data_1zij_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 1zij _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 ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.056 . . . . . . . . 63.009999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -40.71 -71.0 0.09 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.858 1.663 . . . . 100.0 110.684 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' MET . . . . . 0.407 ' CE ' ' CE ' ' C' ' 2' ' ' MET . 6.2 tpp -48.33 -42.93 32.67 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 117.856 2.539 . . . . 65.239999999999995 117.856 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -35.34 80.59 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 115.972 -2.291 . . . . 60.82 107.911 179.698 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.44 -49.06 70.58 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 114.286 1.217 . . . . 100.0 114.286 -179.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.3 tp -61.42 -60.05 4.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.934 0.873 . . . . 70.319999999999993 109.372 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -51.41 -32.32 25.98 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.125 -1.398 . . . . 100.0 109.673 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . 0.328 21.2 m-20 -80.04 -26.74 39.62 Favored 'General case' 0 C--O 1.244 0.803 0 C-N-CA 117.397 -1.721 . . . . 74.290000000000006 112.164 178.477 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.9 mtmt -73.57 -30.48 63.06 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 114.709 -1.132 . . . . 96.719999999999999 110.38 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.0 t -73.49 -27.5 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 114.828 -1.078 . . . . 28.32 110.086 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.11 -38.02 32.45 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-O 122.476 1.132 . . . . 100.0 108.489 178.814 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -54.08 -48.75 70.32 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 118.052 -1.459 . . . . 64.739999999999995 108.408 176.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . 0.43 ' CD2' ' CD2' ' B' ' 13' ' ' LEU . 77.3 mt -58.84 -46.33 87.95 Favored 'General case' 0 CA--C 1.509 -0.631 0 C-N-CA 125.531 1.533 . . . . 39.920000000000002 113.99 179.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 13.9 mt -62.37 -39.75 94.19 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 123.589 1.661 . . . . 29.239999999999998 110.521 -179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.7 t -56.44 -63.44 1.19 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 113.138 -1.846 . . . . 40.920000000000002 109.54 178.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . 0.269 4.8 mmtt -57.0 -46.53 82.22 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.618 2.367 . . . . 75.890000000000001 114.457 178.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -61.47 -50.95 70.7 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 126.653 1.981 . . . . 64.680000000000007 110.342 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 60.1 t60 -57.81 -57.02 14.61 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.672 0.749 . . . . 74.019999999999996 109.939 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 52.1 mt -49.08 -47.21 45.29 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.514 1.526 . . . . 34.729999999999997 113.487 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.04 -42.11 89.46 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-O 122.927 1.346 . . . . 97.689999999999998 110.503 179.629 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -65.92 -52.25 51.58 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 113.43 -1.714 . . . . 33.380000000000003 110.557 -178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -54.39 -48.42 71.59 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 125.262 1.601 . . . . 98.370000000000005 111.432 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.1 t -60.21 -43.94 94.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 CA-C-O 118.304 -0.855 . . . . 23.710000000000001 110.322 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.47 83.57 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.309 1.044 . . . . 31.809999999999999 113.74 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -67.95 -42.62 80.66 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.071 1.748 . . . . 59.240000000000002 111.393 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.0 mt -58.08 -30.46 66.25 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 125.452 1.501 . . . . 48.350000000000001 110.889 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.301 4.4 mtpp -83.48 -20.42 34.02 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 114.464 1.283 . . . . 51.890000000000001 114.464 178.425 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.0 mttt -82.96 -38.57 22.56 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 106.533 -1.654 . . . . 91.060000000000002 106.533 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.6 mt -63.34 -20.56 65.62 Favored 'General case' 0 C--O 1.222 -0.367 0 N-CA-C 114.847 1.425 . . . . 49.340000000000003 114.847 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -117.15 -1.54 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 122.801 1.286 . . . . 61.780000000000001 112.865 -176.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 83.67 -4.13 83.1 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 113.586 -1.643 . . . . 56.960000000000001 116.428 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -76.49 146.72 38.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.561 0.578 . . . . 76.890000000000001 112.561 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.611 0 N-CA-C 109.333 -0.617 . . . . 100.0 109.333 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.863 . . . . . . . . 100.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 51.0 mtt180 -48.41 -41.25 28.58 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 124.571 1.148 . . . . 100.0 111.694 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -59.41 5.5 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 115.751 1.76 . . . . 80.900000000000006 115.751 -179.555 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LYS . . . . . 0.526 ' O ' ' N ' ' B' ' 7' ' ' ASP . 0.0 OUTLIER -52.85 -53.48 48.22 Favored 'General case' 0 CA--C 1.505 -0.75 0 O-C-N 125.226 1.579 . . . . 100.0 112.487 -179.833 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.18 -47.26 24.05 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 124.964 1.415 . . . . 88.019999999999996 111.695 179.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.43 -45.88 82.12 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.737 0.779 . . . . 62.649999999999999 109.484 -179.101 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -70.63 -32.54 69.89 Favored 'General case' 0 N--CA 1.432 -1.362 0 C-N-CA 116.931 -1.908 . . . . 100.0 110.251 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' B' ' 3' ' ' LYS . 11.1 m-20 -56.75 -55.49 33.56 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 107.338 -1.356 . . . . 