data_7c31_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 7c31 _Structure_validation_residue.Date_analyzed 2020-09-11 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 . . . . . . . . . . . . . 46.9 ttt180 . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 120.634 0.254 . . . . 50.33 111.284 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 83.9 t -98.75 134.67 36.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-N 115.662 -0.699 . . . . 28.17 110.055 -172.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' B' ' 3' ' ' CYS . 13.4 m -115.23 150.76 35.64 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 125.179 1.392 . . . . 26.25 109.243 172.207 -82.499 65.094 114.722 105.865 2.047 108.489 -79.287 -56.568 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -130.19 148.93 52.08 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.988 -1.006 . . . . 48.0 111.37 -178.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.2 t -150.14 130.33 13.62 Favored 'General case' 0 N--CA 1.462 0.132 0 N-CA-C 106.957 -1.497 . . . . 23.47 106.957 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.99 139.52 57.37 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 119.338 -0.945 . . . . 29.7 110.422 176.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.8 t -64.14 139.96 58.82 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 115.837 -0.62 . . . . 17.16 110.766 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.3 m170 -86.94 -26.93 23.63 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.054 -0.521 . . . . 37.6 111.996 173.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -97.13 -25.68 15.23 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 113.849 1.055 . . . . 62.32 113.849 -171.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -61.73 129.74 42.45 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 118.378 0.535 . . . . 17.3 109.755 -174.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -113.25 133.81 54.91 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.197 -0.668 . . . . 56.77 109.197 -174.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.05 -176.6 54.58 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-O 122.943 1.302 . . . . 20.16 113.449 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.73 136.58 57.09 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-N 114.151 -1.025 . . . . 19.31 109.266 -179.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.0 t -85.33 105.02 15.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 106.913 -1.514 . . . . 15.81 106.913 177.781 -167.488 -72.769 -71.421 106.72 1.982 102.595 -59.337 -50.768 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.9 mmm -107.65 -19.43 13.55 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.117 -0.492 . . . . 45.19 111.649 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -132.87 113.05 1.19 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.164 -0.774 . . . . 28.25 111.164 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -55.66 -36.94 67.61 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.782 -0.367 . . . . 31.27 111.541 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -66.89 -37.22 83.97 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 120.348 -0.541 . . . . 38.75 111.459 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -64.56 -41.13 96.51 Favored 'General case' 0 CA--C 1.508 -0.644 0 C-N-CA 119.469 -0.893 . . . . 21.84 109.929 177.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.8 t -61.13 -44.41 97.37 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.356 -0.384 . . . . 13.05 110.153 176.562 169.966 61.262 85.951 104.26 2.038 105.662 54.299 172.971 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.81 -43.63 81.17 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.443 0.64 . . . . 13.53 111.861 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.0 mt -68.16 -42.8 79.53 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.735 -0.603 . . . . 27.22 111.511 -178.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 76.4 t -61.06 -42.04 91.59 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 C-N-CA 120.181 -0.607 . . . . 18.65 110.142 176.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 54.5 m -64.27 -37.29 86.95 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 122.096 -0.378 . . . . 13.58 111.697 -179.711 -75.69 -73.89 -77.524 101.336 2.052 105.279 -44.489 -57.095 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 54.7 mtm-85 -64.28 -35.09 79.72 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 119.638 -0.825 . . . . 48.59 111.123 175.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.82 -29.04 69.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 119.833 -0.127 . . . . 36.8 111.051 175.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -84.89 -0.98 55.97 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 113.538 0.94 . . . . 30.83 113.538 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.55 3.57 49.95 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 115.972 1.149 . . . . 22.88 115.972 175.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -91.62 175.72 6.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 118.452 1.126 . . . . 22.82 110.591 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 82.6 p -85.83 -25.58 26.2 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 113.643 0.979 . . . . 31.81 113.643 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 175.37 -159.89 28.17 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 107.57 -2.212 . . . . 16.47 107.57 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 172.89 171.4 37.6 Favored Glycine 0 CA--C 1.496 -1.147 0 N-CA-C 110.2 -1.16 . . . . 11.82 110.2 -176.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.7 ptmm? -157.27 164.39 37.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.063 -1.068 . . . . 66.75 110.474 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 33.9 m -79.6 140.94 36.97 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.363 -1.29 . . . . 14.88 109.665 176.56 -50.768 -59.337 -71.421 102.595 1.982 106.72 -72.769 -167.488 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -139.41 147.2 41.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.493 0.664 . . . . 45.02 109.501 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 83.86 163.16 34.9 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 114.756 -1.111 . . . . 15.8 113.107 166.