data_3w93_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 3w93 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 72.8 mtp180 . . . . . 0 N--CA 1.428 -1.563 0 N-CA-C 113.893 1.072 . . . . 35.490000000000002 113.893 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.9 t -69.09 -39.09 79.08 Favored 'Isoleucine or valine' 0 C--O 1.268 2.057 0 O-C-N 121.416 -0.802 . . . . 24.559999999999999 111.659 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.13 -42.16 98.96 Favored 'General case' 0 C--O 1.256 1.397 0 O-C-N 120.901 -1.125 . . . . 23.870000000000001 109.871 176.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 90.2 mtm-85 -65.94 -39.95 90.94 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 118.213 -1.395 . . . . 28.609999999999999 110.572 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.7 mt -61.05 -40.86 95.22 Favored 'General case' 0 CA--C 1.483 -1.622 0 O-C-N 120.354 -1.466 . . . . 28.66 111.952 175.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -58.57 -39.39 80.15 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-O 122.131 0.967 . . . . 25.050000000000001 111.503 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -70.63 -37.59 73.8 Favored 'General case' 0 C--O 1.256 1.397 0 O-C-N 120.688 -1.258 . . . . 49.710000000000001 112.129 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -64.78 -41.36 95.9 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.777 0.673 . . . . 39.689999999999998 111.723 175.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.3 t -64.52 -45.25 96.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 124.282 0.989 . . . . 21.379999999999999 111.653 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 29.8 t -59.45 -39.18 82.77 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 121.21 -0.931 . . . . 32.899999999999999 112.785 176.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.39 -42.89 87.25 Favored 'General case' 0 CA--C 1.554 1.103 0 CA-C-O 122.293 1.045 . . . . 22.75 109.062 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.2 mt -62.27 -41.27 98.33 Favored 'General case' 0 C--O 1.269 2.082 0 O-C-N 121.756 -0.59 . . . . 20.289999999999999 111.671 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -58.54 -39.02 79.03 Favored 'General case' 0 C--O 1.257 1.463 0 O-C-N 122.025 -0.422 . . . . 33.149999999999999 110.417 178.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -73.27 -34.85 66.02 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.409 -0.589 . . . . 44.719999999999999 109.409 -174.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -73.06 -40.65 64.89 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 116.236 -0.438 . . . . 36.109999999999999 112.155 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.5 t -68.53 -37.5 77.82 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.581 0 N-CA-C 112.46 0.541 . . . . 22.09 112.46 -178.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.484 0 N-CA-C 107.247 -1.39 . . . . 29.309999999999999 107.247 173.953 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GOA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.507 2.404 0 N-CA-C 108.42 -0.956 . . . . 26.899999999999999 108.42 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -58.85 -41.56 87.28 Favored 'General case' 0 C--O 1.209 -1.032 0 C-N-CA 118.098 -1.441 . . . . 37.479999999999997 113.841 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -67.0 -41.38 86.81 Favored 'General case' 0 C--O 1.252 1.211 0 N-CA-C 109.421 -0.585 . . . . 50.68 109.421 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -64.41 -41.81 96.42 Favored 'General case' 0 C--O 1.263 1.806 0 C-N-CA 120.659 -0.417 . . . . 45.149999999999999 111.336 -177.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.4 t -65.36 -40.92 89.97 Favored 'Isoleucine or valine' 0 C--O 1.249 1.027 0 O-C-N 123.764 0.665 . . . . 21.620000000000001 110.363 178.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.26 -38.95 88.55 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 120.239 -0.584 . . . . 25.73 111.22 176.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 63.0 ttt-85 -68.43 -38.39 81.15 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.048 -1.657 . . . . 58.899999999999999 112.803 177.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.02 -38.7 82.89 Favored 'General case' 0 CA--C 1.482 -1.667 0 C-N-CA 119.388 -0.925 . . . . 24.699999999999999 110.952 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -58.01 -41.79 83.84 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 118.71 -1.196 . . . . 41.590000000000003 111.594 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . 0.583 ' NZ ' ' O ' ' A' ' 520' ' ' HOH . 22.8 mmtm -64.94 -35.9 82.65 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 117.172 -1.811 . . . . 43.82 113.648 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 76.7 mt -72.44 -42.79 64.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 O-C-N 120.733 -1.229 . . . . 32.82 107.92 -174.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.9 t -71.89 -42.15 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 122.695 1.236 . . . . 25.82 112.03 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 83.07 -168.98 47.59 Favored Glycine 0 N--CA 1.428 -1.844 0 CA-C-N 114.887 -1.051 . . . . 25.579999999999998 112.707 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 . . . . . 0 C--O 1.292 3.317 0 CA-C-O 117.693 -1.146 . . . . 57.189999999999998 110.921 -172.458 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 . . . . . 0 N--CA 1.513 2.708 0 N-CA-C 108.242 -1.022 . . . . 50.75 108.242 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 71.7 t -68.3 -42.52 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 115.559 -0.746 . . . . 38.329999999999998 111.426 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.77 -41.13 77.1 Favored 'General case' 0 C--O 1.208 -1.129 0 N-CA-C 114.99 1.478 . . . . 37.18 114.99 174.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -64.83 -40.46 95.21 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 122.959 1.361 . . . . 54.880000000000003 112.684 176.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 12.8 mt -66.81 -42.38 86.01 Favored 'General case' 0 C--O 1.249 1.051 0 CA-C-N 114.414 -1.266 . . . . 31.859999999999999 111.498 175.