100.0 107.338 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.73 -54.63 6.07 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 111.012 -2.813 . . . . 83.019999999999996 112.78 178.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 55.6 t -63.86 -33.29 61.09 Favored 'Isoleucine or valine' 0 C--O 1.244 0.78 0 C-N-CA 127.467 2.307 . . . . 40.280000000000001 116.391 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -74.21 -31.76 62.76 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 118.114 -1.434 . . . . 87.0 110.333 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -65.19 -50.54 65.52 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.978 2.111 . . . . 100.0 109.359 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 27.1 mt -58.75 -44.82 90.63 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 106.272 -1.751 . . . . 43.009999999999998 106.272 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LEU . . . . . 0.43 ' CD2' ' CD2' ' A' ' 12' ' ' LEU . 7.6 mt -55.62 -41.76 73.95 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 114.433 -1.258 . . . . 45.780000000000001 109.94 178.302 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . 0.297 0.9 OUTLIER -64.85 -48.75 73.2 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 118.936 -1.106 . . . . 91.260000000000005 112.254 178.48 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -59.34 -50.94 72.05 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 115.982 1.845 . . . . 73.319999999999993 115.982 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . 0.274 8.7 m-85 -67.61 -46.4 72.66 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 114.715 -1.129 . . . . 100.0 112.723 -178.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -63.01 -39.95 96.3 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.367 -1.288 . . . . 50.140000000000001 108.892 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 14.0 mt -59.16 -47.21 86.15 Favored 'General case' 0 C--O 1.198 -1.618 0 CA-C-N 114.61 -1.177 . . . . 56.210000000000001 113.477 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -59.49 -37.74 79.04 Favored 'General case' 0 CA--C 1.492 -1.271 0 C-N-CA 123.722 0.809 . . . . 85.579999999999998 112.083 -179.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -68.51 -38.79 81.21 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.029 -1.441 . . . . 66.359999999999999 111.933 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -66.06 -43.26 87.93 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 115.326 -0.852 . . . . 54.009999999999998 111.915 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.4 t -67.48 -40.68 84.92 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 C-N-CA 125.917 1.687 . . . . 26.77 109.81 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.59 -49.5 72.61 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 113.986 -1.461 . . . . 37.240000000000002 108.461 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ARG . . . . . 0.443 ' CD ' ' NZ ' ' C' ' 27' ' ' LYS 0.262 0.0 OUTLIER -64.84 -43.52 92.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 126.407 2.317 . . . . 100.0 111.591 -179.274 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 81.7 mt -63.38 -27.11 69.08 Favored 'General case' 0 C--O 1.206 -1.208 0 C-N-CA 120.294 -0.563 . . . . 48.659999999999997 109.877 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -16.75 63.09 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 113.208 0.818 . . . . 91.739999999999995 113.208 -179.813 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -95.91 -45.06 7.1 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.911 -0.586 . . . . 100.0 111.111 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.46 25.51 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 112.686 0.624 . . . . 87.310000000000002 112.686 179.021 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' VAL . . . . . 0.459 ' CG1' ' N ' ' B' ' 31' ' ' GLY . 30.7 t -141.07 -107.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 126.204 1.802 . . . . 81.819999999999993 106.197 179.115 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLY . . . . . 0.459 ' N ' ' CG1' ' B' ' 30' ' ' VAL . . . -136.25 102.06 0.39 Allowed Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 108.925 -1.67 . . . . 95.709999999999994 108.925 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLU . . . . . 0.482 ' O ' ' C ' ' B' ' 33' ' ' ARG . 1.4 mt-10 -38.48 100.86 0.02 OUTLIER 'General case' 0 C--N 1.339 0.134 0 C-N-CA 126.662 1.985 . . . . 100.0 115.352 -179.259 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ARG . . . . . 0.482 ' C ' ' O ' ' B' ' 32' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 C-N-CA 125.0 1.32 . . . . 100.0 111.832 178.245 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 0' ' ' ACE . . . . . 0.564 ' O ' ' N ' ' C' ' 4' ' ' GLN . . . . . . . . 0 C--O 1.224 -0.249 . . . . . . . . 82.819999999999993 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' ARG . . . . . . . . . . . . 0.271 11.4 mmm180 -38.12 -71.29 0.08 Allowed 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.942 1.089 . . . . 100.0 113.942 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' MET . . . . . 0.448 ' SD ' ' N ' ' C' ' 2' ' ' MET 0.429 0.0 OUTLIER -81.07 -19.04 44.57 Favored 'General case' 0 C--O 1.251 1.14 0 CA-C-O 123.344 1.545 . . . . 94.840000000000003 113.266 178.495 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' LYS . . . . . . . . . . . . . 25.5 tttt -71.6 -23.59 61.75 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 103.958 -2.608 . . . . 100.0 103.958 175.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLN . . . . . 0.632 ' O ' ' N ' ' C' ' 7' ' ' ASP . 0.0 OUTLIER -69.94 -73.63 0.16 Allowed 'General case' 0 C--N 1.361 1.068 0 N-CA-C 106.355 -1.72 . . . . 100.0 106.355 177.18 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . 0.282 1.2 mt -48.96 -40.03 28.76 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 113.516 -1.674 . . . . 100.0 111.018 179.98 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -66.5 -3.5 6.37 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 119.014 -1.074 . . . . 100.0 110.638 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ASP . . . . . 0.632 ' N ' ' O ' ' C' ' 4' ' ' GLN . 0.5 OUTLIER -104.35 -35.84 7.8 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 114.504 -1.226 . . . . 100.0 110.023 179.16 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.23 -10.12 59.66 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 114.746 -1.116 . . . . 97.010000000000005 110.195 178.259 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 25.2 t -93.77 -21.17 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.935 0 N-CA-C 105.807 -1.923 . . . . 45.840000000000003 105.807 178.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . 0.259 0.0 OUTLIER -76.45 -29.16 56.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.28 -1.327 . . . . 100.0 111.883 -179.8 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -77.37 -36.56 53.48 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 108.778 -0.823 . . . . 100.0 108.778 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 83.0 mt -65.51 -35.85 82.11 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 122.805 1.288 . . . . 31.850000000000001 111.294 178.