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.5 tp -59.77 -27.43 66.52 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.785 -0.707 . . . . 32.62 110.965 172.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . 0.449 ' NH1' ' O ' ' A' ' 101' ' ' HOH . 62.0 mtp180 -74.9 -10.94 59.97 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.551 0.575 . . . . 59.96 112.551 178.143 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 52.6 66.28 1.27 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 123.086 1.422 . . . . 22.84 110.569 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -107.76 148.52 29.36 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 113.808 -1.542 . . . . 32.98 108.832 175.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 31.2 t -85.51 122.77 30.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.448 -0.796 . . . . 11.14 110.757 176.191 172.971 54.299 85.951 105.662 2.038 104.26 61.262 169.966 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -116.54 119.71 36.43 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 124.169 0.918 . . . . 24.34 109.207 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 63.5 m -81.29 148.04 29.61 Favored 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 124.938 1.295 . . . . 11.91 109.998 178.569 -57.095 -44.489 -77.524 105.279 2.052 101.336 -73.89 -75.69 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.8 p -131.83 150.34 52.18 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 123.644 0.778 . . . . 25.87 112.049 -176.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -160.26 168.54 25.12 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 106.834 -1.543 . . . . 42.04 106.834 171.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.08 139.76 54.82 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 109.649 -0.5 . . . . 33.2 109.649 171.053 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 62.0 m . . . . . 0 C--N 1.325 -0.477 0 C-N-CA 118.147 -1.421 . . . . 44.04 108.835 -179.194 -56.568 -79.287 114.722 108.489 2.047 105.865 65.094 -82.499 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 . . . . . 0 N--CA 1.493 1.695 0 N-CA-C 109.674 -0.491 . . . . 41.55 109.674 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.3 p -92.58 148.89 4.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.458 0 CA-C-O 121.554 0.692 . . . . 23.71 109.707 -178.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' CYS . . . . . 1.015 ' SG ' ' O ' ' B' ' 123' ' ' HOH . 83.8 m -128.32 161.45 29.36 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.299 -0.864 . . . . 20.82 110.0 172.469 -64.328 150.212 -131.543 101.196 2.001 95.837 121.323 -98.43 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -130.54 148.07 52.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.855 -1.066 . . . . 58.13 111.434 -174.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 24.3 t -150.15 127.94 11.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.546 -0.909 . . . . 18.77 108.546 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -57.61 143.05 42.67 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 108.944 -0.762 . . . . 46.71 108.944 179.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 27.3 t -63.66 143.06 58.14 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.192 0.52 . . . . 17.34 110.629 -177.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -97.16 -7.99 31.18 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 112.648 0.611 . . . . 52.12 112.648 174.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -113.88 -24.23 9.21 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 114.64 1.348 . . . . 64.78 114.64 -176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -69.61 130.35 42.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 119.043 0.838 . . . . 18.11 109.98 -168.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -90.41 121.54 32.47 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 123.12 0.568 . . . . 25.52 109.914 -176.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 73.39 -156.79 51.49 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 118.124 -1.988 . . . . 27.89 116.06 168.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.62 136.33 45.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.496 -0.852 . . . . 32.59 111.235 -175.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' CYS . . . . . . . . . . . . . 11.1 t -89.87 108.06 19.48 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.712 0.805 . . . . 26.06 109.287 -177.651 -164.675 -76.38 -68.213 104.33 2.031 102.705 -55.064 -52.961 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' MET . . . . . . . . . . . . . 5.4 mmt -98.3 -51.14 4.08 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 120.782 -0.367 . . . . 65.92 110.637 177.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -99.8 119.24 6.44 Favored Glycine 0 C--N 1.308 -0.975 0 N-CA-C 111.958 -0.457 . . . . 32.62 111.958 -174.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -59.63 -37.88 79.84 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 119.474 -0.89 . . . . 59.9 110.969 179.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 8.2 t-80 -61.56 -39.31 90.66 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.384 -0.526 . . . . 63.93 111.216 -179.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 44.3 m-20 -64.06 -41.89 97.2 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 118.721 -1.191 . . . . 22.4 109.615 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' CYS . . . . . . . . . . . . . 15.0 t -62.81 -44.5 95.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.231 -0.441 . . . . 14.18 110.935 178.845 170.031 61.685 84.277 104.619 2.033 105.236 56.209 171.012 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.98 -43.16 81.39 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 112.497 0.555 . . . . 22.6 112.497 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 13.8 mt -68.12 -40.76 82.42 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 119.123 -1.031 . . . . 36.65 111.479 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.79 -45.59 97.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.631 0 CA-C-O 122.263 1.03 . . . . 18.54 109.593 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 67.0 m -63.66 -35.33 80.19 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.524 -0.735 . . . . 13.18 112.468 179.85 -72.439 -75.967 -76.019 100.258 2.009 104.781 -45.41 -58.699 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -64.13 -34.4 77.97 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 118.779 -1.169 . . . . 