data_4nem_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 4nem _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 CA--C 1.521 -0.157 0 CA-C-O 120.886 0.374 . . . . 80.400000000000006 111.717 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.4 p -76.66 -17.19 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.084 -1.08 . . . . 78.010000000000005 108.084 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -61.83 -46.11 90.9 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.301 -0.863 . . . . 123.72 109.727 169.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -63.64 -42.98 98.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.887 -0.597 . . . . 74.760000000000005 110.031 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 10.0 m -57.29 -48.06 79.87 Favored 'General case' 0 C--O 1.243 0.738 0 N-CA-C 112.45 0.537 . . . . 43.68 112.45 176.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -62.41 -44.08 97.28 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.218 -0.66 . . . . 87.780000000000001 109.218 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 27.0 tp -65.25 -38.91 91.83 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 118.856 -1.138 . . . . 43.159999999999997 110.317 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -61.27 -42.97 99.55 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 121.113 -0.235 . . . . 51.780000000000001 111.417 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.6 mt -65.32 -34.99 79.64 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.328 -0.549 . . . . 43.270000000000003 112.341 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -65.77 -39.66 91.26 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 109.037 -0.727 . . . . 47.329999999999998 109.037 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -65.55 -43.1 90.93 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.773 -0.825 . . . . 43.299999999999997 108.773 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.0 tp -55.78 -49.96 71.74 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.222 0.326 . . . . 36.57 110.353 174.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.6 tp -57.48 -48.55 78.93 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.955 -0.566 . . . . 37.969999999999999 110.405 -176.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 11.9 tp -66.6 -37.33 84.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.189 -0.459 . . . . 52.920000000000002 110.157 -176.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -65.11 -43.07 93.24 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.616 -0.834 . . . . 43.07 111.264 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 83.0 mt -66.66 -39.95 88.42 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.546 0.689 . . . . 32.530000000000001 110.884 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -63.27 -39.92 95.94 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.488 -0.778 . . . . 63.93 112.164 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 34.4 mtt -62.78 -39.15 93.31 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.435 -0.506 . . . . 54.049999999999997 111.631 177.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.5 -49.58 77.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.716 -0.394 . . . . 46.829999999999998 111.077 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 44.4 tp -58.1 -48.01 81.47 Favored 'General case' 0 C--O 1.242 0.689 0 CA-C-O 121.388 0.613 . . . . 34.759999999999998 111.666 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -60.97 -34.78 75.3 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.454 -0.794 . . . . 59.869999999999997 110.962 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.16 -38.39 82.86 Favored Glycine 0 C--O 1.224 -0.495 0 CA-C-N 115.255 -0.884 . . . . 44.770000000000003 113.52 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.7 pt -93.32 -29.58 4.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 C-N-CA 118.116 -1.434 . . . . 51.390000000000001 111.839 -176.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -93.05 69.18 4.44 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 110.142 -0.318 . . . . 55.609999999999999 110.142 -168.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -155.12 158.91 39.74 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 124.013 0.82 . . . . 83.659999999999997 111.92 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -79.28 -4.44 50.77 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.182 0.808 . . . . 91.730000000000004 113.182 -177.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -81.4 -2.56 49.89 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.227 -0.589 . . . . 92.030000000000001 109.836 173.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -104.39 104.91 47.31 Favored Pre-proline 0 N--CA 1.452 -0.339 0 CA-C-N 115.584 -0.735 . . . . 53.530000000000001 109.785 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.12 -25.82 26.52 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 124.273 3.315 . . . . 75.340000000000003 112.828 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -88.17 13.51 11.2 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.42 0.526 . . . . 92.180000000000007 112.42 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 19.6 tp -64.54 -47.81 77.39 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 118.349 -1.34 . . . . 41.479999999999997 111.878 -174.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 97.5 m -55.07 -46.86 75.45 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 119.874 -0.73 . . . . 46.100000000000001 111.844 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.3 mtp85 -63.77 -41.02 98.04 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 119.676 -0.81 . . . . 96.870000000000005 110.738 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 77.3 mtp -61.82 -31.08 71.3 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 112.536 0.569 . . . . 78.480000000000004 112.536 -178.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.7 mt -76.22 -7.51 55.02 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.57 0.952 . . . . 35.450000000000003 113.57 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.0 p -78.24 -17.5 56.61 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.141 0.793 . . . . 35.020000000000003 113.141 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -81.81 149.67 28.24 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.489 -0.484 . . . . 46.450000000000003 110.085 -174.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . 0.581 ' NZ ' ' O ' ' A' ' 313' ' ' HOH . 23.7 mmmt -105.14 132.59 51.17 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.564 0.579 . . . . 71.219999999999999 112.564 -173.496 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -118.23 141.82 48.12 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.485 -0.931 . . . . 39.5 108.485 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -93.92 142.64 27.14 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.251 -1.389 . . . . 77.810000000000002 107.251 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 60.6 mmm -115.18 146.13 35.66 Favored Pre-proline 0 N--CA 1.451 -0.395 0 O-C-N 123.912 0.757 . . . . 49.770000000000003 110.084 -168.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -66.73 135.22 37.72 Favored 'Trans proline' 0 CA--C 1.512 -0.58 0 O-C-N 122.54 0.758 . . . . 48.270000000000003 110.24 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -61.6 -40.77 95.99 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.955 0.784 . . . . 77.260000000000005 109.007 173.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -137.8 137.09 37.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.153 -0.476 . . . . 96.299999999999997 110.195 174.