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -68.02 -39.74 83.09 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 120.904 -1.123 . . . . 33.159999999999997 108.522 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' SER . . . . . . . . . . . . . 35.6 t -70.87 -37.02 73.06 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 113.529 -1.669 . . . . 87.159999999999997 111.694 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 17.3 mttt -66.01 -45.04 82.96 Favored 'General case' 0 CA--C 1.5 -0.957 0 O-C-N 123.922 0.764 . . . . 95.280000000000001 110.73 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -59.58 -51.63 69.01 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.971 0.908 . . . . 33.82 110.017 178.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -65.37 -42.29 92.89 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.421 -1.425 . . . . 70.969999999999999 112.365 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.92 -40.83 85.74 Favored 'General case' 0 C--O 1.208 -1.123 0 C-N-CA 124.005 0.922 . . . . 33.82 109.392 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -64.65 -44.21 91.17 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 123.877 1.799 . . . . 79.900000000000006 111.07 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -59.45 -48.08 83.0 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 114.603 -1.18 . . . . 31.170000000000002 111.775 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -60.36 -49.34 77.99 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-O 123.992 1.853 . . . . 100.0 111.275 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 27.0 t -60.72 -35.65 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.66 0 C-N-CA 118.25 -1.38 . . . . 28.350000000000001 112.403 178.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.49 72.73 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 120.415 -1.428 . . . . 26.329999999999998 110.651 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ARG . . . . . . . . . . . . . 56.8 ttt-85 -55.48 -53.62 54.01 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 114.95 -1.023 . . . . 78.640000000000001 111.683 177.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 7.8 mt -58.64 -47.81 83.16 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-O 123.707 1.718 . . . . 34.869999999999997 112.4 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' LYS . . . . . 0.443 ' NZ ' ' CD ' ' B' ' 25' ' ' ARG . 15.1 tptt -45.64 -43.65 12.6 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 113.902 -1.499 . . . . 75.239999999999995 108.76 177.503 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -69.69 -49.0 57.69 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 124.569 1.147 . . . . 100.0 113.526 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 34.1 mt -64.62 -51.46 62.53 Favored 'General case' 0 C--O 1.21 -1.006 0 O-C-N 125.397 1.686 . . . . 46.850000000000001 111.72 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' VAL . . . . . 0.458 ' CG1' ' N ' ' C' ' 31' ' ' GLY . 2.6 t -49.94 -83.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 108.974 -0.75 . . . . 69.120000000000005 108.974 -179.911 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' GLY . . . . . 0.458 ' N ' ' CG1' ' C' ' 30' ' ' VAL . . . 64.21 123.82 0.01 OUTLIER Glycine 0 C--O 1.246 0.884 0 CA-C-O 122.763 1.202 . . . . 73.510000000000005 115.39 178.082 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' GLU . . . . . 0.518 ' O ' ' C ' ' C' ' 33' ' ' ARG . . . 169.88 -136.79 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 112.49 -1.855 . . . . 78.849999999999994 106.804 -179.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' ARG . . . . . 0.518 ' C ' ' O ' ' C' ' 32' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.327 0 O-C-N 124.214 0.946 . . . . 100.0 110.807 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' ACE . . . . . 0.679 ' O ' ' HG3' ' A' ' 4' ' ' GLN . . . . . . . . 0 C--O 1.228 -0.056 . . . . . . . . 63.01 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ARG . . . . . 0.566 ' CZ ' ' HG2' ' B' ' 2' ' ' MET . 1.1 ttt180 -40.71 -71.0 0.09 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.858 1.663 . . . . 100.0 110.684 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' MET . . . . . 0.524 ' HG3' ' CD ' ' A' ' 6' ' ' GLU . 6.2 tpp -48.33 -42.93 32.67 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 117.856 2.539 . . . . 65.24 117.856 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -35.34 80.59 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 115.972 -2.291 . . . . 60.82 107.911 179.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . 0.679 ' HG3' ' O ' ' A' ' 0' ' ' ACE . 50.2 mt-30 -65.44 -49.06 70.58 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 114.286 1.217 . . . . 100.0 114.286 -179.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . 0.54 HD22 ' HG2' ' B' ' 6' ' ' GLU . 1.3 tp -61.42 -60.05 4.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.934 0.873 . . . . 70.32 109.372 178.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . 0.524 ' CD ' ' HG3' ' A' ' 2' ' ' MET . 40.1 mt-10 -51.41 -32.32 25.98 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.125 -1.398 . . . . 100.0 109.673 178.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . 0.328 21.2 m-20 -80.04 -26.74 39.62 Favored 'General case' 0 C--O 1.244 0.803 0 C-N-CA 117.397 -1.721 . . . . 74.29 112.164 178.477 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' HG11 ' B' ' 9' ' ' VAL . 17.9 mtmt -73.57 -30.48 63.06 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 114.709 -1.132 . . . . 96.72 110.38 178.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 5' ' ' LEU . 22.0 t -73.49 -27.5 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 114.828 -1.078 . . . . 28.32 110.086 179.116 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.11 -38.02 32.45 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-O 122.476 1.132 . . . . 100.0 108.489 178.814 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 14' ' ' SER . 61.8 tt0 -54.08 -48.75 70.32 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 118.052 -1.459 . . . . 64.74 108.408 176.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . 0.981 HD21 HD23 ' B' ' 13' ' ' LEU . 77.3 mt -58.84 -46.33 87.95 Favored 'General case' 0 CA--C 1.509 -0.631 0 C-N-CA 125.531 1.533 . . . . 39.92 113.99 179.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . 0.863 HD23 HD21 ' C' ' 12' ' ' LEU . 13.9 mt -62.37 -39.75 94.19 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 123.589 1.661 . . . . 29.24 110.521 -179.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' A' ' 11' ' ' GLU . 29.7 t -56.44 -63.44 1.19 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 113.138 -1.846 . . . . 40.92 109.54 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . 0.422 ' HD2' ' OE2' ' B' ' 20' ' ' GLU 0.269 4.8 mmtt -57.0 -46.53 82.22 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.618 2.367 . . . . 75.89 114.457 178.782 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -61.47 -50.95 70.7 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 126.653 1.981 . . . . 64.68 110.342 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . 0.756 ' HB2' ' O ' ' A' ' 75' ' ' HOH . 60.1 t60 -57.81 -57.02 14.61 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.672 0.749 . . . . 