26.2 111.149 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -64.88 -23.57 67.27 Favored 'General case' 0 C--N 1.317 -0.824 0 O-C-N 121.98 -0.45 . . . . 74.42 112.009 173.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -88.2 4.37 45.91 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 112.945 0.72 . . . . 20.94 112.945 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.9 13.37 62.54 Favored Glycine 0 C--O 1.229 -0.207 0 N-CA-C 116.87 1.508 . . . . 22.51 116.87 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -97.8 168.65 10.19 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 125.094 1.358 . . . . 22.8 109.455 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 5.3 p -87.84 -23.18 24.08 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.93 -0.708 . . . . 34.58 112.603 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -171.05 -169.47 34.09 Favored Glycine 0 N--CA 1.44 -1.035 0 N-CA-C 109.979 -1.248 . . . . 21.32 109.979 -176.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 179.81 169.07 39.57 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 119.876 -1.154 . . . . 16.94 110.379 174.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LYS . . . . . 0.442 ' HB2' ' HE2' ' B' ' 33' ' ' LYS . 10.4 ptmm? -152.83 153.46 33.17 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.775 -0.824 . . . . 64.5 108.775 -178.431 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' CYS . . . . . . . . . . . . . 47.2 m -73.96 134.78 43.16 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 114.41 -1.268 . . . . 23.81 109.658 172.107 -52.961 -55.064 -68.213 102.705 2.031 104.33 -76.38 -164.675 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -148.15 164.59 33.44 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.621 0.724 . . . . 65.16 109.875 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLY . . . . . . . . . . . . . . . 91.02 161.45 37.4 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-N 114.49 -1.232 . . . . 34.81 112.921 171.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.38 -42.45 96.13 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 119.719 -0.793 . . . . 49.6 111.415 178.003 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ARG . . . . . 0.441 ' O ' ' HG2' ' B' ' 40' ' ' ARG . 9.4 mtt180 -88.1 100.51 13.0 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 104.988 -2.227 . . . . 62.68 104.988 166.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -59.02 103.05 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.824 -0.806 . . . . 67.28 108.824 -167.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ARG . . . . . 0.441 ' HG2' ' O ' ' B' ' 38' ' ' ARG . 85.9 mmt-85 -118.46 155.81 30.15 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.568 0.699 . . . . 71.18 110.333 179.501 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' CYS . . . . . . . . . . . . . 18.4 t -90.0 122.35 32.93 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.442 -0.799 . . . . 14.61 109.269 -178.923 171.012 56.209 84.277 105.236 2.033 104.619 61.685 170.031 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -114.33 123.77 50.33 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 123.359 0.664 . . . . 24.14 109.405 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 73.6 m -88.66 149.41 23.53 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.101 -1.074 . . . . 12.44 108.101 -179.208 -58.699 -45.41 -76.019 104.781 2.009 100.258 -75.967 -72.439 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 28.8 p -130.71 150.6 51.82 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.993 -0.549 . . . . 22.77 110.875 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -159.82 171.48 19.4 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.668 -1.234 . . . . 62.37 107.668 173.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.55 134.95 39.28 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 118.99 -1.084 . . . . 70.91 108.912 172.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' CYS . . . . . 0.661 ' HB2' ' O ' ' B' ' 123' ' ' HOH . 1.2 m . . . . . 0 CA--C 1.506 -0.715 0 C-N-CA 114.376 -2.93 . . . . 78.05 112.59 177.496 -98.43 121.323 -131.543 95.837 2.001 101.196 150.212 -64.328 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . 0.449 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . 1.015 ' O ' ' SG ' ' B' ' 3' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 46.9 ttt180 . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 120.634 0.254 . . . . 41.88 111.284 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 83.9 t -98.75 134.67 36.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-N 115.662 -0.699 . . . . 23.42 110.055 -172.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' B' ' 3' ' ' CYS . 13.4 m -115.23 150.76 35.64 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 125.179 1.392 . . . . 26.25 109.243 172.207 -82.499 65.094 114.722 105.865 2.047 108.489 -79.287 -56.568 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . 0.49 ' HG2' HG22 ' A' ' 44' ' ' THR . 78.3 mt-10 -130.19 148.93 52.08 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.988 -1.006 . . . . 48.0 111.37 -178.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.2 t -150.14 130.33 13.62 Favored 'General case' 0 N--CA 1.462 0.132 0 N-CA-C 106.957 -1.497 . . . . 19.5 106.957 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.99 139.52 57.37 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 119.338 -0.945 . . . . 24.69 110.422 176.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.8 t -64.14 139.96 58.82 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 115.837 -0.62 . . . . 14.64 110.766 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.3 m170 -86.94 -26.93 23.63 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.054 -0.521 . . . . 31.27 111.996 173.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -97.13 -25.68 15.23 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 113.849 1.055 . . . . 51.87 113.849 -171.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -61.73 129.74 42.45 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 118.378 0.535 . . . . 17.3 109.755 -174.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -113.25 133.81 54.91 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.197 -0.668 . . . . 56.77 109.197 -174.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.05 -176.6 54.58 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-O 122.943 1.302 . . . . 