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -53.89 -40.85 66.98 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.324 1.231 . . . . 30.23 114.324 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -65.27 -42.44 93.21 Favored 'General case' 0 CA--C 1.552 1.045 0 O-C-N 124.078 0.861 . . . . 48.520000000000003 109.758 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -63.82 -45.89 87.56 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.759 -1.11 . . . . 38.100000000000001 111.028 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 32.9 t -64.59 -41.6 92.72 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-N 115.91 -0.586 . . . . 18.329999999999998 111.757 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' SER . . . . . 0.544 ' OG ' ' NZ ' ' B' ' 14' ' ' LYS . 43.1 t -57.12 -45.55 83.36 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.863 -0.791 . . . . 34.049999999999997 108.863 175.416 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.37 -40.14 96.43 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 108.585 -0.894 . . . . 23.02 108.585 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 41.8 mt -67.05 -42.28 85.07 Favored 'General case' 0 N--CA 1.438 -1.07 0 O-C-N 119.417 -2.052 . . . . 20.02 110.562 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -57.46 -39.17 75.76 Favored 'General case' 0 C--O 1.205 -1.237 0 O-C-N 120.937 -1.102 . . . . 31.120000000000001 109.955 -179.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LYS . . . . . 0.544 ' NZ ' ' OG ' ' B' ' 10' ' ' SER . 59.3 mttp -65.38 -44.05 88.78 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 125.338 1.649 . . . . 38.270000000000003 110.365 179.903 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -68.01 -35.03 77.63 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 120.885 0.374 . . . . 37.700000000000003 110.406 -178.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 25.3 t -76.54 -32.03 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.291 0 O-C-N 119.697 -1.877 . . . . 22.420000000000002 110.534 -176.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.556 1.205 0 N-CA-C 108.216 -1.031 . . . . 26.649999999999999 108.216 175.23 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GOA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 41.0 mt . . . . . 0 C--O 1.269 2.097 0 CA-C-O 120.731 0.301 . . . . 20.469999999999999 111.237 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -51.08 -46.02 61.64 Favored 'General case' 0 C--O 1.208 -1.124 0 O-C-N 120.628 -1.295 . . . . 37.829999999999998 112.147 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LYS . . . . . 1.527 ' NZ ' ' C7 ' ' B' ' 401' ' ' TYZ . 9.5 mtmm -65.28 -44.24 88.62 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.852 0.834 . . . . 40.399999999999999 108.955 -177.854 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -65.33 -43.04 92.2 Favored 'General case' 0 C--O 1.278 2.57 0 O-C-N 120.421 -1.424 . . . . 22.030000000000001 110.968 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 46.4 t -65.11 -38.75 83.51 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.246 0 O-C-N 123.581 0.551 . . . . 21.73 111.954 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.41 -40.34 82.16 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 124.335 2.017 . . . . 24.260000000000002 114.68 171.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 43.1 ttt-85 -64.62 -47.73 77.49 Favored 'General case' 0 C--O 1.176 -2.787 0 O-C-N 119.352 -2.092 . . . . 30.5 112.169 177.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.83 -42.46 97.77 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-O 118.12 -0.943 . . . . 20.280000000000001 110.276 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -59.28 -38.02 79.11 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 119.727 -0.789 . . . . 45.520000000000003 112.194 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -64.84 -39.96 94.41 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 123.762 0.664 . . . . 48.770000000000003 111.771 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 80.5 mt -69.2 -37.12 77.93 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.133 0.573 . . . . 32.700000000000003 112.188 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 38.5 t -78.6 -24.85 13.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 O-C-N 121.419 -0.801 . . . . 43.939999999999998 112.027 178.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.83 -146.76 35.7 Favored Glycine 0 C--O 1.249 1.088 0 N-CA-C 114.979 0.752 . . . . 55.439999999999998 114.979 -175.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.505 2.308 0 C-N-CA 128.022 2.529 . . . . 71.959999999999994 112.635 167.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 . . . . . 0 CA--C 1.495 -1.157 0 N-CA-C 116.614 2.079 . . . . 37.530000000000001 116.614 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' VAL . . . . . . . . . . . . . 40.3 t -73.2 -42.3 58.23 Favored 'Isoleucine or valine' 0 C--O 1.25 1.114 0 O-C-N 119.777 -1.827 . . . . 29.43 112.502 -177.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -34.33 76.38 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 123.29 1.519 . . . . 26.120000000000001 113.64 176.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ARG . . . . . . . . . . . . . 61.5 ttt-85 -66.84 -37.78 85.14 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 119.747 -1.846 . . . . 28.469999999999999 109.527 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 14.9 mt -67.66 -43.07 81.1 Favored 'General case' 0 C--O 1.273 2.338 0 O-C-N 119.535 -1.978 . . . . 27.239999999999998 110.542 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -58.68 -38.93 79.27 Favored 'General case' 0 C--O 1.267 1.978 0 C-N-CA 119.838 -0.745 . . . . 36.869999999999997 109.332 -177.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 11.5 mtmm -68.45 -43.46 77.0 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.573 -1.33 . . . . 48.600000000000001 107.64 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -64.72 -40.29 95.08 Favored 'General case' 0 C--O 1.277 2.519 0 C-N-CA 119.331 -0.948 . . . . 31.91 112.025 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 25.4 t -67.92 -43.87 85.55 Favored 'Isoleucine or valine' 0 C--O 1.273 2.292 0 CA-C-O 117.781 -1.104 . . . . 