74.02 109.939 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 52.1 mt -49.08 -47.21 45.29 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.514 1.526 . . . . 34.73 113.487 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.04 -42.11 89.46 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-O 122.927 1.346 . . . . 97.69 110.503 179.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -65.92 -52.25 51.58 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 113.43 -1.714 . . . . 33.38 110.557 -178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -54.39 -48.42 71.59 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 125.262 1.601 . . . . 98.37 111.432 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.1 t -60.21 -43.94 94.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 CA-C-O 118.304 -0.855 . . . . 23.71 110.322 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.47 83.57 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.309 1.044 . . . . 31.81 113.74 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -67.95 -42.62 80.66 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.071 1.748 . . . . 59.24 111.393 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 26' ' ' LEU . 2.0 mt -58.08 -30.46 66.25 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 125.452 1.501 . . . . 48.35 110.889 178.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.301 4.4 mtpp -83.48 -20.42 34.02 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 114.464 1.283 . . . . 51.89 114.464 178.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.0 mttt -82.96 -38.57 22.56 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 106.533 -1.654 . . . . 91.06 106.533 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.6 mt -63.34 -20.56 65.62 Favored 'General case' 0 C--O 1.222 -0.367 0 N-CA-C 114.847 1.425 . . . . 49.34 114.847 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -117.15 -1.54 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 122.801 1.286 . . . . 61.78 112.865 -176.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 83.67 -4.13 83.1 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 113.586 -1.643 . . . . 56.96 116.428 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . 0.581 ' CD ' HD13 ' C' ' 29' ' ' LEU . 54.1 mm-40 -76.49 146.72 38.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.561 0.578 . . . . 76.89 112.561 -179.778 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.611 0 N-CA-C 109.333 -0.617 . . . . 100.0 109.333 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.863 . . . . . . . . 100.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 51.0 mtt180 -48.41 -41.25 28.58 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 124.571 1.148 . . . . 100.0 111.694 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' MET . . . . . 0.566 ' HG2' ' CZ ' ' A' ' 1' ' ' ARG . 0.5 OUTLIER -59.21 -59.41 5.5 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 115.751 1.76 . . . . 80.9 115.751 -179.555 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LYS . . . . . 0.736 ' HA ' ' HE3' ' B' ' 3' ' ' LYS . 0.0 OUTLIER -52.85 -53.48 48.22 Favored 'General case' 0 CA--C 1.505 -0.75 0 O-C-N 125.226 1.579 . . . . 100.0 112.487 -179.833 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . 0.527 ' O ' ' HB2' ' B' ' 8' ' ' LYS . 0.0 OUTLIER -47.18 -47.26 24.05 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 124.964 1.415 . . . . 88.02 111.695 179.29 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . 0.706 HD13 ' O ' ' B' ' 52' ' ' HOH . 1.0 OUTLIER -65.43 -45.88 82.12 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.737 0.779 . . . . 62.65 109.484 -179.101 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . 0.547 ' HG3' ' O ' ' B' ' 2' ' ' MET . 5.2 mt-10 -70.63 -32.54 69.89 Favored 'General case' 0 N--CA 1.432 -1.362 0 C-N-CA 116.931 -1.908 . . . . 100.0 110.251 179.355 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ASP . . . . . 0.566 ' OD2' ' HG3' ' B' ' 3' ' ' LYS . 11.1 m-20 -56.75 -55.49 33.56 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 107.338 -1.356 . . . . 100.0 107.338 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LYS . . . . . 0.636 ' HG2' HG11 ' C' ' 9' ' ' VAL . 0.0 OUTLIER -44.73 -54.63 6.07 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 111.012 -2.813 . . . . 83.02 112.78 178.726 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 9' ' ' VAL . . . . . 0.433 HG11 ' HB3' ' A' ' 8' ' ' LYS . 55.6 t -63.86 -33.29 61.09 Favored 'Isoleucine or valine' 0 C--O 1.244 0.78 0 C-N-CA 127.467 2.307 . . . . 40.28 116.391 -177.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -74.21 -31.76 62.76 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 118.114 -1.434 . . . . 87.0 110.333 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -65.19 -50.54 65.52 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.978 2.111 . . . . 100.0 109.359 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . 0.566 HD21 HD23 ' C' ' 13' ' ' LEU . 27.1 mt -58.75 -44.82 90.63 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 106.272 -1.751 . . . . 43.01 106.272 177.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LEU . . . . . 0.981 HD23 HD21 ' A' ' 12' ' ' LEU . 7.6 mt -55.62 -41.76 73.95 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 114.433 -1.258 . . . . 45.78 109.94 178.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . 0.297 0.9 OUTLIER -64.85 -48.75 73.2 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 118.936 -1.106 . . . . 91.26 112.254 178.48 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -59.34 -50.94 72.05 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 115.982 1.845 . . . . 73.32 115.982 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ABA . . . . . 0.445 ' O ' ' HG3' ' B' ' 20' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . 0.274 8.7 m-85 -67.61 -46.4 72.66 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 114.715 -1.129 . . . . 100.0 112.723 -178.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -63.01 -39.95 96.3 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.367 -1.288 . . . . 50.14 108.892 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' B' ' 19' ' ' LEU . 14.0 mt -59.16 -47.21 86.15 Favored 'General case' 0 C--O 1.198 -1.618 0 CA-C-N 114.61 -1.177 . . . . 56.21 113.477 -179.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' B' ' 16' ' ' ABA . 59.9 mt-10 -59.49 -37.74 79.04 Favored 'General case' 0 CA--C 1.492 -1.271 0 C-N-CA 123.722 0.809 . . . . 85.58 112.083 -179.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -68.51 -38.79 81.21 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.029 -1.441 . . . . 66.36 111.933 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLU . . . . . 0.696 ' OE1' ' HE2' ' C' ' 27' ' ' LYS . 28.1 mm-40 -66.06 -43.26 87.93 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 115.326 -0.852 . . . . 54.01 111.915 178.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.4 t -67.48 -40.68 84.92 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 C-N-CA 125.917 1.687 . . . . 26.77 109.81 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.59 -49.5 72.61 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 113.986 -1.461 . . . . 37.24 108.461 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ARG . . . . . 