17.09 113.449 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.73 136.58 57.09 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-N 114.151 -1.025 . . . . 16.38 109.266 -179.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.0 t -85.33 105.02 15.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 106.913 -1.514 . . . . 15.81 106.913 177.781 -167.488 -72.769 -71.421 106.72 1.982 102.595 -59.337 -50.768 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.9 mmm -107.65 -19.43 13.55 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.117 -0.492 . . . . 44.31 111.649 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -132.87 113.05 1.19 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.164 -0.774 . . . . 23.48 111.164 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -55.66 -36.94 67.61 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.782 -0.367 . . . . 31.27 111.541 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -66.89 -37.22 83.97 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 120.348 -0.541 . . . . 38.67 111.459 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -64.56 -41.13 96.51 Favored 'General case' 0 CA--C 1.508 -0.644 0 C-N-CA 119.469 -0.893 . . . . 18.14 109.929 177.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.8 t -61.13 -44.41 97.37 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.356 -0.384 . . . . 10.82 110.153 176.562 169.966 61.262 85.951 104.26 2.038 105.662 54.299 172.971 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.81 -43.63 81.17 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.443 0.64 . . . . 11.81 111.861 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.0 mt -68.16 -42.8 79.53 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.735 -0.603 . . . . 25.95 111.511 -178.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 76.4 t -61.06 -42.04 91.59 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 C-N-CA 120.181 -0.607 . . . . 15.49 110.142 176.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 54.5 m -64.27 -37.29 86.95 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 122.096 -0.378 . . . . 13.47 111.697 -179.711 -75.69 -73.89 -77.524 101.336 2.052 105.279 -44.489 -57.095 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 54.7 mtm-85 -64.28 -35.09 79.72 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 119.638 -0.825 . . . . 48.59 111.123 175.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.82 -29.04 69.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 119.833 -0.127 . . . . 31.64 111.051 175.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -84.89 -0.98 55.97 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 113.538 0.94 . . . . 25.63 113.538 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.55 3.57 49.95 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 115.972 1.149 . . . . 20.01 115.972 175.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -91.62 175.72 6.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 118.452 1.126 . . . . 18.96 110.591 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 82.6 p -85.83 -25.58 26.2 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 113.643 0.979 . . . . 26.45 113.643 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 175.37 -159.89 28.17 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 107.57 -2.212 . . . . 13.67 107.57 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 172.89 171.4 37.6 Favored Glycine 0 CA--C 1.496 -1.147 0 N-CA-C 110.2 -1.16 . . . . 11.82 110.2 -176.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.7 ptmm? -157.27 164.39 37.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.063 -1.068 . . . . 55.57 110.474 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 33.9 m -79.6 140.94 36.97 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.363 -1.29 . . . . 14.88 109.665 176.56 -50.768 -59.337 -71.421 102.595 1.982 106.72 -72.769 -167.488 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -139.41 147.2 41.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.493 0.664 . . . . 37.46 109.501 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 83.86 163.16 34.9 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 114.756 -1.111 . . . . 13.11 113.107 166.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.5 tp -59.77 -27.43 66.52 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.785 -0.707 . . . . 27.12 110.965 172.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . 0.449 ' NH1' ' O ' ' A' ' 101' ' ' HOH . 62.0 mtp180 -74.9 -10.94 59.97 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.551 0.575 . . . . 51.57 112.551 178.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 52.6 66.28 1.27 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 123.086 1.422 . . . . 18.98 110.569 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -107.76 148.52 29.36 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 113.808 -1.542 . . . . 27.43 108.832 175.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 31.2 t -85.51 122.77 30.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.448 -0.796 . . . . 9.73 110.757 176.191 172.971 54.299 85.951 105.662 2.038 104.26 61.262 169.966 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -116.54 119.71 36.43 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 124.169 0.918 . . . . 20.23 109.207 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 63.5 m -81.29 148.04 29.61 Favored 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 124.938 1.295 . . . . 11.91 109.998 178.569 -57.095 -44.489 -77.524 105.279 2.052 101.336 -73.89 -75.69 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . 0.49 HG22 ' HG2' ' A' ' 4' ' ' GLU . 37.8 p -131.83 150.34 52.18 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 123.644 0.778 . . . . 21.5 112.049 -176.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -160.26 168.54 25.12 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 106.834 -1.543 . . . . 34.97 106.834 171.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.08 139.76 54.82 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 109.649 -0.5 . . . . 27.61 109.649 171.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 62.0 m . . . . . 0 C--N 1.325 -0.477 0 C-N-CA 118.147 -1.421 . . . . 44.04 108.835 -179.194 -56.568 -79.287 114.722 108.489 2.047 105.865 65.094 -82.499 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 . . . . . 0 N--CA 1.493 1.695 0 N-CA-C 109.674 -0.491 . . . . 34.56 109.674 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.3 p -92.58 148.89 4.