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.3 83.92 1.89 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.465 -0.494 . . . . 51.25 110.83 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.0 p -131.19 -11.92 3.63 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.934 0.716 . . . . 65.349999999999994 112.934 -175.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -131.52 157.33 43.85 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 110.288 -0.264 . . . . 91.239999999999995 110.288 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.1 mt -57.73 -32.37 67.36 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.991 -0.284 . . . . 52.039999999999999 111.251 -177.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.4 pttt -64.86 -20.96 66.69 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.423 -0.911 . . . . 75.040000000000006 110.552 -177.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -72.87 -9.21 58.43 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.348 0.499 . . . . 53.359999999999999 112.348 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.2 mt -60.59 -17.07 44.26 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.347 0.869 . . . . 44.079999999999998 113.347 173.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -51.38 -34.71 35.54 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.968 0.413 . . . . 88.780000000000001 110.215 173.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' CYS . . . . . 0.583 ' N ' ' SG ' ' A' ' 105' ' ' CYS . 59.6 m -70.23 -28.49 65.3 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.105 0.479 . . . . 56.369999999999997 109.98 -177.905 -74.19 18.24 -128.17 98.097 2.037 115.618 -87.583 -121.161 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 tp -75.81 -48.33 22.09 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.532 -0.544 . . . . 40.75 109.532 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . 0.492 ' OE1' ' NZ ' ' A' ' 97' ' ' LYS . 2.3 tt0 -54.37 -39.6 67.33 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.832 -0.622 . . . . 93.010000000000005 110.414 -176.714 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -73.7 -12.1 60.62 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.411 0.893 . . . . 69.670000000000002 113.411 -175.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -108.11 2.82 23.27 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.64 0.978 . . . . 73.870000000000005 113.64 175.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 50.1 mt -67.23 -34.23 77.03 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.073 -0.651 . . . . 46.630000000000003 111.692 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.7 tptp -67.42 -49.85 40.46 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 118.586 -1.246 . . . . 65.0 110.928 -177.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -60.45 -36.99 84.35 Favored 'Trans proline' 0 C--N 1.349 0.589 0 O-C-N 122.514 0.744 . . . . 74.799999999999997 113.155 175.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.6 tp -58.8 -44.31 90.73 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.799 -1.185 . . . . 45.630000000000003 107.799 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -62.46 -45.38 93.3 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.846 -1.07 . . . . 112.88 110.473 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -60.9 -40.95 95.06 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.471 -0.786 . . . . 93.599999999999994 111.454 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.59 -37.85 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 116.487 -0.324 . . . . 59.890000000000001 111.215 -177.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.55 -35.62 81.57 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.918 0.389 . . . . 67.680000000000007 110.413 171.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -61.51 -61.02 2.83 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.001 -0.545 . . . . 126.41 111.868 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 14.7 mt -68.85 11.75 0.18 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.055 -0.521 . . . . 151.27000000000001 112.107 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -114.87 7.46 15.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.403 -0.362 . . . . 117.39 110.678 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.993 -0.548 . . . . 120.95 110.694 175.837 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.7 t0 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.317 0.579 . . . . 111.79000000000001 111.499 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.82 -39.48 91.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.611 -0.722 . . . . 61.950000000000003 110.196 171.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 37.2 mm -63.05 -41.23 92.05 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.213 0.53 . . . . 52.659999999999997 110.381 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 p -62.97 -41.57 99.58 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 115.211 -0.904 . . . . 102.3 109.886 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -67.06 -40.08 86.99 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.23 -0.441 . . . . 96.340000000000003 111.049 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 83.1 mt -62.35 -43.31 97.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 108.26 -1.015 . . . . 34.030000000000001 108.26 177.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -59.95 -41.57 92.15 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 119.412 -0.915 . . . . 62.789999999999999 110.818 -177.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 44.5 t -64.4 -44.73 97.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.691 0.757 . . . . 34.07 110.339 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 77.5 mt -65.89 -44.92 92.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.559 0 C-N-CA 119.997 -0.681 . . . . 42.770000000000003 110.309 -175.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.2 t -59.01 -49.82 81.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.623 -0.717 . . . . 46.100000000000001 112.221 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.0 mt -54.39 -40.46 68.2 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.735 0.643 . . . . 55.420000000000002 112.735 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -81.12 -32.67 33.68 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.928 -0.578 . . . . 53.909999999999997 111.914 -174.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 33.8 mt -72.23 -29.94 64.43 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.559 -0.456 . . . . 59.149999999999999 111.225 173.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . 0.492 ' NZ ' ' OE1' ' A' ' 60' ' ' GLU . 14.4 ttpt . . . . . 0 C--N 1.327 -0.38 0 CA-C-O 121.121 0.486 . . . . 79.950000000000003 112.195 -173.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.3 t80 . . . . . 0 C--O 1.233 0.189 0 N-CA-C 112.973 0.731 . . . . 111.95999999999999 112.973 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 2.8 ttp -89.23 127.97 35.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.739 -0.664 . . . . 126.34 110.744 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' CYS . . . . . 0.583 ' SG ' ' N ' ' A' ' 58' ' ' CYS . 0.0 OUTLIER -74.84 129.76 38.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 114.398 1.258 . . . . 114.17 114.398 -166.234 -121.161 -87.583 -128.17 115.618 2.037 98.097 18.24 -74.19 3 3 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -103.38 133.55 48.25 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.582 -0.735 . . . . 114.18000000000001 109.948 174.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -111.22 144.95 39.57 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 120.384 -0.527 . . . . 