0.588 ' HD3' ' NZ ' ' C' ' 27' ' ' LYS 0.262 0.0 OUTLIER -64.84 -43.52 92.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 126.407 2.317 . . . . 100.0 111.591 -179.274 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . 1.0 HD21 ' HD2' ' C' ' 27' ' ' LYS . 81.7 mt -63.38 -27.11 69.08 Favored 'General case' 0 C--O 1.206 -1.208 0 C-N-CA 120.294 -0.563 . . . . 48.66 109.877 176.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -16.75 63.09 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 113.208 0.818 . . . . 91.74 113.208 -179.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . 0.556 ' C ' ' H ' ' B' ' 30' ' ' VAL . 2.8 mtmp? -95.91 -45.06 7.1 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.911 -0.586 . . . . 100.0 111.111 178.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LEU . . . . . 1.006 HD22 ' HD3' ' C' ' 33' ' ' ARG . 0.8 OUTLIER -67.46 25.51 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 112.686 0.624 . . . . 87.31 112.686 179.021 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 30' ' ' VAL . . . . . 0.644 HG12 ' N ' ' B' ' 31' ' ' GLY . 30.7 t -141.07 -107.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 126.204 1.802 . . . . 81.82 106.197 179.115 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLY . . . . . 0.644 ' N ' HG12 ' B' ' 30' ' ' VAL . . . -136.25 102.06 0.39 Allowed Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 108.925 -1.67 . . . . 95.71 108.925 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLU . . . . . 0.482 ' O ' ' C ' ' B' ' 33' ' ' ARG . 1.4 mt-10 -38.48 100.86 0.02 OUTLIER 'General case' 0 C--N 1.339 0.134 0 C-N-CA 126.662 1.985 . . . . 100.0 115.352 -179.259 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ARG . . . . . 0.597 ' N ' ' HD3' ' B' ' 33' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 C-N-CA 125.0 1.32 . . . . 100.0 111.832 178.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 0' ' ' ACE . . . . . 0.768 ' CH3' ' HB3' ' C' ' 3' ' ' LYS . . . . . . . . 0 C--O 1.224 -0.249 . . . . . . . . 82.82 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 1' ' ' ARG . . . . . . . . . . . . 0.271 11.4 mmm180 -38.12 -71.29 0.08 Allowed 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.942 1.089 . . . . 100.0 113.942 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 2' ' ' MET . . . . . 0.515 ' O ' ' HB2' ' C' ' 6' ' ' GLU 0.429 0.0 OUTLIER -81.07 -19.04 44.57 Favored 'General case' 0 C--O 1.251 1.14 0 CA-C-O 123.344 1.545 . . . . 94.84 113.266 178.495 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' C' C ' 3' ' ' LYS . . . . . 0.768 ' HB3' ' CH3' ' C' ' 0' ' ' ACE . 25.5 tttt -71.6 -23.59 61.75 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 103.958 -2.608 . . . . 100.0 103.958 175.743 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLN . . . . . 0.62 ' HB2' ' O ' ' C' ' 0' ' ' ACE . 2.1 tt0 -69.94 -73.63 0.16 Allowed 'General case' 0 C--N 1.361 1.068 0 N-CA-C 106.355 -1.72 . . . . 100.0 106.355 177.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 5' ' ' LEU . . . . . 0.689 ' HB3' HD21 ' B' ' 5' ' ' LEU 0.282 1.2 mt -48.96 -40.03 28.76 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 113.516 -1.674 . . . . 100.0 111.018 179.98 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 6' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' C' ' 2' ' ' MET . 7.6 tt0 -66.5 -3.5 6.37 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 119.014 -1.074 . . . . 100.0 110.638 178.091 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ASP . . . . . 0.579 ' N ' ' O ' ' C' ' 4' ' ' GLN . 0.5 OUTLIER -104.35 -35.84 7.8 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 114.504 -1.226 . . . . 100.0 110.023 179.16 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 8' ' ' LYS . . . . . 0.704 ' HE3' HD11 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -81.23 -10.12 59.66 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 114.746 -1.116 . . . . 97.01 110.195 178.259 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 9' ' ' VAL . . . . . 0.636 HG11 ' HG2' ' B' ' 8' ' ' LYS . 25.2 t -93.77 -21.17 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.935 0 N-CA-C 105.807 -1.923 . . . . 45.84 105.807 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . 0.259 0.0 OUTLIER -76.45 -29.16 56.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.28 -1.327 . . . . 100.0 111.883 -179.8 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -77.37 -36.56 53.48 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 108.778 -0.823 . . . . 100.0 108.778 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' LEU . . . . . 0.863 HD21 HD23 ' A' ' 13' ' ' LEU . 83.0 mt -65.51 -35.85 82.11 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 122.805 1.288 . . . . 31.85 111.294 178.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 13' ' ' LEU . . . . . 0.566 HD23 HD21 ' B' ' 12' ' ' LEU . 49.1 mt -68.02 -39.74 83.09 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 120.904 -1.123 . . . . 33.16 108.522 -178.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 14' ' ' SER . . . . . . . . . . . . . 35.6 t -70.87 -37.02 73.06 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 113.529 -1.669 . . . . 87.16 111.694 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 17.3 mttt -66.01 -45.04 82.96 Favored 'General case' 0 CA--C 1.5 -0.957 0 O-C-N 123.922 0.764 . . . . 95.28 110.73 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 17' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -59.58 -51.63 69.01 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.971 0.908 . . . . 33.82 110.017 178.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -65.37 -42.29 92.89 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.421 -1.425 . . . . 70.97 112.365 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.92 -40.83 85.74 Favored 'General case' 0 C--O 1.208 -1.123 0 C-N-CA 124.005 0.922 . . . . 33.82 109.392 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -64.65 -44.21 91.17 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 123.877 1.799 . . . . 79.9 111.07 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -59.45 -48.08 83.0 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 114.603 -1.18 . . . . 31.17 111.775 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -60.36 -49.34 77.99 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-O 123.992 1.853 . . . . 100.0 111.275 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' C' ' 27' ' ' LYS . 27.0 t -60.72 -35.65 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.66 0 C-N-CA 118.25 -1.38 . . . . 28.35 112.403 178.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.49 72.73 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 120.415 -1.428 . . . . 26.33 110.651 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ARG . . . . . . . . . . . . . 56.8 ttt-85 -55.48 -53.62 54.01 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 114.95 -1.023 . . . . 78.64 111.683 177.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' C' ' 26' ' ' LEU . 7.8 mt -58.64 -47.81 83.16 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-O 123.707 1.718 . . . . 34.87 112.4 -179.759 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 27' ' ' LYS . . . . . 1.0 ' HD2' HD21 ' B' ' 26' ' ' LEU . 