18.289999999999999 109.923 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' SER . . . . . . . . . . . . . 23.0 t -56.2 -41.9 76.32 Favored 'General case' 0 C--O 1.288 3.109 0 O-C-N 124.839 1.337 . . . . 30.77 110.697 175.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.3 -46.29 87.4 Favored 'General case' 0 C--O 1.251 1.15 0 O-C-N 120.401 -1.437 . . . . 21.039999999999999 110.548 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.48 -44.54 95.82 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.171 0.988 . . . . 21.52 111.422 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -58.92 -38.24 78.49 Favored 'General case' 0 C--O 1.251 1.182 0 CA-C-O 117.246 -1.359 . . . . 29.370000000000001 110.705 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -73.77 -37.45 65.0 Favored 'General case' 0 C--O 1.256 1.444 0 O-C-N 125.839 1.962 . . . . 40.240000000000002 107.33 -175.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -66.49 -39.69 88.86 Favored 'General case' 0 C--O 1.298 3.607 0 O-C-N 121.039 -1.038 . . . . 38.32 113.417 176.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 41.4 t -70.99 -36.05 61.93 Favored 'Isoleucine or valine' 0 C--O 1.267 2.013 0 O-C-N 120.61 -1.307 . . . . 17.489999999999998 110.193 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 124.276 1.989 . . . . 21.739999999999998 107.659 175.549 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' GOA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 51.0 mt . . . . . 0 C--O 1.252 1.216 0 CA-C-O 119.224 -0.417 . . . . 24.440000000000001 110.273 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -58.27 -44.98 88.65 Favored 'General case' 0 C--O 1.262 1.726 0 C-N-CA 120.336 -0.546 . . . . 34.729999999999997 110.746 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -63.64 -44.6 93.4 Favored 'General case' 0 CA--C 1.448 -2.948 0 C-N-CA 119.941 -0.704 . . . . 22.82 112.137 178.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -65.46 -41.62 93.19 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-O 125.328 2.49 . . . . 34.68 115.191 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 56.0 t -66.18 -37.18 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.296 0 O-C-N 118.528 -2.607 . . . . 17.73 111.518 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.82 -41.82 98.25 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-O 122.466 1.127 . . . . 14.19 108.791 177.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ARG . . . . . . . . . . . . . 62.1 ttt-85 -61.95 -46.74 87.98 Favored 'General case' 0 C--O 1.204 -1.306 0 O-C-N 119.573 -1.955 . . . . 23.07 112.594 176.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.65 -43.88 97.08 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.603 0.716 . . . . 20.550000000000001 111.606 178.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -58.3 -41.93 85.55 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 120.21 -1.556 . . . . 25.629999999999999 109.648 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 16.5 ttpp -68.09 -41.83 81.26 Favored 'General case' 0 C--O 1.258 1.517 0 C-N-CA 119.035 -1.066 . . . . 43.990000000000002 112.356 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.38 -41.0 90.05 Favored 'General case' 0 C--O 1.264 1.858 0 C-N-CA 118.679 -1.208 . . . . 23.469999999999999 112.97 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' VAL . . . . . . . . . . . . . 53.5 t -81.79 -28.69 9.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 C-N-CA 118.92 -1.112 . . . . 28.609999999999999 108.611 -174.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.532 5.064 0 O-C-N 119.601 -1.937 . . . . 34.619999999999997 113.011 -175.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' TYZ . . . . . 0.471 ' C9 ' ' C1 ' ' A' ' 400' ' ' TYZ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 401' ' ' TYZ . . . . . 1.527 ' C7 ' ' NZ ' ' B' ' 21' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' TYZ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' TYZ . . . . . 0.564 ' C9 ' ' C1 ' ' C' ' 102' ' ' TYZ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . 0.583 ' O ' ' NZ ' ' A' ' 28' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 72.8 mtp180 . . . . . 0 N--CA 1.428 -1.563 0 N-CA-C 113.893 1.072 . . . . 35.490000000000002 113.893 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.9 t -69.09 -39.09 79.08 Favored 'Isoleucine or valine' 0 C--O 1.268 2.057 0 O-C-N 121.416 -0.802 . . . . 24.559999999999999 111.659 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.13 -42.16 98.96 Favored 'General case' 0 C--O 1.256 1.397 0 O-C-N 120.901 -1.125 . . . . 23.870000000000001 109.871 176.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 90.2 mtm-85 -65.94 -39.95 90.94 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 118.213 -1.395 . . . . 28.609999999999999 110.572 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.7 mt -61.05 -40.86 95.22 Favored 'General case' 0 CA--C 1.483 -1.622 0 O-C-N 120.354 -1.466 . . . . 28.66 111.952 175.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -58.57 -39.39 80.15 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-O 122.131 0.967 . . . . 25.050000000000001 111.503 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -70.63 -37.59 73.8 Favored 'General case' 0 C--O 1.256 1.397 0 O-C-N 120.688 -1.258 . . . . 49.710000000000001 112.129 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -64.78 -41.36 95.9 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.777 0.673 . . . . 39.689999999999998 111.723 175.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.3 t -64.52 -45.25 96.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 124.282 0.989 . . . . 21.379999999999999 111.653 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 29.8 t -59.45 -39.18 82.77 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 121.21 -0.931 . . . . 32.899999999999999 112.785 176.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.39 -42.89 87.25 Favored 'General case' 0 CA--C 1.554 1.103 0 CA-C-O 122.293 1.045 . . . . 22.75 109.062 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.2 mt -62.27 -41.27 98.33 Favored 'General case' 0 C--O 1.269 2.082 0 O-C-N 121.756 -0.59 . . . . 20.289999999999999 111.671 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -58.54 -39.02 79.03 Favored 'General case' 0 C--O 1.257 1.463 0 O-C-N 122.025 -0.422 . . . . 