60.0 111.159 -174.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.72 156.46 11.0 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.828 0.705 . . . . 55.969999999999999 110.386 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -74.52 -32.71 62.58 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.775 0.657 . . . . 93.579999999999998 112.775 -174.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -101.66 136.11 42.05 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.069 0.461 . . . . 138.34999999999999 112.129 -179.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 7.9 p -80.2 166.04 21.81 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.675 -0.693 . . . . 62.659999999999997 112.326 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -129.9 166.31 20.27 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.909 -0.587 . . . . 40.560000000000002 110.595 -177.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 27.6 p -77.48 166.3 23.26 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.946 -0.761 . . . . 33.960000000000001 108.946 171.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 19.6 tt -55.95 -34.4 37.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.248 -0.887 . . . . 37.990000000000002 109.995 177.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 41.5 t -70.68 -45.15 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 112.116 0.414 . . . . 37.560000000000002 112.116 -178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -67.2 -36.45 81.77 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 119.831 -0.748 . . . . 114.42 110.932 177.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -57.71 -50.32 73.6 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 121.039 0.447 . . . . 37.68 109.975 176.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 63.9 mt -64.69 -43.89 92.06 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 120.207 -0.597 . . . . 34.649999999999999 110.914 -179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.1 m-20 -61.38 -34.22 74.96 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.905 -0.718 . . . . 51.590000000000003 110.963 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 -64.61 -46.01 84.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.618 -0.719 . . . . 93.379999999999995 111.155 179.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -80.14 -20.28 45.3 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.076 -0.65 . . . . 35.549999999999997 111.621 -175.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 71.2 mt -68.62 -46.46 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.468 -0.333 . . . . 35.880000000000003 110.491 169.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 89.8 m -60.67 -44.41 96.5 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 112.621 0.6 . . . . 44.689999999999998 112.621 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -55.02 -48.75 72.96 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 120.963 0.411 . . . . 45.299999999999997 109.994 175.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 75.3 m -61.96 -44.38 96.86 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.223 -0.591 . . . . 42.390000000000001 110.141 -175.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -62.08 -39.17 91.51 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.427 0.632 . . . . 77.609999999999999 111.918 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.9 m -61.69 -50.72 71.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.308 -0.86 . . . . 62.420000000000002 112.932 178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.2 mm -62.45 -43.01 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 C-N-CA 119.261 -0.975 . . . . 53.299999999999997 110.714 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.1 mt -52.53 -42.19 38.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 CA-C-O 121.092 0.472 . . . . 52.32 111.763 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.5 p -69.42 -28.41 66.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.876 -0.602 . . . . 93.540000000000006 112.034 -177.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' THR . . . . . . . . . . . . . 6.4 p -83.65 8.62 13.8 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.816 0.341 . . . . 85.319999999999993 111.695 178.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.5 mt -122.13 9.39 9.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.379 -0.373 . . . . 95.120000000000005 110.224 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 6.0 m . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.483 -0.326 . . . . 92.489999999999995 110.579 179.443 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' 2JY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . 0.581 ' O ' ' NZ ' ' A' ' 43' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 CA--C 1.521 -0.157 0 CA-C-O 120.886 0.374 . . . . 80.400000000000006 111.717 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.4 p -76.66 -17.19 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.084 -1.08 . . . . 78.010000000000005 108.084 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -61.83 -46.11 90.9 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.301 -0.863 . . . . 123.72 109.727 169.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -63.64 -42.98 98.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.887 -0.597 . . . . 74.760000000000005 110.031 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 10.0 m -57.29 -48.06 79.87 Favored 'General case' 0 C--O 1.243 0.738 0 N-CA-C 112.45 0.537 . . . . 43.68 112.45 176.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -62.41 -44.08 97.28 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.218 -0.66 . . . . 87.780000000000001 109.218 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . 0.443 HD23 ' C02' ' A' ' 201' ' ' 2JY . 27.0 tp -65.25 -38.91 91.83 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 118.856 -1.138 . . . . 43.159999999999997 110.317 -177.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -61.27 -42.97 99.55 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 121.113 -0.235 . . . . 51.780000000000001 111.417 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.6 mt -65.32 -34.99 79.64 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.328 -0.549 . . . . 43.270000000000003 112.341 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -65.77 -39.66 91.26 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 109.037 -0.727 . . . . 47.329999999999998 109.037 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -65.55 -43.1 90.93 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.773 -0.825 . . . . 43.299999999999997 108.773 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.0 tp -55.78 -49.96 71.74 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.222 0.326 . . . . 36.57 110.353 174.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . 0.449 ' CD1' HG23 ' A' ' 122' ' ' ILE . 25.6 tp -57.48 -48.55 78.93 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.955 -0.566 . . . . 37.969999999999999 110.405 -176.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 23' ' ' MET . 11.9 tp -66.6 -37.33 84.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.189 -0.459 . . . . 52.920000000000002 110.157 -176.86 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -65.11 -43.07 93.24 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.616 -0.834 . . . . 43.07 111.264 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 83.0 mt -66.66 -39.95 88.42 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.546 0.689 . . . . 32.530000000000001 110.884 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -63.27 -39.92 95.94 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.488 -0.778 . . . . 