15.1 tptt -45.64 -43.65 12.6 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 113.902 -1.499 . . . . 75.24 108.76 177.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -69.69 -49.0 57.69 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 124.569 1.147 . . . . 100.0 113.526 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' LEU . . . . . 0.581 HD13 ' CD ' ' A' ' 32' ' ' GLU . 34.1 mt -64.62 -51.46 62.53 Favored 'General case' 0 C--O 1.21 -1.006 0 O-C-N 125.397 1.686 . . . . 46.85 111.72 -178.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 30' ' ' VAL . . . . . 0.673 HG12 ' N ' ' C' ' 31' ' ' GLY . 2.6 t -49.94 -83.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 108.974 -0.75 . . . . 69.12 108.974 -179.911 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 31' ' ' GLY . . . . . 0.673 ' N ' HG12 ' C' ' 30' ' ' VAL . . . 64.21 123.82 0.01 OUTLIER Glycine 0 C--O 1.246 0.884 0 CA-C-O 122.763 1.202 . . . . 73.51 115.39 178.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 32' ' ' GLU . . . . . 0.518 ' O ' ' C ' ' C' ' 33' ' ' ARG . . . 169.88 -136.79 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 112.49 -1.855 . . . . 78.85 106.804 -179.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 33' ' ' ARG . . . . . 1.006 ' HD3' HD22 ' B' ' 29' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.327 0 O-C-N 124.214 0.946 . . . . 100.0 110.807 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 75' ' ' HOH . . . . . 0.756 ' O ' ' HB2' ' A' ' 18' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 52' ' ' HOH . . . . . 0.706 ' O ' HD13 ' B' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.679 ' O ' ' HG3' ' A' ' 4' ' ' GLN . . . . . . . . 0 C--O 1.228 -0.056 . . . . . . . . 63.009999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.566 ' CZ ' ' HG2' ' B' ' 2' ' ' MET . 1.1 ttt180 -40.71 -71.0 0.09 Allowed 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.858 1.663 . . . . 100.0 110.684 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' MET . . . . . 0.524 ' HG3' ' CD ' ' A' ' 6' ' ' GLU . 6.2 tpp -48.33 -42.93 32.67 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 117.856 2.539 . . . . 65.239999999999995 117.856 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.49 -35.34 80.59 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 115.972 -2.291 . . . . 60.82 107.911 179.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.679 ' HG3' ' O ' ' A' ' 0' ' ' ACE . 50.2 mt-30 -65.44 -49.06 70.58 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 114.286 1.217 . . . . 100.0 114.286 -179.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.54 HD22 ' HG2' ' B' ' 6' ' ' GLU . 1.3 tp -61.42 -60.05 4.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.934 0.873 . . . . 70.319999999999993 109.372 178.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.524 ' CD ' ' HG3' ' A' ' 2' ' ' MET . 40.1 mt-10 -51.41 -32.32 25.98 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.125 -1.398 . . . . 100.0 109.673 178.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . 0.328 21.2 m-20 -80.04 -26.74 39.62 Favored 'General case' 0 C--O 1.244 0.803 0 C-N-CA 117.397 -1.721 . . . . 74.290000000000006 112.164 178.477 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' HG11 ' B' ' 9' ' ' VAL . 17.9 mtmt -73.57 -30.48 63.06 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 114.709 -1.132 . . . . 96.719999999999999 110.38 178.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 5' ' ' LEU . 22.0 t -73.49 -27.5 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 114.828 -1.078 . . . . 28.32 110.086 179.116 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.11 -38.02 32.45 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-O 122.476 1.132 . . . . 100.0 108.489 178.814 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 14' ' ' SER . 61.8 tt0 -54.08 -48.75 70.32 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 118.052 -1.459 . . . . 64.739999999999995 108.408 176.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.981 HD21 HD23 ' B' ' 13' ' ' LEU . 77.3 mt -58.84 -46.33 87.95 Favored 'General case' 0 CA--C 1.509 -0.631 0 C-N-CA 125.531 1.533 . . . . 39.920000000000002 113.99 179.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.863 HD23 HD21 ' C' ' 12' ' ' LEU . 13.9 mt -62.37 -39.75 94.19 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 123.589 1.661 . . . . 29.239999999999998 110.521 -179.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' A' ' 11' ' ' GLU . 29.7 t -56.44 -63.44 1.19 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 113.138 -1.846 . . . . 40.920000000000002 109.54 178.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.422 ' HD2' ' OE2' ' B' ' 20' ' ' GLU 0.269 4.8 mmtt -57.0 -46.53 82.22 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.618 2.367 . . . . 75.890000000000001 114.457 178.782 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -61.47 -50.95 70.7 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 126.653 1.981 . . . . 64.680000000000007 110.342 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.756 ' HB2' ' O ' ' A' ' 75' ' ' HOH . 60.1 t60 -57.81 -57.02 14.61 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.672 0.749 . . . . 74.019999999999996 109.939 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 52.1 mt -49.08 -47.21 45.29 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.514 1.526 . . . . 34.729999999999997 113.487 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.04 -42.11 89.46 Favored 'General case' 0 N--CA 1.433 -1.285 0 CA-C-O 122.927 1.346 . . . . 97.689999999999998 110.503 179.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -65.92 -52.25 51.58 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 113.43 -1.714 . . . . 33.380000000000003 110.557 -178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -54.39 -48.42 71.59 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 125.262 1.601 . . . . 98.370000000000005 111.432 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.1 t -60.21 -43.94 94.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 CA-C-O 118.304 -0.855 . . . . 23.710000000000001 110.322 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.47 83.57 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.309 1.044 . . . . 31.809999999999999 113.74 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.9 ttt85 -67.95 -42.62 80.66 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.071 1.748 . . . . 59.240000000000002 111.393 179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 26' ' ' LEU . 2.0 mt -58.08 -30.46 66.25 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 125.452 1.501 . . . . 48.350000000000001 110.889 178.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . 0.301 4.4 mtpp -83.48 -20.42 34.02 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 114.464 1.283 . . . . 51.890000000000001 114.464 178.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 36.0 mttt -82.96 -38.57 22.56 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 106.533 -1.654 . . . . 91.060000000000002 106.533 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.6 mt -63.34 -20.56 65.62 Favored 'General case' 0 C--O 1.222 -0.367 0 N-CA-C 114.847 1.425 . . . . 49.340000000000003 114.847 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.2 t -117.15 -1.54 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.243 0 CA-C-O 122.801 1.286 . . . . 