33.149999999999999 110.417 178.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -73.27 -34.85 66.02 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.409 -0.589 . . . . 44.719999999999999 109.409 -174.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -73.06 -40.65 64.89 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 116.236 -0.438 . . . . 36.109999999999999 112.155 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.5 t -68.53 -37.5 77.82 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.581 0 N-CA-C 112.46 0.541 . . . . 22.09 112.46 -178.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.484 0 N-CA-C 107.247 -1.39 . . . . 29.309999999999999 107.247 173.953 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GOA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.507 2.404 0 N-CA-C 108.42 -0.956 . . . . 26.899999999999999 108.42 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -58.85 -41.56 87.28 Favored 'General case' 0 C--O 1.209 -1.032 0 C-N-CA 118.098 -1.441 . . . . 37.479999999999997 113.841 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -67.0 -41.38 86.81 Favored 'General case' 0 C--O 1.252 1.211 0 N-CA-C 109.421 -0.585 . . . . 50.68 109.421 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -64.41 -41.81 96.42 Favored 'General case' 0 C--O 1.263 1.806 0 C-N-CA 120.659 -0.417 . . . . 45.149999999999999 111.336 -177.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.4 t -65.36 -40.92 89.97 Favored 'Isoleucine or valine' 0 C--O 1.249 1.027 0 O-C-N 123.764 0.665 . . . . 21.620000000000001 110.363 178.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.26 -38.95 88.55 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 120.239 -0.584 . . . . 25.73 111.22 176.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 63.0 ttt-85 -68.43 -38.39 81.15 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.048 -1.657 . . . . 58.899999999999999 112.803 177.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.02 -38.7 82.89 Favored 'General case' 0 CA--C 1.482 -1.667 0 C-N-CA 119.388 -0.925 . . . . 24.699999999999999 110.952 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -58.01 -41.79 83.84 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 118.71 -1.196 . . . . 41.590000000000003 111.594 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . 0.479 ' NZ ' ' O ' ' A' ' 520' ' ' HOH . 22.8 mmtm -64.94 -35.9 82.65 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 117.172 -1.811 . . . . 43.82 113.648 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' HB3' HG11 ' B' ' 30' ' ' VAL . 76.7 mt -72.44 -42.79 64.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 O-C-N 120.733 -1.229 . . . . 32.82 107.92 -174.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.9 t -71.89 -42.15 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 122.695 1.236 . . . . 25.82 112.03 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 83.07 -168.98 47.59 Favored Glycine 0 N--CA 1.428 -1.844 0 CA-C-N 114.887 -1.051 . . . . 25.579999999999998 112.707 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 . . . . . 0 C--O 1.292 3.317 0 CA-C-O 117.693 -1.146 . . . . 57.189999999999998 110.921 -172.458 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 . . . . . 0 N--CA 1.513 2.708 0 N-CA-C 108.242 -1.022 . . . . 50.75 108.242 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 71.7 t -68.3 -42.52 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 115.559 -0.746 . . . . 38.329999999999998 111.426 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.77 -41.13 77.1 Favored 'General case' 0 C--O 1.208 -1.129 0 N-CA-C 114.99 1.478 . . . . 37.18 114.99 174.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -64.83 -40.46 95.21 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 122.959 1.361 . . . . 54.880000000000003 112.684 176.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 12.8 mt -66.81 -42.38 86.01 Favored 'General case' 0 C--O 1.249 1.051 0 CA-C-N 114.414 -1.266 . . . . 31.859999999999999 111.498 175.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -53.89 -40.85 66.98 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.324 1.231 . . . . 30.23 114.324 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -65.27 -42.44 93.21 Favored 'General case' 0 CA--C 1.552 1.045 0 O-C-N 124.078 0.861 . . . . 48.520000000000003 109.758 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -63.82 -45.89 87.56 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.759 -1.11 . . . . 38.100000000000001 111.028 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 32.9 t -64.59 -41.6 92.72 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-N 115.91 -0.586 . . . . 18.329999999999998 111.757 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' SER . . . . . 0.544 ' OG ' ' NZ ' ' B' ' 14' ' ' LYS . 43.1 t -57.12 -45.55 83.36 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.863 -0.791 . . . . 34.049999999999997 108.863 175.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.37 -40.14 96.43 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 108.585 -0.894 . . . . 23.02 108.585 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 41.8 mt -67.05 -42.28 85.07 Favored 'General case' 0 N--CA 1.438 -1.07 0 O-C-N 119.417 -2.052 . . . . 20.02 110.562 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -57.46 -39.17 75.76 Favored 'General case' 0 C--O 1.205 -1.237 0 O-C-N 120.937 -1.102 . . . . 31.120000000000001 109.955 -179.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LYS . . . . . 0.544 ' NZ ' ' OG ' ' B' ' 10' ' ' SER . 59.3 mttp -65.38 -44.05 88.78 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 125.338 1.649 . . . . 38.270000000000003 110.365 179.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -68.01 -35.03 77.63 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 120.885 0.374 . . . . 37.700000000000003 110.406 -178.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 25.3 t -76.54 -32.03 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.291 0 O-C-N 119.697 -1.877 . . . . 22.420000000000002 110.534 -176.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.556 1.205 0 N-CA-C 108.216 -1.031 . . . . 26.649999999999999 108.216 175.23 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GOA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 41.0 mt . . . . . 