . . . 60.4 m -92.01 -9.6 42.27 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.662 0.615 . . . . 32.310000000000002 112.662 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 57.07 56.7 5.08 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.247 0.832 . . . . 49.100000000000001 113.247 -176.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.5 p -150.07 136.01 10.41 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 115.578 -0.737 . . . . 27.530000000000001 110.305 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -64.31 144.03 84.86 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 N-CA-C 110.347 -0.674 . . . . 25.75 110.347 172.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 4.5 t -145.9 -177.35 5.55 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 119.952 -0.699 . . . . 19.52 112.412 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.29 165.1 11.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.03 0.532 . . . . 16.84 110.308 178.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 60.4 m -68.49 -25.15 64.82 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.034 0.753 . . . . 17.870000000000001 113.034 -175.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 39.5 mt -77.65 -27.74 51.04 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.291 0.369 . . . . 16.379999999999999 111.827 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 24.1 m -64.2 -32.08 73.53 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 109.561 -0.533 . . . . 19.800000000000001 109.561 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LYS . . . . . 0.413 ' O ' ' HA ' ' A' ' 156' ' ' LYS . 45.3 tptt -83.63 -41.39 17.86 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 113.863 1.06 . . . . 25.329999999999998 113.863 175.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 78.4 t -69.29 -48.67 66.63 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.412 0 O-C-N 121.82 -0.55 . . . . 15.69 109.884 -178.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -120.55 -24.36 5.82 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 116.295 1.961 . . . . 17.309999999999999 116.295 -173.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -95.41 -145.16 18.3 Favored Glycine 0 CA--C 1.507 -0.445 0 N-CA-C 115.254 0.862 . . . . 18.399999999999999 115.254 -160.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.3 -21.43 62.94 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.144 0.794 . . . . 23.940000000000001 113.144 -167.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -108.27 25.74 11.28 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 111.64 0.237 . . . . 28.48 111.64 -178.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 150' ' ' LYS . 17.3 pttm -62.74 -33.39 75.04 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.203 0.816 . . . . 35.969999999999999 113.203 -171.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -102.05 19.08 19.17 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 113.508 0.929 . . . . 48.109999999999999 113.508 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 97.7 m -95.97 157.5 15.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 110.345 -0.242 . . . . 25.129999999999999 110.345 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -84.36 131.34 34.71 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.05 -0.66 . . . . 62.469999999999999 110.338 168.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 35.4 m -125.48 162.81 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 121.143 0.497 . . . . 19.68 111.64 -175.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -129.39 152.49 79.64 Favored Pre-proline 0 C--O 1.244 0.766 0 N-CA-C 108.052 -1.092 . . . . 19.489999999999998 108.052 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.95 145.77 28.66 Favored 'Trans proline' 0 C--N 1.35 0.658 0 O-C-N 122.52 0.747 . . . . 18.609999999999999 111.444 172.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 58.3 mt -86.01 156.29 57.81 Favored Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 108.192 -1.04 . . . . 20.140000000000001 108.192 166.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' PRO . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 167' ' ' TYR . 24.2 Cg_exo -51.6 -31.41 40.15 Favored 'Trans proline' 0 C--N 1.348 0.5 0 N-CA-C 114.75 1.019 . . . . 24.550000000000001 114.75 -172.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.5 t -54.58 -28.29 45.07 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.561 0.948 . . . . 34.990000000000002 113.561 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 11.0 mm -66.15 -35.35 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 112.956 0.725 . . . . 27.27 112.956 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 164' ' ' PRO . 21.6 p90 -117.69 17.3 14.4 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 115.504 1.668 . . . . 32.159999999999997 115.504 -176.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 168' ' ' LYS . . . . . . . . . . . . . 53.9 pttt . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 114.359 1.244 . . . . 61.439999999999998 114.359 -176.454 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 112.336 0.495 . . . . 69.230000000000004 112.336 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.463 ' CD2' ' HD3' ' A' ' 133' ' ' LYS . 97.3 m-70 -138.64 149.64 45.41 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 113.066 0.765 . . . . 54.509999999999998 113.066 -175.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.6 mp -91.44 139.3 30.84 Favored 'General case' 0 CA--C 1.498 -1.046 0 N-CA-C 106.801 -1.555 . . . . 35.890000000000001 106.801 164.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 79.1 mmm -105.71 147.2 28.82 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 108.976 -0.749 . . . . 33.259999999999998 108.976 177.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 50.2 t -61.92 138.77 58.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 115.666 -0.697 . . . . 23.5 110.209 174.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . . . -64.35 -39.44 93.89 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.729 0.812 . . . . 41.189999999999998 112.644 175.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -84.56 -48.98 9.0 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.75 0.648 . . . . 25.829999999999998 112.75 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 50.9 m80 -98.65 81.15 2.64 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 107.885 -1.154 . . . . 22.329999999999998 107.885 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . . . -65.14 -15.41 62.38 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 114.846 1.424 . . . . 29.989999999999998 114.846 -163.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -98.66 1.08 45.91 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 112.857 0.688 . . . . 54.170000000000002 112.857 174.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -100.64 139.33 36.48 Favored 'General case' 0 N--CA 1.445 -0.7 0 O-C-N 121.973 -0.454 . . . . 