61.780000000000001 112.865 -176.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 83.67 -4.13 83.1 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 113.586 -1.643 . . . . 56.960000000000001 116.428 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.581 ' CD ' HD13 ' C' ' 29' ' ' LEU . 54.1 mm-40 -76.49 146.72 38.31 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.561 0.578 . . . . 76.890000000000001 112.561 -179.778 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.611 0 N-CA-C 109.333 -0.617 . . . . 100.0 109.333 178.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.863 . . . . . . . . 100.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 51.0 mtt180 -48.41 -41.25 28.58 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 124.571 1.148 . . . . 100.0 111.694 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' MET . . . . . 0.566 ' HG2' ' CZ ' ' A' ' 1' ' ' ARG . 0.5 OUTLIER -59.21 -59.41 5.5 Favored 'General case' 0 C--N 1.347 0.489 0 N-CA-C 115.751 1.76 . . . . 80.900000000000006 115.751 -179.555 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LYS . . . . . 0.736 ' HA ' ' HE3' ' B' ' 3' ' ' LYS . 0.0 OUTLIER -52.85 -53.48 48.22 Favored 'General case' 0 CA--C 1.505 -0.75 0 O-C-N 125.226 1.579 . . . . 100.0 112.487 -179.833 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . 0.527 ' O ' ' HB2' ' B' ' 8' ' ' LYS . 0.0 OUTLIER -47.18 -47.26 24.05 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 124.964 1.415 . . . . 88.019999999999996 111.695 179.29 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.706 HD13 ' O ' ' B' ' 52' ' ' HOH . 1.0 OUTLIER -65.43 -45.88 82.12 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.737 0.779 . . . . 62.649999999999999 109.484 -179.101 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . 0.547 ' HG3' ' O ' ' B' ' 2' ' ' MET . 5.2 mt-10 -70.63 -32.54 69.89 Favored 'General case' 0 N--CA 1.432 -1.362 0 C-N-CA 116.931 -1.908 . . . . 100.0 110.251 179.355 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ASP . . . . . 0.566 ' OD2' ' HG3' ' B' ' 3' ' ' LYS . 11.1 m-20 -56.75 -55.49 33.56 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 107.338 -1.356 . . . . 100.0 107.338 179.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.636 ' HG2' HG11 ' C' ' 9' ' ' VAL . 0.0 OUTLIER -44.73 -54.63 6.07 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 111.012 -2.813 . . . . 83.019999999999996 112.78 178.726 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' VAL . . . . . 0.433 HG11 ' HB3' ' A' ' 8' ' ' LYS . 55.6 t -63.86 -33.29 61.09 Favored 'Isoleucine or valine' 0 C--O 1.244 0.78 0 C-N-CA 127.467 2.307 . . . . 40.280000000000001 116.391 -177.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -74.21 -31.76 62.76 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 118.114 -1.434 . . . . 87.0 110.333 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -65.19 -50.54 65.52 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.978 2.111 . . . . 100.0 109.359 177.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . 0.566 HD21 HD23 ' C' ' 13' ' ' LEU . 27.1 mt -58.75 -44.82 90.63 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 106.272 -1.751 . . . . 43.009999999999998 106.272 177.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.981 HD23 HD21 ' A' ' 12' ' ' LEU . 7.6 mt -55.62 -41.76 73.95 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-N 114.433 -1.258 . . . . 45.780000000000001 109.94 178.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . 0.297 0.9 OUTLIER -64.85 -48.75 73.2 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 118.936 -1.106 . . . . 91.260000000000005 112.254 178.48 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -59.34 -50.94 72.05 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 115.982 1.845 . . . . 73.319999999999993 115.982 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ABA . . . . . 0.445 ' O ' ' HG3' ' B' ' 20' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . 0.274 8.7 m-85 -67.61 -46.4 72.66 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 114.715 -1.129 . . . . 100.0 112.723 -178.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -63.01 -39.95 96.3 Favored 'General case' 0 N--CA 1.441 -0.898 0 CA-C-N 114.367 -1.288 . . . . 50.140000000000001 108.892 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' B' ' 19' ' ' LEU . 14.0 mt -59.16 -47.21 86.15 Favored 'General case' 0 C--O 1.198 -1.618 0 CA-C-N 114.61 -1.177 . . . . 56.210000000000001 113.477 -179.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' B' ' 16' ' ' ABA . 59.9 mt-10 -59.49 -37.74 79.04 Favored 'General case' 0 CA--C 1.492 -1.271 0 C-N-CA 123.722 0.809 . . . . 85.579999999999998 112.083 -179.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -68.51 -38.79 81.21 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.029 -1.441 . . . . 66.359999999999999 111.933 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLU . . . . . 0.696 ' OE1' ' HE2' ' C' ' 27' ' ' LYS . 28.1 mm-40 -66.06 -43.26 87.93 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 115.326 -0.852 . . . . 54.009999999999998 111.915 178.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.4 t -67.48 -40.68 84.92 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 C-N-CA 125.917 1.687 . . . . 26.77 109.81 179.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.59 -49.5 72.61 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 113.986 -1.461 . . . . 37.240000000000002 108.461 -179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ARG . . . . . 0.588 ' HD3' ' NZ ' ' C' ' 27' ' ' LYS 0.262 0.0 OUTLIER -64.84 -43.52 92.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 126.407 2.317 . . . . 100.0 111.591 -179.274 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . 1.0 HD21 ' HD2' ' C' ' 27' ' ' LYS . 81.7 mt -63.38 -27.11 69.08 Favored 'General case' 0 C--O 1.206 -1.208 0 C-N-CA 120.294 -0.563 . . . . 48.659999999999997 109.877 176.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -16.75 63.09 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 113.208 0.818 . . . . 91.739999999999995 113.208 -179.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.556 ' C ' ' H ' ' B' ' 30' ' ' VAL . 2.8 mtmp? -95.91 -45.06 7.1 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.911 -0.586 . . . . 100.0 111.111 178.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LEU . . . . . 1.006 HD22 ' HD3' ' C' ' 33' ' ' ARG . 0.8 OUTLIER -67.46 25.51 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 112.686 0.624 . . . . 87.310000000000002 112.686 179.021 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.644 HG12 ' N ' ' B' ' 31' ' ' GLY . 30.7 t -141.07 -107.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 126.204 1.802 . . . . 81.819999999999993 106.197 179.115 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLY . . . . . 0.644 ' N ' HG12 ' B' ' 30' ' ' VAL . . . -136.25 102.06 0.39 Allowed Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 108.925 -1.67 . . . . 95.709999999999994 108.925 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.482 ' O ' ' C ' ' B' ' 33' ' ' ARG . 1.4 mt-10 -38.48 100.86 0.02 OUTLIER 'General case' 0 C--N 1.339 0.134 0 C-N-CA 126.662 1.985 . . . . 100.0 115.352 -179.259 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ARG . . . . . 