0 C--O 1.269 2.097 0 CA-C-O 120.731 0.301 . . . . 20.469999999999999 111.237 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -51.08 -46.02 61.64 Favored 'General case' 0 C--O 1.208 -1.124 0 O-C-N 120.628 -1.295 . . . . 37.829999999999998 112.147 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LYS . . . . . 1.527 ' NZ ' ' C7 ' ' B' ' 401' ' ' TYZ . 9.5 mtmm -65.28 -44.24 88.62 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.852 0.834 . . . . 40.399999999999999 108.955 -177.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -65.33 -43.04 92.2 Favored 'General case' 0 C--O 1.278 2.57 0 O-C-N 120.421 -1.424 . . . . 22.030000000000001 110.968 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 46.4 t -65.11 -38.75 83.51 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.246 0 O-C-N 123.581 0.551 . . . . 21.73 111.954 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.41 -40.34 82.16 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 124.335 2.017 . . . . 24.260000000000002 114.68 171.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 43.1 ttt-85 -64.62 -47.73 77.49 Favored 'General case' 0 C--O 1.176 -2.787 0 O-C-N 119.352 -2.092 . . . . 30.5 112.169 177.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.83 -42.46 97.77 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-O 118.12 -0.943 . . . . 20.280000000000001 110.276 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -59.28 -38.02 79.11 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 119.727 -0.789 . . . . 45.520000000000003 112.194 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -64.84 -39.96 94.41 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 123.762 0.664 . . . . 48.770000000000003 111.771 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 80.5 mt -69.2 -37.12 77.93 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.133 0.573 . . . . 32.700000000000003 112.188 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' VAL . . . . . 0.438 ' O ' HG12 ' B' ' 30' ' ' VAL . 38.5 t -78.6 -24.85 13.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 O-C-N 121.419 -0.801 . . . . 43.939999999999998 112.027 178.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.83 -146.76 35.7 Favored Glycine 0 C--O 1.249 1.088 0 N-CA-C 114.979 0.752 . . . . 55.439999999999998 114.979 -175.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.505 2.308 0 C-N-CA 128.022 2.529 . . . . 71.959999999999994 112.635 167.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 1' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 . . . . . 0 CA--C 1.495 -1.157 0 N-CA-C 116.614 2.079 . . . . 37.530000000000001 116.614 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' VAL . . . . . . . . . . . . . 40.3 t -73.2 -42.3 58.23 Favored 'Isoleucine or valine' 0 C--O 1.25 1.114 0 O-C-N 119.777 -1.827 . . . . 29.43 112.502 -177.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -34.33 76.38 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 123.29 1.519 . . . . 26.120000000000001 113.64 176.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ARG . . . . . . . . . . . . . 61.5 ttt-85 -66.84 -37.78 85.14 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 119.747 -1.846 . . . . 28.469999999999999 109.527 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 14.9 mt -67.66 -43.07 81.1 Favored 'General case' 0 C--O 1.273 2.338 0 O-C-N 119.535 -1.978 . . . . 27.239999999999998 110.542 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -58.68 -38.93 79.27 Favored 'General case' 0 C--O 1.267 1.978 0 C-N-CA 119.838 -0.745 . . . . 36.869999999999997 109.332 -177.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 11.5 mtmm -68.45 -43.46 77.0 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.573 -1.33 . . . . 48.600000000000001 107.64 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -64.72 -40.29 95.08 Favored 'General case' 0 C--O 1.277 2.519 0 C-N-CA 119.331 -0.948 . . . . 31.91 112.025 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 25.4 t -67.92 -43.87 85.55 Favored 'Isoleucine or valine' 0 C--O 1.273 2.292 0 CA-C-O 117.781 -1.104 . . . . 18.289999999999999 109.923 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' SER . . . . . . . . . . . . . 23.0 t -56.2 -41.9 76.32 Favored 'General case' 0 C--O 1.288 3.109 0 O-C-N 124.839 1.337 . . . . 30.77 110.697 175.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.3 -46.29 87.4 Favored 'General case' 0 C--O 1.251 1.15 0 O-C-N 120.401 -1.437 . . . . 21.039999999999999 110.548 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.48 -44.54 95.82 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.171 0.988 . . . . 21.52 111.422 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -58.92 -38.24 78.49 Favored 'General case' 0 C--O 1.251 1.182 0 CA-C-O 117.246 -1.359 . . . . 29.370000000000001 110.705 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -73.77 -37.45 65.0 Favored 'General case' 0 C--O 1.256 1.444 0 O-C-N 125.839 1.962 . . . . 40.240000000000002 107.33 -175.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -66.49 -39.69 88.86 Favored 'General case' 0 C--O 1.298 3.607 0 O-C-N 121.039 -1.038 . . . . 38.32 113.417 176.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 41.4 t -70.99 -36.05 61.93 Favored 'Isoleucine or valine' 0 C--O 1.267 2.013 0 O-C-N 120.61 -1.307 . . . . 17.489999999999998 110.193 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 124.276 1.989 . . . . 21.739999999999998 107.659 175.549 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 18' ' ' GOA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 51.0 mt . . . . . 0 C--O 1.252 1.216 0 CA-C-O 119.224 -0.417 . . . . 24.440000000000001 110.273 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -58.27 -44.98 88.65 Favored 'General case' 0 C--O 1.262 1.726 0 C-N-CA 120.336 -0.546 . . . . 34.729999999999997 110.746 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -63.64 -44.6 93.4 Favored 'General case' 0 CA--C 1.448 -2.948 0 C-N-CA 119.941 -0.704 . . . . 22.82 112.137 178.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -65.46 -41.62 93.19 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-O 125.328 2.49 . . . . 34.68 115.191 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 56.0 t -66.18 -37.18 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.296 0 O-C-N 118.528 -2.607 . . . . 