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.458 0 CA-C-O 121.554 0.692 . . . . 34.11 109.707 -178.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' CYS . . . . . 1.015 ' SG ' ' O ' ' B' ' 123' ' ' HOH . 83.8 m -128.32 161.45 29.36 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.299 -0.864 . . . . 20.82 110.0 172.469 -64.328 150.212 -131.543 101.196 2.001 95.837 121.323 -98.43 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -130.54 148.07 52.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.855 -1.066 . . . . 58.13 111.434 -174.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 24.3 t -150.15 127.94 11.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.546 -0.909 . . . . 15.58 108.546 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -57.61 143.05 42.67 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 108.944 -0.762 . . . . 43.92 108.944 179.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 27.3 t -63.66 143.06 58.14 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.192 0.52 . . . . 17.34 110.629 -177.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -97.16 -7.99 31.18 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 112.648 0.611 . . . . 43.38 112.648 174.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -113.88 -24.23 9.21 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 114.64 1.348 . . . . 53.93 114.64 -176.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -69.61 130.35 42.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 119.043 0.838 . . . . 15.38 109.98 -168.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -90.41 121.54 32.47 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 123.12 0.568 . . . . 25.52 109.914 -176.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 73.39 -156.79 51.49 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 118.124 -1.988 . . . . 23.18 116.06 168.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.62 136.33 45.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.496 -0.852 . . . . 27.1 111.235 -175.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' CYS . . . . . . . . . . . . . 11.1 t -89.87 108.06 19.48 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.712 0.805 . . . . 26.06 109.287 -177.651 -164.675 -76.38 -68.213 104.33 2.031 102.705 -55.064 -52.961 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' MET . . . . . . . . . . . . . 5.4 mmt -98.3 -51.14 4.08 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 120.782 -0.367 . . . . 65.92 110.637 177.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -99.8 119.24 6.44 Favored Glycine 0 C--N 1.308 -0.975 0 N-CA-C 111.958 -0.457 . . . . 27.12 111.958 -174.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -59.63 -37.88 79.84 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 119.474 -0.89 . . . . 59.9 110.969 179.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 8.2 t-80 -61.56 -39.31 90.66 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.384 -0.526 . . . . 53.22 111.216 -179.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 44.3 m-20 -64.06 -41.89 97.2 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 118.721 -1.191 . . . . 18.61 109.615 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' CYS . . . . . . . . . . . . . 15.0 t -62.81 -44.5 95.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.231 -0.441 . . . . 11.98 110.935 178.845 170.031 61.685 84.277 104.619 2.033 105.236 56.209 171.012 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.98 -43.16 81.39 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 112.497 0.555 . . . . 18.78 112.497 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 13.8 mt -68.12 -40.76 82.42 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 119.123 -1.031 . . . . 30.48 111.479 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.79 -45.59 97.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.631 0 CA-C-O 122.263 1.03 . . . . 15.39 109.593 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 67.0 m -63.66 -35.33 80.19 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.524 -0.735 . . . . 12.23 112.468 179.85 -72.439 -75.967 -76.019 100.258 2.009 104.781 -45.41 -58.699 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -64.13 -34.4 77.97 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 118.779 -1.169 . . . . 21.77 111.149 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -64.88 -23.57 67.27 Favored 'General case' 0 C--N 1.317 -0.824 0 O-C-N 121.98 -0.45 . . . . 74.42 112.009 173.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -88.2 4.37 45.91 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 112.945 0.72 . . . . 20.21 112.945 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.9 13.37 62.54 Favored Glycine 0 C--O 1.229 -0.207 0 N-CA-C 116.87 1.508 . . . . 18.7 116.87 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -97.8 168.65 10.19 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 125.094 1.358 . . . . 18.94 109.455 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 5.3 p -87.84 -23.18 24.08 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.93 -0.708 . . . . 28.76 112.603 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -171.05 -169.47 34.09 Favored Glycine 0 N--CA 1.44 -1.035 0 N-CA-C 109.979 -1.248 . . . . 17.71 109.979 -176.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 179.81 169.07 39.57 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 119.876 -1.154 . . . . 16.94 110.379 174.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LYS . . . . . 0.424 ' HB2' ' HE2' ' B' ' 33' ' ' LYS . 10.4 ptmm? -152.83 153.46 33.17 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.775 -0.824 . . . . 53.69 108.775 -178.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' CYS . . . . . . . . . . . . . 47.2 m -73.96 134.78 43.16 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 114.41 -1.268 . . . . 23.81 109.658 172.107 -52.961 -55.064 -68.213 102.705 2.031 104.33 -76.38 -164.675 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -148.15 164.59 33.44 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.621 0.724 . . . . 54.24 109.875 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLY . . . . . . . . . . . . . . . 91.02 161.45 37.4 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-N 114.49 -1.232 . . . . 32.15 112.921 171.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.38 -42.45 96.13 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 119.719 -0.793 . . . . 41.28 111.415 178.003 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ARG . . . . . 