0.597 ' HD3' ' N ' ' B' ' 33' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 C-N-CA 125.0 1.32 . . . . 100.0 111.832 178.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 0' ' ' ACE . . . . . 0.768 ' CH3' ' HB3' ' C' ' 3' ' ' LYS . . . . . . . . 0 C--O 1.224 -0.249 . . . . . . . . 82.819999999999993 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' ARG . . . . . . . . . . . . 0.271 11.4 mmm180 -38.12 -71.29 0.08 Allowed 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 113.942 1.089 . . . . 100.0 113.942 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' MET . . . . . 0.515 ' O ' ' HB2' ' C' ' 6' ' ' GLU 0.429 0.0 OUTLIER -81.07 -19.04 44.57 Favored 'General case' 0 C--O 1.251 1.14 0 CA-C-O 123.344 1.545 . . . . 94.840000000000003 113.266 178.495 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' LYS . . . . . 0.768 ' HB3' ' CH3' ' C' ' 0' ' ' ACE . 25.5 tttt -71.6 -23.59 61.75 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 103.958 -2.608 . . . . 100.0 103.958 175.743 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLN . . . . . 0.62 ' HB2' ' O ' ' C' ' 0' ' ' ACE . 0.0 OUTLIER -69.94 -73.63 0.16 Allowed 'General case' 0 C--N 1.361 1.068 0 N-CA-C 106.355 -1.72 . . . . 100.0 106.355 177.18 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' LEU . . . . . 0.689 ' HB3' HD21 ' B' ' 5' ' ' LEU 0.282 1.2 mt -48.96 -40.03 28.76 Favored 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 113.516 -1.674 . . . . 100.0 111.018 179.98 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' C' ' 2' ' ' MET . 7.6 tt0 -66.5 -3.5 6.37 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 119.014 -1.074 . . . . 100.0 110.638 178.091 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ASP . . . . . 0.579 ' N ' ' O ' ' C' ' 4' ' ' GLN . 0.5 OUTLIER -104.35 -35.84 7.8 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 114.504 -1.226 . . . . 100.0 110.023 179.16 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' LYS . . . . . 0.704 ' HE3' HD11 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -81.23 -10.12 59.66 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 114.746 -1.116 . . . . 97.010000000000005 110.195 178.259 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' VAL . . . . . 0.636 HG11 ' HG2' ' B' ' 8' ' ' LYS . 25.2 t -93.77 -21.17 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.935 0 N-CA-C 105.807 -1.923 . . . . 45.840000000000003 105.807 178.442 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' GLU . . . . . . . . . . . . 0.259 0.0 OUTLIER -76.45 -29.16 56.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.28 -1.327 . . . . 100.0 111.883 -179.8 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -77.37 -36.56 53.48 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 108.778 -0.823 . . . . 100.0 108.778 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.863 HD21 HD23 ' A' ' 13' ' ' LEU . 83.0 mt -65.51 -35.85 82.11 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 122.805 1.288 . . . . 31.850000000000001 111.294 178.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' LEU . . . . . 0.566 HD23 HD21 ' B' ' 12' ' ' LEU . 49.1 mt -68.02 -39.74 83.09 Favored 'General case' 0 CA--C 1.497 -1.09 0 O-C-N 120.904 -1.123 . . . . 33.159999999999997 108.522 -178.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' SER . . . . . . . . . . . . . 35.6 t -70.87 -37.02 73.06 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 113.529 -1.669 . . . . 87.159999999999997 111.694 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 17.3 mttt -66.01 -45.04 82.96 Favored 'General case' 0 CA--C 1.5 -0.957 0 O-C-N 123.922 0.764 . . . . 95.280000000000001 110.73 179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -59.58 -51.63 69.01 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.971 0.908 . . . . 33.82 110.017 178.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -65.37 -42.29 92.89 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 120.421 -1.425 . . . . 70.969999999999999 112.365 178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.92 -40.83 85.74 Favored 'General case' 0 C--O 1.208 -1.123 0 C-N-CA 124.005 0.922 . . . . 33.82 109.392 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -64.65 -44.21 91.17 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 123.877 1.799 . . . . 79.900000000000006 111.07 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -59.45 -48.08 83.0 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-N 114.603 -1.18 . . . . 31.170000000000002 111.775 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -60.36 -49.34 77.99 Favored 'General case' 0 C--N 1.347 0.495 0 CA-C-O 123.992 1.853 . . . . 100.0 111.275 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' C' ' 27' ' ' LYS . 27.0 t -60.72 -35.65 65.57 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.66 0 C-N-CA 118.25 -1.38 . . . . 28.350000000000001 112.403 178.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.49 72.73 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 120.415 -1.428 . . . . 26.329999999999998 110.651 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ARG . . . . . . . . . . . . . 56.8 ttt-85 -55.48 -53.62 54.01 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 114.95 -1.023 . . . . 78.640000000000001 111.683 177.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' C' ' 26' ' ' LEU . 7.8 mt -58.64 -47.81 83.16 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-O 123.707 1.718 . . . . 34.869999999999997 112.4 -179.759 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' LYS . . . . . 1.0 ' HD2' HD21 ' B' ' 26' ' ' LEU . 15.1 tptt -45.64 -43.65 12.6 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 113.902 -1.499 . . . . 75.239999999999995 108.76 177.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 39.5 mttt -69.69 -49.0 57.69 Favored 'General case' 0 CA--C 1.505 -0.773 0 C-N-CA 124.569 1.147 . . . . 100.0 113.526 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' LEU . . . . . 0.581 HD13 ' CD ' ' A' ' 32' ' ' GLU . 34.1 mt -64.62 -51.46 62.53 Favored 'General case' 0 C--O 1.21 -1.006 0 O-C-N 125.397 1.686 . . . . 46.850000000000001 111.72 -178.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' VAL . . . . . 0.673 HG12 ' N ' ' C' ' 31' ' ' GLY . 2.6 t -49.94 -83.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 108.974 -0.75 . . . . 69.120000000000005 108.974 -179.911 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' GLY . . . . . 0.673 ' N ' HG12 ' C' ' 30' ' ' VAL . . . 64.21 123.82 0.01 OUTLIER Glycine 0 C--O 1.246 0.884 0 CA-C-O 122.763 1.202 . . . . 73.510000000000005 115.39 178.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' GLU . . . . . 0.518 ' O ' ' C ' ' C' ' 33' ' ' ARG . . . 169.88 -136.79 0.0 OUTLIER 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 112.49 -1.855 . . . . 78.849999999999994 106.804 -179.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' ARG . . . . . 1.006 ' HD3' HD22 ' B' ' 29' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.327 0 O-C-N 124.214 0.946 . . . . 100.0 110.807 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' HOH . . . . . 0.756 ' O ' ' HB2' ' A' ' 18' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' HOH . . . . . 0.706 ' O ' HD13 ' B' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_