17.73 111.518 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.82 -41.82 98.25 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-O 122.466 1.127 . . . . 14.19 108.791 177.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ARG . . . . . . . . . . . . . 62.1 ttt-85 -61.95 -46.74 87.98 Favored 'General case' 0 C--O 1.204 -1.306 0 O-C-N 119.573 -1.955 . . . . 23.07 112.594 176.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.65 -43.88 97.08 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.603 0.716 . . . . 20.550000000000001 111.606 178.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -58.3 -41.93 85.55 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 120.21 -1.556 . . . . 25.629999999999999 109.648 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 16.5 ttpp -68.09 -41.83 81.26 Favored 'General case' 0 C--O 1.258 1.517 0 C-N-CA 119.035 -1.066 . . . . 43.990000000000002 112.356 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.38 -41.0 90.05 Favored 'General case' 0 C--O 1.264 1.858 0 C-N-CA 118.679 -1.208 . . . . 23.469999999999999 112.97 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' VAL . . . . . . . . . . . . . 53.5 t -81.79 -28.69 9.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 C-N-CA 118.92 -1.112 . . . . 28.609999999999999 108.611 -174.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.532 5.064 0 O-C-N 119.601 -1.937 . . . . 34.619999999999997 113.011 -175.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 400' ' ' TYZ . . . . . 0.827 ' HA ' H9C3 ' A' ' 400' ' ' TYZ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 401' ' ' TYZ . . . . . 1.527 ' C7 ' ' NZ ' ' B' ' 21' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' TYZ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 102' ' ' TYZ . . . . . 0.923 ' HA ' H9C3 ' C' ' 102' ' ' TYZ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . 0.479 ' O ' ' NZ ' ' A' ' 28' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 72.8 mtp180 . . . . . 0 N--CA 1.428 -1.563 0 N-CA-C 113.893 1.072 . . . . 35.490000000000002 113.893 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.9 t -69.09 -39.09 79.08 Favored 'Isoleucine or valine' 0 C--O 1.268 2.057 0 O-C-N 121.416 -0.802 . . . . 24.559999999999999 111.659 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.13 -42.16 98.96 Favored 'General case' 0 C--O 1.256 1.397 0 O-C-N 120.901 -1.125 . . . . 23.870000000000001 109.871 176.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 90.2 mtm-85 -65.94 -39.95 90.94 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 118.213 -1.395 . . . . 28.609999999999999 110.572 -178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 9.7 mt -61.05 -40.86 95.22 Favored 'General case' 0 CA--C 1.483 -1.622 0 O-C-N 120.354 -1.466 . . . . 28.66 111.952 175.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -58.57 -39.39 80.15 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-O 122.131 0.967 . . . . 25.050000000000001 111.503 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.8 mmtp -70.63 -37.59 73.8 Favored 'General case' 0 C--O 1.256 1.397 0 O-C-N 120.688 -1.258 . . . . 49.710000000000001 112.129 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -64.78 -41.36 95.9 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.777 0.673 . . . . 39.689999999999998 111.723 175.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 49.3 t -64.52 -45.25 96.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.595 0 O-C-N 124.282 0.989 . . . . 21.379999999999999 111.653 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 29.8 t -59.45 -39.18 82.77 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 121.21 -0.931 . . . . 32.899999999999999 112.785 176.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.39 -42.89 87.25 Favored 'General case' 0 CA--C 1.554 1.103 0 CA-C-O 122.293 1.045 . . . . 22.75 109.062 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.2 mt -62.27 -41.27 98.33 Favored 'General case' 0 C--O 1.269 2.082 0 O-C-N 121.756 -0.59 . . . . 20.289999999999999 111.671 178.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -58.54 -39.02 79.03 Favored 'General case' 0 C--O 1.257 1.463 0 O-C-N 122.025 -0.422 . . . . 33.149999999999999 110.417 178.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.8 mttp -73.27 -34.85 66.02 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 109.409 -0.589 . . . . 44.719999999999999 109.409 -174.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -73.06 -40.65 64.89 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 116.236 -0.438 . . . . 36.109999999999999 112.155 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.5 t -68.53 -37.5 77.82 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.581 0 N-CA-C 112.46 0.541 . . . . 22.09 112.46 -178.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.484 0 N-CA-C 107.247 -1.39 . . . . 29.309999999999999 107.247 173.953 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GOA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 45.7 mt . . . . . 0 N--CA 1.507 2.404 0 N-CA-C 108.42 -0.956 . . . . 26.899999999999999 108.42 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 77.9 mt-10 -58.85 -41.56 87.28 Favored 'General case' 0 C--O 1.209 -1.032 0 C-N-CA 118.098 -1.441 . . . . 37.479999999999997 113.841 179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -67.0 -41.38 86.81 Favored 'General case' 0 C--O 1.252 1.211 0 N-CA-C 109.421 -0.585 . . . . 50.68 109.421 179.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -64.41 -41.81 96.42 Favored 'General case' 0 C--O 1.263 1.806 0 C-N-CA 120.659 -0.417 . . . . 45.149999999999999 111.336 -177.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.4 t -65.36 -40.92 89.97 Favored 'Isoleucine or valine' 0 C--O 1.249 1.027 0 O-C-N 123.764 0.665 . . . . 21.620000000000001 110.363 178.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.26 -38.95 88.55 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 120.239 -0.584 . . . . 25.73 111.22 176.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 63.0 ttt-85 -68.43 -38.39 81.15 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.048 -1.657 . . . . 58.899999999999999 112.803 177.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.02 -38.7 82.89 Favored 'General case' 0 CA--C 1.482 -1.667 0 C-N-CA 119.388 -0.925 . . . . 