0.45 ' O ' ' HG2' ' B' ' 40' ' ' ARG . 9.4 mtt180 -88.1 100.51 13.0 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 104.988 -2.227 . . . . 52.18 104.988 166.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -59.02 103.05 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.824 -0.806 . . . . 56.01 108.824 -167.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' B' ' 38' ' ' ARG . 85.9 mmt-85 -118.46 155.81 30.15 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.568 0.699 . . . . 59.26 110.333 179.501 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' CYS . . . . . . . . . . . . . 18.4 t -90.0 122.35 32.93 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.442 -0.799 . . . . 12.11 109.269 -178.923 171.012 56.209 84.277 105.236 2.033 104.619 61.685 170.031 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -114.33 123.77 50.33 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 123.359 0.664 . . . . 20.06 109.405 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 73.6 m -88.66 149.41 23.53 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.101 -1.074 . . . . 11.89 108.101 -179.208 -58.699 -45.41 -76.019 104.781 2.009 100.258 -75.967 -72.439 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 28.8 p -130.71 150.6 51.82 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.993 -0.549 . . . . 18.92 110.875 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -159.82 171.48 19.4 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.668 -1.234 . . . . 51.92 107.668 173.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.55 134.95 39.28 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 118.99 -1.084 . . . . 59.04 108.912 172.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' CYS . . . . . 0.652 ' HB2' ' O ' ' B' ' 123' ' ' HOH . 1.2 m . . . . . 0 CA--C 1.506 -0.715 0 C-N-CA 114.376 -2.93 . . . . 78.05 112.59 177.496 -98.43 121.323 -131.543 95.837 2.001 101.196 150.212 -64.328 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . 0.449 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . 1.015 ' O ' ' SG ' ' B' ' 3' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 46.9 ttt180 . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 120.634 0.254 . . . . 41.88 111.284 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 83.9 t -98.75 134.67 36.66 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 CA-C-N 115.662 -0.699 . . . . 23.42 110.055 -172.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' B' ' 3' ' ' CYS . 13.4 m -115.23 150.76 35.64 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 125.179 1.392 . . . . 26.25 109.243 172.207 -82.499 65.094 114.722 105.865 2.047 108.489 -79.287 -56.568 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.49 ' HG2' HG22 ' A' ' 44' ' ' THR . 78.3 mt-10 -130.19 148.93 52.08 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.988 -1.006 . . . . 48.0 111.37 -178.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.2 t -150.14 130.33 13.62 Favored 'General case' 0 N--CA 1.462 0.132 0 N-CA-C 106.957 -1.497 . . . . 19.5 106.957 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.99 139.52 57.37 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 119.338 -0.945 . . . . 24.69 110.422 176.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.8 t -64.14 139.96 58.82 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 115.837 -0.62 . . . . 14.64 110.766 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.3 m170 -86.94 -26.93 23.63 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.054 -0.521 . . . . 31.27 111.996 173.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -97.13 -25.68 15.23 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 113.849 1.055 . . . . 51.87 113.849 -171.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -61.73 129.74 42.45 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 118.378 0.535 . . . . 17.3 109.755 -174.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -113.25 133.81 54.91 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 109.197 -0.668 . . . . 56.77 109.197 -174.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.05 -176.6 54.58 Favored Glycine 0 N--CA 1.445 -0.719 0 CA-C-O 122.943 1.302 . . . . 17.09 113.449 176.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.73 136.58 57.09 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-N 114.151 -1.025 . . . . 16.38 109.266 -179.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 17.0 t -85.33 105.02 15.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 106.913 -1.514 . . . . 15.81 106.913 177.781 -167.488 -72.769 -71.421 106.72 1.982 102.595 -59.337 -50.768 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 8.9 mmm -107.65 -19.43 13.55 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.117 -0.492 . . . . 44.31 111.649 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -132.87 113.05 1.19 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.164 -0.774 . . . . 23.48 111.164 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 95.6 m-20 -55.66 -36.94 67.61 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.782 -0.367 . . . . 31.27 111.541 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 80.9 t60 -66.89 -37.22 83.97 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 120.348 -0.541 . . . . 38.67 111.459 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 65.3 m-20 -64.56 -41.13 96.51 Favored 'General case' 0 CA--C 1.508 -0.644 0 C-N-CA 119.469 -0.893 . . . . 18.14 109.929 177.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.8 t -61.13 -44.41 97.37 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.356 -0.384 . . . . 10.82 110.153 176.562 169.966 61.262 85.951 104.26 2.038 105.662 54.299 172.971 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.81 -43.63 81.17 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.443 0.64 . . . . 11.81 111.861 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 98.0 mt -68.16 -42.8 79.53 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.735 -0.603 . . . . 25.95 111.511 -178.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 76.4 t -61.06 -42.04 91.59 Favored 'Isoleucine or valine' 0 C--O 1.239 0.533 0 C-N-CA 120.181 -0.607 . . . . 15.49 110.142 176.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 54.5 m -64.27 -37.29 86.95 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 122.096 -0.378 . . . . 13.47 111.697 -179.711 -75.69 -73.89 -77.524 101.336 2.052 105.279 -44.489 -57.095 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 54.7 mtm-85 -64.28 -35.09 79.72 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 119.638 -0.825 . . . . 