28.149999999999999 111.752 -179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.463 ' HD3' ' CD2' ' A' ' 123' ' ' HIS . 18.3 mtmm -79.95 140.82 36.5 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.619 -0.719 . . . . 44.090000000000003 111.329 174.17 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 26.7 mm -73.76 106.93 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 N-CA-C 105.726 -1.953 . . . . 20.719999999999999 105.726 170.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 38.9 p-10 -135.5 0.44 2.75 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 112.42 0.526 . . . . 24.52 112.42 -172.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 30.2 pt -130.48 167.77 24.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 120.614 0.245 . . . . 16.93 111.573 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -125.4 126.9 45.72 Favored 'General case' 0 C--O 1.222 -0.383 0 N-CA-C 108.838 -0.801 . . . . 25.370000000000001 108.838 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' CYS . . . . . . . . . . . . . 45.6 t -80.75 112.76 18.42 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 118.627 -1.229 . . . . 21.66 111.007 172.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 75.4 mt -73.68 -28.64 61.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.437 -0.801 . . . . 30.800000000000001 111.011 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' SER . . . . . . . . . . . . . 9.7 m -72.55 -47.18 50.31 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 112.227 0.454 . . . . 32.200000000000003 112.227 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' CYS . . . . . . . . . . . . . 60.4 m -92.01 -9.6 42.27 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.662 0.615 . . . . 32.310000000000002 112.662 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 57.07 56.7 5.08 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 113.247 0.832 . . . . 49.100000000000001 113.247 -176.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 4.5 p -150.07 136.01 10.41 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 115.578 -0.737 . . . . 27.530000000000001 110.305 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -64.31 144.03 84.86 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 N-CA-C 110.347 -0.674 . . . . 25.75 110.347 172.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 4.5 t -145.9 -177.35 5.55 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 119.952 -0.699 . . . . 19.52 112.412 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -107.29 165.1 11.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.03 0.532 . . . . 16.84 110.308 178.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 60.4 m -68.49 -25.15 64.82 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 113.034 0.753 . . . . 17.870000000000001 113.034 -175.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 39.5 mt -77.65 -27.74 51.04 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 123.291 0.369 . . . . 16.379999999999999 111.827 -177.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' CYS . . . . . . . . . . . . . 24.1 m -64.2 -32.08 73.53 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 109.561 -0.533 . . . . 19.800000000000001 109.561 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LYS . . . . . 0.413 ' O ' ' HA ' ' A' ' 156' ' ' LYS . 45.3 tptt -83.63 -41.39 17.86 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 113.863 1.06 . . . . 25.329999999999998 113.863 175.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' VAL . . . . . . . . . . . . . 78.4 t -69.29 -48.67 66.63 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.412 0 O-C-N 121.82 -0.55 . . . . 15.69 109.884 -178.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -120.55 -24.36 5.82 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 116.295 1.961 . . . . 17.309999999999999 116.295 -173.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . -95.41 -145.16 18.3 Favored Glycine 0 CA--C 1.507 -0.445 0 N-CA-C 115.254 0.862 . . . . 18.399999999999999 115.254 -160.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -70.3 -21.43 62.94 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 113.144 0.794 . . . . 23.940000000000001 113.144 -167.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -108.27 25.74 11.28 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 111.64 0.237 . . . . 28.48 111.64 -178.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 150' ' ' LYS . 17.3 pttm -62.74 -33.39 75.04 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.203 0.816 . . . . 35.969999999999999 113.203 -171.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -102.05 19.08 19.17 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 113.508 0.929 . . . . 48.109999999999999 113.508 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 97.7 m -95.97 157.5 15.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 110.345 -0.242 . . . . 25.129999999999999 110.345 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -84.36 131.34 34.71 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.05 -0.66 . . . . 62.469999999999999 110.338 168.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 35.4 m -125.48 162.81 27.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 121.143 0.497 . . . . 19.68 111.64 -175.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -129.39 152.49 79.64 Favored Pre-proline 0 C--O 1.244 0.766 0 N-CA-C 108.052 -1.092 . . . . 19.489999999999998 108.052 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.95 145.77 28.66 Favored 'Trans proline' 0 C--N 1.35 0.658 0 O-C-N 122.52 0.747 . . . . 18.609999999999999 111.444 172.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 58.3 mt -86.01 156.29 57.81 Favored Pre-proline 0 CA--C 1.545 0.774 0 N-CA-C 108.192 -1.04 . . . . 20.140000000000001 108.192 166.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' PRO . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 167' ' ' TYR . 24.2 Cg_exo -51.6 -31.41 40.15 Favored 'Trans proline' 0 C--N 1.348 0.5 0 N-CA-C 114.75 1.019 . . . . 24.550000000000001 114.75 -172.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 1.5 t -54.58 -28.29 45.07 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 113.561 0.948 . . . . 34.990000000000002 113.561 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 11.0 mm -66.15 -35.35 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 112.956 0.725 . . . . 27.27 112.956 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' TYR . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 164' ' ' PRO . 21.6 p90 -117.69 17.3 14.4 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 115.504 1.668 . . . . 32.159999999999997 115.504 -176.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' LYS . . . . . . . . . . . . . 53.9 pttt . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 114.359 1.244 . . . . 61.439999999999998 114.359 -176.454 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_