24.699999999999999 110.952 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -58.01 -41.79 83.84 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 118.71 -1.196 . . . . 41.590000000000003 111.594 175.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.479 ' NZ ' ' O ' ' A' ' 520' ' ' HOH . 22.8 mmtm -64.94 -35.9 82.65 Favored 'General case' 0 N--CA 1.495 1.778 0 C-N-CA 117.172 -1.811 . . . . 43.82 113.648 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' HB3' HG11 ' B' ' 30' ' ' VAL . 76.7 mt -72.44 -42.79 64.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 O-C-N 120.733 -1.229 . . . . 32.82 107.92 -174.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.9 t -71.89 -42.15 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 122.695 1.236 . . . . 25.82 112.03 -178.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 83.07 -168.98 47.59 Favored Glycine 0 N--CA 1.428 -1.844 0 CA-C-N 114.887 -1.051 . . . . 25.579999999999998 112.707 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 . . . . . 0 C--O 1.292 3.317 0 CA-C-O 117.693 -1.146 . . . . 57.189999999999998 110.921 -172.458 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 . . . . . 0 N--CA 1.513 2.708 0 N-CA-C 108.242 -1.022 . . . . 50.75 108.242 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 71.7 t -68.3 -42.52 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 115.559 -0.746 . . . . 38.329999999999998 111.426 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.77 -41.13 77.1 Favored 'General case' 0 C--O 1.208 -1.129 0 N-CA-C 114.99 1.478 . . . . 37.18 114.99 174.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . 52.0 mtm-85 -64.83 -40.46 95.21 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 122.959 1.361 . . . . 54.880000000000003 112.684 176.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 12.8 mt -66.81 -42.38 86.01 Favored 'General case' 0 C--O 1.249 1.051 0 CA-C-N 114.414 -1.266 . . . . 31.859999999999999 111.498 175.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -53.89 -40.85 66.98 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.324 1.231 . . . . 30.23 114.324 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -65.27 -42.44 93.21 Favored 'General case' 0 CA--C 1.552 1.045 0 O-C-N 124.078 0.861 . . . . 48.520000000000003 109.758 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -63.82 -45.89 87.56 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.759 -1.11 . . . . 38.100000000000001 111.028 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' VAL . . . . . . . . . . . . . 32.9 t -64.59 -41.6 92.72 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 CA-C-N 115.91 -0.586 . . . . 18.329999999999998 111.757 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' SER . . . . . 0.544 ' OG ' ' NZ ' ' B' ' 14' ' ' LYS . 43.1 t -57.12 -45.55 83.36 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 108.863 -0.791 . . . . 34.049999999999997 108.863 175.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.37 -40.14 96.43 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 108.585 -0.894 . . . . 23.02 108.585 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 41.8 mt -67.05 -42.28 85.07 Favored 'General case' 0 N--CA 1.438 -1.07 0 O-C-N 119.417 -2.052 . . . . 20.02 110.562 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -57.46 -39.17 75.76 Favored 'General case' 0 C--O 1.205 -1.237 0 O-C-N 120.937 -1.102 . . . . 31.120000000000001 109.955 -179.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.544 ' NZ ' ' OG ' ' B' ' 10' ' ' SER . 59.3 mttp -65.38 -44.05 88.78 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 125.338 1.649 . . . . 38.270000000000003 110.365 179.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -68.01 -35.03 77.63 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 120.885 0.374 . . . . 37.700000000000003 110.406 -178.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 25.3 t -76.54 -32.03 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.291 0 O-C-N 119.697 -1.877 . . . . 22.420000000000002 110.534 -176.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.556 1.205 0 N-CA-C 108.216 -1.031 . . . . 26.649999999999999 108.216 175.23 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GOA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 41.0 mt . . . . . 0 C--O 1.269 2.097 0 CA-C-O 120.731 0.301 . . . . 20.469999999999999 111.237 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -51.08 -46.02 61.64 Favored 'General case' 0 C--O 1.208 -1.124 0 O-C-N 120.628 -1.295 . . . . 37.829999999999998 112.147 178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LYS . . . . . 1.527 ' NZ ' ' C7 ' ' B' ' 401' ' ' TYZ . 9.5 mtmm -65.28 -44.24 88.62 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 121.852 0.834 . . . . 40.399999999999999 108.955 -177.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -65.33 -43.04 92.2 Favored 'General case' 0 C--O 1.278 2.57 0 O-C-N 120.421 -1.424 . . . . 22.030000000000001 110.968 -178.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 46.4 t -65.11 -38.75 83.51 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.246 0 O-C-N 123.581 0.551 . . . . 21.73 111.954 179.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.41 -40.34 82.16 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 124.335 2.017 . . . . 24.260000000000002 114.68 171.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 43.1 ttt-85 -64.62 -47.73 77.49 Favored 'General case' 0 C--O 1.176 -2.787 0 O-C-N 119.352 -2.092 . . . . 30.5 112.169 177.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.83 -42.46 97.77 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-O 118.12 -0.943 . . . . 20.280000000000001 110.276 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -59.28 -38.02 79.11 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 119.727 -0.789 . . . . 45.520000000000003 112.194 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -64.84 -39.96 94.41 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 123.762 0.664 . . . . 48.770000000000003 111.771 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 80.5 mt -69.2 -37.12 77.93 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.133 0.573 . . . . 32.700000000000003 112.188 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.438 ' O ' HG12 ' B' ' 30' ' ' VAL . 38.5 t -78.6 -24.85 13.