63.93 112.164 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' MET . . . . . 0.488 ' HG3' ' O ' ' A' ' 19' ' ' LEU . 34.4 mtt -62.78 -39.15 93.31 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.435 -0.506 . . . . 54.049999999999997 111.631 177.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.5 -49.58 77.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.716 -0.394 . . . . 46.829999999999998 111.077 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 44.4 tp -58.1 -48.01 81.47 Favored 'General case' 0 C--O 1.242 0.689 0 CA-C-O 121.388 0.613 . . . . 34.759999999999998 111.666 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -60.97 -34.78 75.3 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.454 -0.794 . . . . 59.869999999999997 110.962 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.16 -38.39 82.86 Favored Glycine 0 C--O 1.224 -0.495 0 CA-C-N 115.255 -0.884 . . . . 44.770000000000003 113.52 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.7 pt -93.32 -29.58 4.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 C-N-CA 118.116 -1.434 . . . . 51.390000000000001 111.839 -176.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -93.05 69.18 4.44 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 110.142 -0.318 . . . . 55.609999999999999 110.142 -168.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -155.12 158.91 39.74 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 124.013 0.82 . . . . 83.659999999999997 111.92 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -79.28 -4.44 50.77 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.182 0.808 . . . . 91.730000000000004 113.182 -177.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -81.4 -2.56 49.89 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.227 -0.589 . . . . 92.030000000000001 109.836 173.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -104.39 104.91 47.31 Favored Pre-proline 0 N--CA 1.452 -0.339 0 CA-C-N 115.584 -0.735 . . . . 53.530000000000001 109.785 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.12 -25.82 26.52 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 124.273 3.315 . . . . 75.340000000000003 112.828 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -88.17 13.51 11.2 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.42 0.526 . . . . 92.180000000000007 112.42 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 19.6 tp -64.54 -47.81 77.39 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 118.349 -1.34 . . . . 41.479999999999997 111.878 -174.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 97.5 m -55.07 -46.86 75.45 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 119.874 -0.73 . . . . 46.100000000000001 111.844 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.3 mtp85 -63.77 -41.02 98.04 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 119.676 -0.81 . . . . 96.870000000000005 110.738 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 77.3 mtp -61.82 -31.08 71.3 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 112.536 0.569 . . . . 78.480000000000004 112.536 -178.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.7 mt -76.22 -7.51 55.02 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.57 0.952 . . . . 35.450000000000003 113.57 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.0 p -78.24 -17.5 56.61 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.141 0.793 . . . . 35.020000000000003 113.141 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -81.81 149.67 28.24 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.489 -0.484 . . . . 46.450000000000003 110.085 -174.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . 0.445 ' NZ ' ' O ' ' A' ' 313' ' ' HOH . 23.7 mmmt -105.14 132.59 51.17 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.564 0.579 . . . . 71.219999999999999 112.564 -173.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -118.23 141.82 48.12 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.485 -0.931 . . . . 39.5 108.485 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -93.92 142.64 27.14 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.251 -1.389 . . . . 77.810000000000002 107.251 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 60.6 mmm -115.18 146.13 35.66 Favored Pre-proline 0 N--CA 1.451 -0.395 0 O-C-N 123.912 0.757 . . . . 49.770000000000003 110.084 -168.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -66.73 135.22 37.72 Favored 'Trans proline' 0 CA--C 1.512 -0.58 0 O-C-N 122.54 0.758 . . . . 48.270000000000003 110.24 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -61.6 -40.77 95.99 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.955 0.784 . . . . 77.260000000000005 109.007 173.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -137.8 137.09 37.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.153 -0.476 . . . . 96.299999999999997 110.195 174.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.3 83.92 1.89 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.465 -0.494 . . . . 51.25 110.83 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.0 p -131.19 -11.92 3.63 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.934 0.716 . . . . 65.349999999999994 112.934 -175.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -131.52 157.33 43.85 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 110.288 -0.264 . . . . 91.239999999999995 110.288 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.1 mt -57.73 -32.37 67.36 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.991 -0.284 . . . . 52.039999999999999 111.251 -177.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.4 pttt -64.86 -20.96 66.69 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.423 -0.911 . . . . 75.040000000000006 110.552 -177.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -72.87 -9.21 58.43 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.348 0.499 . . . . 53.359999999999999 112.348 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.2 mt -60.59 -17.07 44.26 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.347 0.869 . . . . 44.079999999999998 113.347 173.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -51.38 -34.71 35.54 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.968 0.413 . . . . 88.780000000000001 110.215 173.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' CYS . . . . . 0.583 ' N ' ' SG ' ' A' ' 105' ' ' CYS . 59.6 m -70.23 -28.49 65.3 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.105 0.479 . . . . 56.369999999999997 109.98 -177.905 -74.19 18.24 -128.17 98.097 2.037 115.618 -87.583 -121.161 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 tp -75.81 -48.33 22.09 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.532 -0.544 . . . . 40.75 109.532 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . 0.451 ' OE1' ' NZ ' ' A' ' 97' ' ' LYS . 2.3 tt0 -54.37 -39.6 67.33 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.832 -0.622 . . . . 93.010000000000005 110.414 -176.714 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -73.7 -12.1 60.62 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.411 0.893 . . . . 69.670000000000002 113.411 -175.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -108.11 2.82 23.27 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.64 0.978 . . . . 73.870000000000005 113.64 175.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 50.1 mt -67.23 -34.23 77.03 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.073 -0.651 . . . . 46.630000000000003 111.692 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . 0.488 ' HB3' ' HD3' ' A' ' 65' ' ' PRO . 10.7 tptp -67.42 -49.85 40.46 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 118.586 -1.246 . . . . 65.0 110.928 -177.