48.59 111.123 175.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.82 -29.04 69.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 119.833 -0.127 . . . . 31.64 111.051 175.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 56.6 mt-10 -84.89 -0.98 55.97 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 113.538 0.94 . . . . 25.63 113.538 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.55 3.57 49.95 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 115.972 1.149 . . . . 20.01 115.972 175.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -91.62 175.72 6.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 118.452 1.126 . . . . 18.96 110.591 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 82.6 p -85.83 -25.58 26.2 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 113.643 0.979 . . . . 26.45 113.643 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 175.37 -159.89 28.17 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 107.57 -2.212 . . . . 13.67 107.57 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 172.89 171.4 37.6 Favored Glycine 0 CA--C 1.496 -1.147 0 N-CA-C 110.2 -1.16 . . . . 11.82 110.2 -176.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.7 ptmm? -157.27 164.39 37.72 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.063 -1.068 . . . . 55.57 110.474 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 33.9 m -79.6 140.94 36.97 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.363 -1.29 . . . . 14.88 109.665 176.56 -50.768 -59.337 -71.421 102.595 1.982 106.72 -72.769 -167.488 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -139.41 147.2 41.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.493 0.664 . . . . 37.46 109.501 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 83.86 163.16 34.9 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 114.756 -1.111 . . . . 13.11 113.107 166.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.5 tp -59.77 -27.43 66.52 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 114.785 -0.707 . . . . 27.12 110.965 172.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.449 ' NH1' ' O ' ' A' ' 101' ' ' HOH . 62.0 mtp180 -74.9 -10.94 59.97 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.551 0.575 . . . . 51.57 112.551 178.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 74.1 mtm180 52.6 66.28 1.27 Allowed 'General case' 0 C--O 1.237 0.42 0 CA-C-O 123.086 1.422 . . . . 18.98 110.569 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -107.76 148.52 29.36 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 113.808 -1.542 . . . . 27.43 108.832 175.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 31.2 t -85.51 122.77 30.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.448 -0.796 . . . . 9.73 110.757 176.191 172.971 54.299 85.951 105.662 2.038 104.26 61.262 169.966 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -116.54 119.71 36.43 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 124.169 0.918 . . . . 20.23 109.207 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 63.5 m -81.29 148.04 29.61 Favored 'General case' 0 C--O 1.211 -0.931 0 C-N-CA 124.938 1.295 . . . . 11.91 109.998 178.569 -57.095 -44.489 -77.524 105.279 2.052 101.336 -73.89 -75.69 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . 0.49 HG22 ' HG2' ' A' ' 4' ' ' GLU . 37.8 p -131.83 150.34 52.18 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 123.644 0.778 . . . . 21.5 112.049 -176.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -160.26 168.54 25.12 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 106.834 -1.543 . . . . 34.97 106.834 171.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.08 139.76 54.82 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 109.649 -0.5 . . . . 27.61 109.649 171.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 62.0 m . . . . . 0 C--N 1.325 -0.477 0 C-N-CA 118.147 -1.421 . . . . 44.04 108.835 -179.194 -56.568 -79.287 114.722 108.489 2.047 105.865 65.094 -82.499 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 . . . . . 0 N--CA 1.493 1.695 0 N-CA-C 109.674 -0.491 . . . . 34.56 109.674 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.3 p -92.58 148.89 4.4 Favored 'Isoleucine or valine' 0 C--N 1.37 1.458 0 CA-C-O 121.554 0.692 . . . . 34.11 109.707 -178.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' CYS . . . . . 1.015 ' SG ' ' O ' ' B' ' 123' ' ' HOH . 83.8 m -128.32 161.45 29.36 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.299 -0.864 . . . . 20.82 110.0 172.469 -64.328 150.212 -131.543 101.196 2.001 95.837 121.323 -98.43 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -130.54 148.07 52.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.855 -1.066 . . . . 58.13 111.434 -174.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 24.3 t -150.15 127.94 11.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.546 -0.909 . . . . 15.58 108.546 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -57.61 143.05 42.67 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 108.944 -0.762 . . . . 43.92 108.944 179.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 27.3 t -63.66 143.06 58.14 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.192 0.52 . . . . 17.34 110.629 -177.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -97.16 -7.99 31.18 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 112.648 0.611 . . . . 43.38 112.648 174.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -113.88 -24.23 9.21 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 114.64 1.348 . . . . 53.93 114.64 -176.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -69.61 130.35 42.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 119.043 0.838 . . . . 15.38 109.98 -168.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -90.41 121.54 32.47 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 123.12 0.568 . . . . 25.52 109.914 -176.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 73.39 -156.79 51.49 Favored Glycine 0 CA--C 1.527 0.84 0 C-N-CA 118.124 -1.988 . . . . 23.18 116.06 168.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.62 136.33 45.69 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.496 -0.852 . . . . 27.1 111.235 -175.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' CYS . . . . . . . . . . . . . 11.1 t -89.87 108.06 19.48 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.712 0.805 . . . . 