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 O-C-N 121.419 -0.801 . . . . 43.939999999999998 112.027 178.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.83 -146.76 35.7 Favored Glycine 0 C--O 1.249 1.088 0 N-CA-C 114.979 0.752 . . . . 55.439999999999998 114.979 -175.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.505 2.308 0 C-N-CA 128.022 2.529 . . . . 71.959999999999994 112.635 167.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 . . . . . 0 CA--C 1.495 -1.157 0 N-CA-C 116.614 2.079 . . . . 37.530000000000001 116.614 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' VAL . . . . . . . . . . . . . 40.3 t -73.2 -42.3 58.23 Favored 'Isoleucine or valine' 0 C--O 1.25 1.114 0 O-C-N 119.777 -1.827 . . . . 29.43 112.502 -177.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.29 -34.33 76.38 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 123.29 1.519 . . . . 26.120000000000001 113.64 176.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ARG . . . . . . . . . . . . . 61.5 ttt-85 -66.84 -37.78 85.14 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 119.747 -1.846 . . . . 28.469999999999999 109.527 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 14.9 mt -67.66 -43.07 81.1 Favored 'General case' 0 C--O 1.273 2.338 0 O-C-N 119.535 -1.978 . . . . 27.239999999999998 110.542 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -58.68 -38.93 79.27 Favored 'General case' 0 C--O 1.267 1.978 0 C-N-CA 119.838 -0.745 . . . . 36.869999999999997 109.332 -177.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 11.5 mtmm -68.45 -43.46 77.0 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.573 -1.33 . . . . 48.600000000000001 107.64 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -64.72 -40.29 95.08 Favored 'General case' 0 C--O 1.277 2.519 0 C-N-CA 119.331 -0.948 . . . . 31.91 112.025 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' VAL . . . . . . . . . . . . . 25.4 t -67.92 -43.87 85.55 Favored 'Isoleucine or valine' 0 C--O 1.273 2.292 0 CA-C-O 117.781 -1.104 . . . . 18.289999999999999 109.923 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' SER . . . . . . . . . . . . . 23.0 t -56.2 -41.9 76.32 Favored 'General case' 0 C--O 1.288 3.109 0 O-C-N 124.839 1.337 . . . . 30.77 110.697 175.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.3 -46.29 87.4 Favored 'General case' 0 C--O 1.251 1.15 0 O-C-N 120.401 -1.437 . . . . 21.039999999999999 110.548 -178.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.48 -44.54 95.82 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.171 0.988 . . . . 21.52 111.422 177.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 91.3 mt-10 -58.92 -38.24 78.49 Favored 'General case' 0 C--O 1.251 1.182 0 CA-C-O 117.246 -1.359 . . . . 29.370000000000001 110.705 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -73.77 -37.45 65.0 Favored 'General case' 0 C--O 1.256 1.444 0 O-C-N 125.839 1.962 . . . . 40.240000000000002 107.33 -175.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -66.49 -39.69 88.86 Favored 'General case' 0 C--O 1.298 3.607 0 O-C-N 121.039 -1.038 . . . . 38.32 113.417 176.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 41.4 t -70.99 -36.05 61.93 Favored 'Isoleucine or valine' 0 C--O 1.267 2.013 0 O-C-N 120.61 -1.307 . . . . 17.489999999999998 110.193 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 124.276 1.989 . . . . 21.739999999999998 107.659 175.549 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' GOA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' LEU . . . . . . . . . . . . . 51.0 mt . . . . . 0 C--O 1.252 1.216 0 CA-C-O 119.224 -0.417 . . . . 24.440000000000001 110.273 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -58.27 -44.98 88.65 Favored 'General case' 0 C--O 1.262 1.726 0 C-N-CA 120.336 -0.546 . . . . 34.729999999999997 110.746 177.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -63.64 -44.6 93.4 Favored 'General case' 0 CA--C 1.448 -2.948 0 C-N-CA 119.941 -0.704 . . . . 22.82 112.137 178.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -65.46 -41.62 93.19 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-O 125.328 2.49 . . . . 34.68 115.191 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' VAL . . . . . . . . . . . . . 56.0 t -66.18 -37.18 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.296 0 O-C-N 118.528 -2.607 . . . . 17.73 111.518 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.82 -41.82 98.25 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-O 122.466 1.127 . . . . 14.19 108.791 177.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ARG . . . . . . . . . . . . . 62.1 ttt-85 -61.95 -46.74 87.98 Favored 'General case' 0 C--O 1.204 -1.306 0 O-C-N 119.573 -1.955 . . . . 23.07 112.594 176.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 89.1 mt -60.65 -43.88 97.08 Favored 'General case' 0 CA--C 1.506 -0.749 0 CA-C-O 121.603 0.716 . . . . 20.550000000000001 111.606 178.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -58.3 -41.93 85.55 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 120.21 -1.556 . . . . 25.629999999999999 109.648 179.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' LYS . . . . . . . . . . . . . 16.5 ttpp -68.09 -41.83 81.26 Favored 'General case' 0 C--O 1.258 1.517 0 C-N-CA 119.035 -1.066 . . . . 43.990000000000002 112.356 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.38 -41.0 90.05 Favored 'General case' 0 C--O 1.264 1.858 0 C-N-CA 118.679 -1.208 . . . . 23.469999999999999 112.97 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' VAL . . . . . . . . . . . . . 53.5 t -81.79 -28.69 9.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 C-N-CA 118.92 -1.112 . . . . 28.609999999999999 108.611 -174.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.532 5.064 0 O-C-N 119.601 -1.937 . . . . 34.619999999999997 113.011 -175.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' TYZ . . . . . 0.827 ' HA ' H9C3 ' A' ' 400' ' ' TYZ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 401' ' ' TYZ . . . . . 1.527 ' C7 ' ' NZ ' ' B' ' 21' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' TYZ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' TYZ . . . . . 0.923 ' HA ' H9C3 ' C' ' 102' ' ' TYZ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . 0.479 ' O ' ' NZ ' ' A' ' 28' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_