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PRO . . . . . 0.488 ' HD3' ' HB3' ' A' ' 64' ' ' LYS . 39.8 Cg_exo -60.45 -36.99 84.35 Favored 'Trans proline' 0 C--N 1.349 0.589 0 O-C-N 122.514 0.744 . . . . 74.799999999999997 113.155 175.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.6 tp -58.8 -44.31 90.73 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.799 -1.185 . . . . 45.630000000000003 107.799 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -62.46 -45.38 93.3 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.846 -1.07 . . . . 112.88 110.473 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -60.9 -40.95 95.06 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.471 -0.786 . . . . 93.599999999999994 111.454 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.59 -37.85 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 116.487 -0.324 . . . . 59.890000000000001 111.215 -177.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.55 -35.62 81.57 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.918 0.389 . . . . 67.680000000000007 110.413 171.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -61.51 -61.02 2.83 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.001 -0.545 . . . . 126.41 111.868 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 14.7 mt -68.85 11.75 0.18 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.055 -0.521 . . . . 151.27000000000001 112.107 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -114.87 7.46 15.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.403 -0.362 . . . . 117.39 110.678 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.993 -0.548 . . . . 120.95 110.694 175.837 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.7 t0 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.317 0.579 . . . . 111.79000000000001 111.499 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.82 -39.48 91.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.611 -0.722 . . . . 61.950000000000003 110.196 171.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 37.2 mm -63.05 -41.23 92.05 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.213 0.53 . . . . 52.659999999999997 110.381 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 p -62.97 -41.57 99.58 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 115.211 -0.904 . . . . 102.3 109.886 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -67.06 -40.08 86.99 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.23 -0.441 . . . . 96.340000000000003 111.049 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 83.1 mt -62.35 -43.31 97.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 108.26 -1.015 . . . . 34.030000000000001 108.26 177.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -59.95 -41.57 92.15 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 119.412 -0.915 . . . . 62.789999999999999 110.818 -177.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 44.5 t -64.4 -44.73 97.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.691 0.757 . . . . 34.07 110.339 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 77.5 mt -65.89 -44.92 92.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.559 0 C-N-CA 119.997 -0.681 . . . . 42.770000000000003 110.309 -175.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.2 t -59.01 -49.82 81.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.623 -0.717 . . . . 46.100000000000001 112.221 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.0 mt -54.39 -40.46 68.2 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.735 0.643 . . . . 55.420000000000002 112.735 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -81.12 -32.67 33.68 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.928 -0.578 . . . . 53.909999999999997 111.914 -174.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 33.8 mt -72.23 -29.94 64.43 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.559 -0.456 . . . . 59.149999999999999 111.225 173.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . 0.451 ' NZ ' ' OE1' ' A' ' 60' ' ' GLU . 14.4 ttpt . . . . . 0 C--N 1.327 -0.38 0 CA-C-O 121.121 0.486 . . . . 79.950000000000003 112.195 -173.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.3 t80 . . . . . 0 C--O 1.233 0.189 0 N-CA-C 112.973 0.731 . . . . 111.95999999999999 112.973 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 2.8 ttp -89.23 127.97 35.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.739 -0.664 . . . . 126.34 110.744 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' CYS . . . . . 0.583 ' SG ' ' N ' ' A' ' 58' ' ' CYS . 0.0 OUTLIER -74.84 129.76 38.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 114.398 1.258 . . . . 114.17 114.398 -166.234 -121.161 -87.583 -128.17 115.618 2.037 98.097 18.24 -74.19 3 3 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -103.38 133.55 48.25 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.582 -0.735 . . . . 114.18000000000001 109.948 174.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -111.22 144.95 39.57 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 120.384 -0.527 . . . . 60.0 111.159 -174.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.72 156.46 11.0 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.828 0.705 . . . . 55.969999999999999 110.386 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -74.52 -32.71 62.58 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.775 0.657 . . . . 93.579999999999998 112.775 -174.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -101.66 136.11 42.05 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.069 0.461 . . . . 138.34999999999999 112.129 -179.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 7.9 p -80.2 166.04 21.81 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.675 -0.693 . . . . 62.659999999999997 112.326 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 116' ' ' GLU . . . -129.9 166.31 20.27 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.909 -0.587 . . . . 40.560000000000002 110.595 -177.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 27.6 p -77.48 166.3 23.26 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.946 -0.761 . . . . 33.960000000000001 108.946 171.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 19.6 tt -55.95 -34.4 37.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.248 -0.887 . . . . 37.990000000000002 109.995 177.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 41.5 t -70.68 -45.15 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 112.116 0.414 . . . . 37.560000000000002 112.116 -178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLU . . . . . 0.553 ' HB3' ' HB1' ' A' ' 112' ' ' ALA . 4.6 tt0 -67.2 -36.45 81.77 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 119.831 -0.748 . . . . 114.42 110.932 177.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -57.71 -50.32 73.6 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 121.039 0.447 . . . . 37.68 109.975 176.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 63.9 mt -64.69 -43.89 92.06 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 120.207 -0.597 . . . . 34.649999999999999 110.914 -179.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.1 m-20 -61.38 -34.22 74.96 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.905 -0.718 . . . . 51.590000000000003 110.963 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 -64.61 -46.01 84.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.618 -0.719 . . . . 93.379999999999995 111.155 179.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -80.14 -20.28 45.3 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.076 -0.65 . . . . 35.549999999999997 111.621 -175.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ILE . . . . . 0.449 HG23 ' CD1' ' A' ' 18' ' ' LEU . 