26.06 109.287 -177.651 -164.675 -76.38 -68.213 104.33 2.031 102.705 -55.064 -52.961 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' MET . . . . . . . . . . . . . 5.4 mmt -98.3 -51.14 4.08 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 120.782 -0.367 . . . . 65.92 110.637 177.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -99.8 119.24 6.44 Favored Glycine 0 C--N 1.308 -0.975 0 N-CA-C 111.958 -0.457 . . . . 27.12 111.958 -174.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -59.63 -37.88 79.84 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 119.474 -0.89 . . . . 59.9 110.969 179.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 8.2 t-80 -61.56 -39.31 90.66 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.384 -0.526 . . . . 53.22 111.216 -179.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 44.3 m-20 -64.06 -41.89 97.2 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 118.721 -1.191 . . . . 18.61 109.615 179.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' CYS . . . . . . . . . . . . . 15.0 t -62.81 -44.5 95.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.231 -0.441 . . . . 11.98 110.935 178.845 170.031 61.685 84.277 104.619 2.033 105.236 56.209 171.012 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.98 -43.16 81.39 Favored 'General case' 0 C--O 1.241 0.64 0 N-CA-C 112.497 0.555 . . . . 18.78 112.497 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 13.8 mt -68.12 -40.76 82.42 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 119.123 -1.031 . . . . 30.48 111.479 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 75.7 t -60.79 -45.59 97.63 Favored 'Isoleucine or valine' 0 C--O 1.241 0.631 0 CA-C-O 122.263 1.03 . . . . 15.39 109.593 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 67.0 m -63.66 -35.33 80.19 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.524 -0.735 . . . . 12.23 112.468 179.85 -72.439 -75.967 -76.019 100.258 2.009 104.781 -45.41 -58.699 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 72.5 mtp85 -64.13 -34.4 77.97 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 118.779 -1.169 . . . . 21.77 111.149 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -64.88 -23.57 67.27 Favored 'General case' 0 C--N 1.317 -0.824 0 O-C-N 121.98 -0.45 . . . . 74.42 112.009 173.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -88.2 4.37 45.91 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 112.945 0.72 . . . . 20.21 112.945 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.9 13.37 62.54 Favored Glycine 0 C--O 1.229 -0.207 0 N-CA-C 116.87 1.508 . . . . 18.7 116.87 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -97.8 168.65 10.19 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 125.094 1.358 . . . . 18.94 109.455 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 5.3 p -87.84 -23.18 24.08 Favored 'General case' 0 C--N 1.31 -1.142 0 C-N-CA 119.93 -0.708 . . . . 28.76 112.603 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -171.05 -169.47 34.09 Favored Glycine 0 N--CA 1.44 -1.035 0 N-CA-C 109.979 -1.248 . . . . 17.71 109.979 -176.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 179.81 169.07 39.57 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 119.876 -1.154 . . . . 16.94 110.379 174.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.424 ' HB2' ' HE2' ' B' ' 33' ' ' LYS . 10.4 ptmm? -152.83 153.46 33.17 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.775 -0.824 . . . . 53.69 108.775 -178.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' CYS . . . . . . . . . . . . . 47.2 m -73.96 134.78 43.16 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 114.41 -1.268 . . . . 23.81 109.658 172.107 -52.961 -55.064 -68.213 102.705 2.031 104.33 -76.38 -164.675 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -148.15 164.59 33.44 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.621 0.724 . . . . 54.24 109.875 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLY . . . . . . . . . . . . . . . 91.02 161.45 37.4 Favored Glycine 0 N--CA 1.445 -0.725 0 CA-C-N 114.49 -1.232 . . . . 32.15 112.921 171.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.38 -42.45 96.13 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 119.719 -0.793 . . . . 41.28 111.415 178.003 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ARG . . . . . 0.45 ' O ' ' HG2' ' B' ' 40' ' ' ARG . 9.4 mtt180 -88.1 100.51 13.0 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 104.988 -2.227 . . . . 52.18 104.988 166.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -59.02 103.05 0.14 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.824 -0.806 . . . . 56.01 108.824 -167.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' B' ' 38' ' ' ARG . 85.9 mmt-85 -118.46 155.81 30.15 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.568 0.699 . . . . 59.26 110.333 179.501 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' CYS . . . . . . . . . . . . . 18.4 t -90.0 122.35 32.93 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.442 -0.799 . . . . 12.11 109.269 -178.923 171.012 56.209 84.277 105.236 2.033 104.619 61.685 170.031 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -114.33 123.77 50.33 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 123.359 0.664 . . . . 20.06 109.405 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' CYS . . . . . . . . . . . . . 73.6 m -88.66 149.41 23.53 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.101 -1.074 . . . . 11.89 108.101 -179.208 -58.699 -45.41 -76.019 104.781 2.009 100.258 -75.967 -72.439 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' THR . . . . . . . . . . . . . 28.8 p -130.71 150.6 51.82 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-N 115.993 -0.549 . . . . 18.92 110.875 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -159.82 171.48 19.4 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.668 -1.234 . . . . 51.92 107.668 173.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.55 134.95 39.28 Favored 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 118.99 -1.084 . . . . 59.04 108.912 172.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' CYS . . . . . 0.652 ' HB2' ' O ' ' B' ' 123' ' ' HOH . 1.2 m . . . . . 0 CA--C 1.506 -0.715 0 C-N-CA 114.376 -2.93 . . . . 78.05 112.59 177.496 -98.43 121.323 -131.543 95.837 2.001 101.196 150.212 -64.328 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . 0.449 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . 1.015 ' O ' ' SG ' ' B' ' 3' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_