71.2 mt -68.62 -46.46 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.468 -0.333 . . . . 35.880000000000003 110.491 169.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 89.8 m -60.67 -44.41 96.5 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 112.621 0.6 . . . . 44.689999999999998 112.621 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -55.02 -48.75 72.96 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 120.963 0.411 . . . . 45.299999999999997 109.994 175.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 75.3 m -61.96 -44.38 96.86 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.223 -0.591 . . . . 42.390000000000001 110.141 -175.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -62.08 -39.17 91.51 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.427 0.632 . . . . 77.609999999999999 111.918 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' SER . . . . . 0.45 ' O ' HG23 ' A' ' 131' ' ' THR . 16.9 m -61.69 -50.72 71.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.308 -0.86 . . . . 62.420000000000002 112.932 178.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.2 mm -62.45 -43.01 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 C-N-CA 119.261 -0.975 . . . . 53.299999999999997 110.714 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.1 mt -52.53 -42.19 38.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 CA-C-O 121.092 0.472 . . . . 52.32 111.763 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.5 p -69.42 -28.41 66.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.876 -0.602 . . . . 93.540000000000006 112.034 -177.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 127' ' ' SER . 6.4 p -83.65 8.62 13.8 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.816 0.341 . . . . 85.319999999999993 111.695 178.994 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.5 mt -122.13 9.39 9.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.379 -0.373 . . . . 95.120000000000005 110.224 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 6.0 m . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.483 -0.326 . . . . 92.489999999999995 110.579 179.443 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' 2JY . . . . . 0.443 ' C02' HD23 ' A' ' 12' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . 0.445 ' O ' ' NZ ' ' A' ' 43' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 15.3 t . . . . . 0 CA--C 1.521 -0.157 0 CA-C-O 120.886 0.374 . . . . 80.400000000000006 111.717 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.4 p -76.66 -17.19 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.084 -1.08 . . . . 78.010000000000005 108.084 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -61.83 -46.11 90.9 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.301 -0.863 . . . . 123.72 109.727 169.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -63.64 -42.98 98.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.887 -0.597 . . . . 74.760000000000005 110.031 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 10.0 m -57.29 -48.06 79.87 Favored 'General case' 0 C--O 1.243 0.738 0 N-CA-C 112.45 0.537 . . . . 43.68 112.45 176.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -62.41 -44.08 97.28 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 109.218 -0.66 . . . . 87.780000000000001 109.218 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.443 HD23 ' C02' ' A' ' 201' ' ' 2JY . 27.0 tp -65.25 -38.91 91.83 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 118.856 -1.138 . . . . 43.159999999999997 110.317 -177.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -61.27 -42.97 99.55 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 121.113 -0.235 . . . . 51.780000000000001 111.417 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.6 mt -65.32 -34.99 79.64 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.328 -0.549 . . . . 43.270000000000003 112.341 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -65.77 -39.66 91.26 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 109.037 -0.727 . . . . 47.329999999999998 109.037 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -65.55 -43.1 90.93 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.773 -0.825 . . . . 43.299999999999997 108.773 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.0 tp -55.78 -49.96 71.74 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.222 0.326 . . . . 36.57 110.353 174.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.449 ' CD1' HG23 ' A' ' 122' ' ' ILE . 25.6 tp -57.48 -48.55 78.93 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.955 -0.566 . . . . 37.969999999999999 110.405 -176.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 23' ' ' MET . 11.9 tp -66.6 -37.33 84.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.189 -0.459 . . . . 52.920000000000002 110.157 -176.86 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -65.11 -43.07 93.24 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.616 -0.834 . . . . 43.07 111.264 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 83.0 mt -66.66 -39.95 88.42 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.546 0.689 . . . . 32.530000000000001 110.884 -179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -63.27 -39.92 95.94 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.488 -0.778 . . . . 63.93 112.164 176.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' MET . . . . . 0.488 ' HG3' ' O ' ' A' ' 19' ' ' LEU . 34.4 mtt -62.78 -39.15 93.31 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.435 -0.506 . . . . 54.049999999999997 111.631 177.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 96.1 mt -65.5 -49.58 77.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.716 -0.394 . . . . 46.829999999999998 111.077 176.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 44.4 tp -58.1 -48.01 81.47 Favored 'General case' 0 C--O 1.242 0.689 0 CA-C-O 121.388 0.613 . . . . 34.759999999999998 111.666 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -60.97 -34.78 75.3 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.454 -0.794 . . . . 59.869999999999997 110.962 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.16 -38.39 82.86 Favored Glycine 0 C--O 1.224 -0.495 0 CA-C-N 115.255 -0.884 . . . . 44.770000000000003 113.52 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.7 pt -93.32 -29.58 4.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 C-N-CA 118.116 -1.434 . . . . 51.390000000000001 111.839 -176.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -93.05 69.18 4.44 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 110.142 -0.318 . . . . 55.609999999999999 110.142 -168.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -155.12 158.91 39.74 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 124.013 0.82 . . . . 83.659999999999997 111.92 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -79.28 -4.44 50.77 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 113.182 0.808 . . . . 91.730000000000004 113.182 -177.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -81.4 -2.56 49.89 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.227 -0.589 . . . . 92.030000000000001 109.836 173.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -104.39 104.91 47.31 Favored Pre-proline 0 N--CA 1.452 -0.339 0 CA-C-N 115.584 -0.735 . . . . 53.530000000000001 109.785 177.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.12 -25.82 26.52 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 124.273 3.315 . . . . 75.340000000000003 112.828 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -88.17 13.51 11.2 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 112.42 0.526 . . . . 92.180000000000007 112.42 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 19.6 tp -64.54 -47.81 77.39 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 118.349 -1.34 . . . . 41.479999999999997 111.878 -174.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 97.5 m -55.07 -46.86 75.45 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 119.874 -0.73 . . . . 46.100000000000001 111.844 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.3 mtp85 -63.77 -41.02 98.04 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 119.676 -0.81 . . . . 96.870000000000005 110.738 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 77.3 mtp -61.82 -31.08 71.3 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 112.536 0.569 . . . . 78.480000000000004 112.536 -178.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.7 mt -76.22 -7.51 55.02 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 113.57 0.952 . . . . 35.450000000000003 113.57 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.0 p -78.24 -17.5 56.61 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.141 0.793 . . . . 35.020000000000003 113.141 178.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -81.81 149.67 28.24 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.489 -0.484 . . . . 46.450000000000003 110.085 -174.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.445 ' NZ ' ' O ' ' A' ' 313' ' ' HOH . 23.7 mmmt -105.14 132.59 51.17 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.564 0.579 . . . . 71.219999999999999 112.564 -173.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -118.23 141.82 48.12 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.485 -0.931 . . . . 39.5 108.485 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -93.92 142.64 27.14 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 107.251 -1.389 . . . . 77.810000000000002 107.251 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 60.6 mmm -115.18 146.13 35.66 Favored Pre-proline 0 N--CA 1.451 -0.395 0 O-C-N 123.912 0.757 . . . . 49.770000000000003 110.084 -168.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -66.73 135.22 37.72 Favored 'Trans proline' 0 CA--C 1.512 -0.58 0 O-C-N 122.54 0.758 . . . . 48.270000000000003 110.24 -176.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -61.6 -40.77 95.99 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.955 0.784 . . . . 77.260000000000005 109.007 173.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -137.8 137.09 37.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.153 -0.476 . . . . 96.299999999999997 110.195 174.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.3 83.92 1.89 Allowed 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.465 -0.494 . . . . 51.25 110.83 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.0 p -131.19 -11.92 3.63 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.934 0.716 . . . . 65.349999999999994 112.934 -175.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -131.52 157.33 43.85 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 110.288 -0.264 . . . . 91.239999999999995 110.288 -178.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.1 mt -57.73 -32.37 67.36 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.991 -0.284 . . . . 52.039999999999999 111.251 -177.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.4 pttt -64.86 -20.96 66.69 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.423 -0.911 . . . . 75.040000000000006 110.552 -177.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 36.6 m170 -72.87 -9.21 58.43 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.348 0.499 . . . . 53.359999999999999 112.348 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.2 mt -60.59 -17.07 44.26 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.347 0.869 . . . . 44.079999999999998 113.347 173.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -51.38 -34.71 35.54 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 120.968 0.413 . . . . 88.780000000000001 110.215 173.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.583 ' N ' ' SG ' ' A' ' 105' ' ' CYS . 59.6 m -70.23 -28.49 65.3 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.105 0.479 . . . . 56.369999999999997 109.98 -177.905 -74.19 18.24 -128.17 98.097 2.037 115.618 -87.583 -121.161 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 tp -75.81 -48.33 22.09 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.532 -0.544 . . . . 40.75 109.532 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.451 ' OE1' ' NZ ' ' A' ' 97' ' ' LYS . 2.3 tt0 -54.37 -39.6 67.33 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 115.832 -0.622 . . . . 93.010000000000005 110.414 -176.714 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -73.7 -12.1 60.62 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 113.411 0.893 . . . . 69.670000000000002 113.411 -175.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -108.11 2.82 23.27 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 113.64 0.978 . . . . 73.870000000000005 113.64 175.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 50.1 mt -67.23 -34.23 77.03 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.073 -0.651 . . . . 46.630000000000003 111.692 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.488 ' HB3' ' HD3' ' A' ' 65' ' ' PRO . 10.7 tptp -67.42 -49.85 40.46 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 118.586 -1.246 . . . . 65.0 110.928 -177.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.488 ' HD3' ' HB3' ' A' ' 64' ' ' LYS . 39.8 Cg_exo -60.45 -36.99 84.35 Favored 'Trans proline' 0 C--N 1.349 0.589 0 O-C-N 122.514 0.744 . . . . 74.799999999999997 113.155 175.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.6 tp -58.8 -44.31 90.73 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 107.799 -1.185 . . . . 45.630000000000003 107.799 179.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -62.46 -45.38 93.3 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 114.846 -1.07 . . . . 112.88 110.473 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -60.9 -40.95 95.06 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.471 -0.786 . . . . 93.599999999999994 111.454 -177.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.59 -37.85 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 116.487 -0.324 . . . . 59.890000000000001 111.215 -177.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 79.1 mt -64.55 -35.62 81.57 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.918 0.389 . . . . 67.680000000000007 110.413 171.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -61.51 -61.02 2.83 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.001 -0.545 . . . . 126.41 111.868 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 14.7 mt -68.85 11.75 0.18 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.055 -0.521 . . . . 151.27000000000001 112.107 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -114.87 7.46 15.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.403 -0.362 . . . . 117.39 110.678 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.993 -0.548 . . . . 120.95 110.694 175.837 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 23.7 t0 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.317 0.579 . . . . 111.79000000000001 111.499 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.82 -39.48 91.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.611 -0.722 . . . . 61.950000000000003 110.196 171.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 37.2 mm -63.05 -41.23 92.05 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.213 0.53 . . . . 52.659999999999997 110.381 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.3 p -62.97 -41.57 99.58 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-N 115.211 -0.904 . . . . 102.3 109.886 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -67.06 -40.08 86.99 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.23 -0.441 . . . . 96.340000000000003 111.049 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 83.1 mt -62.35 -43.31 97.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 108.26 -1.015 . . . . 34.030000000000001 108.26 177.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -59.95 -41.57 92.15 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 119.412 -0.915 . . . . 62.789999999999999 110.818 -177.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 44.5 t -64.4 -44.73 97.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.691 0.757 . . . . 34.07 110.339 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 77.5 mt -65.89 -44.92 92.46 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.559 0 C-N-CA 119.997 -0.681 . . . . 42.770000000000003 110.309 -175.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 52.2 t -59.01 -49.82 81.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.623 -0.717 . . . . 46.100000000000001 112.221 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 27.0 mt -54.39 -40.46 68.2 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.735 0.643 . . . . 55.420000000000002 112.735 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -81.12 -32.67 33.68 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.928 -0.578 . . . . 53.909999999999997 111.914 -174.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 33.8 mt -72.23 -29.94 64.43 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.559 -0.456 . . . . 59.149999999999999 111.225 173.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.451 ' NZ ' ' OE1' ' A' ' 60' ' ' GLU . 14.4 ttpt . . . . . 0 C--N 1.327 -0.38 0 CA-C-O 121.121 0.486 . . . . 79.950000000000003 112.195 -173.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 85.3 t80 . . . . . 0 C--O 1.233 0.189 0 N-CA-C 112.973 0.731 . . . . 111.95999999999999 112.973 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 2.8 ttp -89.23 127.97 35.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.739 -0.664 . . . . 126.34 110.744 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.583 ' SG ' ' N ' ' A' ' 58' ' ' CYS . 0.0 OUTLIER -74.84 129.76 38.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 114.398 1.258 . . . . 114.17 114.398 -166.234 -121.161 -87.583 -128.17 115.618 2.037 98.097 18.24 -74.19 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -103.38 133.55 48.25 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.582 -0.735 . . . . 114.18000000000001 109.948 174.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -111.22 144.95 39.57 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 120.384 -0.527 . . . . 60.0 111.159 -174.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.72 156.46 11.0 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.828 0.705 . . . . 55.969999999999999 110.386 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -74.52 -32.71 62.58 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.775 0.657 . . . . 93.579999999999998 112.775 -174.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -101.66 136.11 42.05 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.069 0.461 . . . . 138.34999999999999 112.129 -179.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 7.9 p -80.2 166.04 21.81 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.675 -0.693 . . . . 62.659999999999997 112.326 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 116' ' ' GLU . . . -129.9 166.31 20.27 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.909 -0.587 . . . . 40.560000000000002 110.595 -177.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 27.6 p -77.48 166.3 23.26 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.946 -0.761 . . . . 33.960000000000001 108.946 171.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 19.6 tt -55.95 -34.4 37.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.248 -0.887 . . . . 37.990000000000002 109.995 177.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 41.5 t -70.68 -45.15 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 112.116 0.414 . . . . 37.560000000000002 112.116 -178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.553 ' HB3' ' HB1' ' A' ' 112' ' ' ALA . 4.6 tt0 -67.2 -36.45 81.77 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 119.831 -0.748 . . . . 114.42 110.932 177.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -57.71 -50.32 73.6 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-O 121.039 0.447 . . . . 37.68 109.975 176.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 63.9 mt -64.69 -43.89 92.06 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 120.207 -0.597 . . . . 34.649999999999999 110.914 -179.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.1 m-20 -61.38 -34.22 74.96 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.905 -0.718 . . . . 51.590000000000003 110.963 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 -64.61 -46.01 84.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.618 -0.719 . . . . 93.379999999999995 111.155 179.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 90.0 m95 -80.14 -20.28 45.3 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.076 -0.65 . . . . 35.549999999999997 111.621 -175.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.449 HG23 ' CD1' ' A' ' 18' ' ' LEU . 71.2 mt -68.62 -46.46 79.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.468 -0.333 . . . . 35.880000000000003 110.491 169.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 89.8 m -60.67 -44.41 96.5 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 112.621 0.6 . . . . 44.689999999999998 112.621 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -55.02 -48.75 72.96 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 120.963 0.411 . . . . 45.299999999999997 109.994 175.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 75.3 m -61.96 -44.38 96.86 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.223 -0.591 . . . . 42.390000000000001 110.141 -175.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -62.08 -39.17 91.51 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.427 0.632 . . . . 77.609999999999999 111.918 179.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' SER . . . . . 0.45 ' O ' HG23 ' A' ' 131' ' ' THR . 16.9 m -61.69 -50.72 71.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.308 -0.86 . . . . 62.420000000000002 112.932 178.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.2 mm -62.45 -43.01 97.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 C-N-CA 119.261 -0.975 . . . . 53.299999999999997 110.714 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ILE . . . . . . . . . . . . . 46.1 mt -52.53 -42.19 38.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.621 0 CA-C-O 121.092 0.472 . . . . 52.32 111.763 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.5 p -69.42 -28.41 66.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.876 -0.602 . . . . 93.540000000000006 112.034 -177.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 127' ' ' SER . 6.4 p -83.65 8.62 13.8 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.816 0.341 . . . . 85.319999999999993 111.695 178.994 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.5 mt -122.13 9.39 9.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.379 -0.373 . . . . 95.120000000000005 110.224 176.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 6.0 m . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.483 -0.326 . . . . 92.489999999999995 110.579 179.443 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' 2JY . . . . . 0.443 ' C02' HD23 ' A' ' 12' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . 0.445 ' O ' ' NZ ' ' A' ' 43' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_