data_4nj2_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 4nj2 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.863 0 N-CA-C 108.717 -0.845 . . . . 55.640000000000001 108.717 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.84 -45.25 12.48 Favored 'General case' 0 C--O 1.225 -0.234 0 O-C-N 123.862 0.726 . . . . 69.0 110.38 -164.879 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . . . -59.37 -34.25 72.18 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-O 119.47 -0.3 . . . . 56.439999999999998 111.196 174.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . . . -67.88 -42.51 81.13 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.054 0.222 . . . . 50.68 110.918 177.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.3 mt -67.55 -39.73 84.96 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.383 0.427 . . . . 44.399999999999999 112.008 174.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . . . -66.58 -37.75 85.58 Favored 'General case' 0 C--O 1.22 -0.49 0 O-C-N 123.384 0.428 . . . . 48.520000000000003 110.348 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -61.14 -43.74 98.41 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 122.951 0.5 . . . . 48.890000000000001 111.251 173.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -63.38 -42.97 98.85 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.155 0.582 . . . . 42.079999999999998 111.506 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 97.4 mt -61.83 -44.94 99.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 109.402 -0.592 . . . . 35.899999999999999 109.402 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -60.69 -37.05 80.35 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 111.697 0.258 . . . . 43.009999999999998 111.697 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . . . -70.86 -36.83 72.99 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.321 1.048 . . . . 31.280000000000001 111.294 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 82.8 mt -74.28 -38.16 63.47 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 120.93 0.395 . . . . 33.490000000000002 111.316 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.9 mt -62.0 -42.25 98.94 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.301 0.572 . . . . 34.049999999999997 110.911 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.0 t -63.35 -45.36 91.54 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.439 -0.8 . . . . 37.600000000000001 110.615 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . 0.538 ' NZ ' ' OE2' ' B' ' 20' ' ' GLU . 0.0 OUTLIER -58.76 -50.18 74.87 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 120.977 0.418 . . . . 36.770000000000003 110.81 174.114 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.2 t30 -50.65 -46.68 58.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.762 -0.654 . . . . 31.579999999999998 111.534 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -62.57 -45.18 94.11 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.617 -0.719 . . . . 58.020000000000003 110.992 -178.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . . . -63.24 -37.54 87.63 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-N 116.204 -0.453 . . . . 31.629999999999999 111.54 176.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.2 mt -66.97 -40.85 87.54 Favored 'General case' 0 C--O 1.243 0.747 0 CA-C-N 117.969 0.349 . . . . 26.780000000000001 111.726 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -61.4 -37.46 83.54 Favored 'General case' 0 C--O 1.239 0.532 0 O-C-N 123.468 0.48 . . . . 34.899999999999999 111.596 175.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -67.09 -37.06 83.29 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 110.485 -0.191 . . . . 34.609999999999999 110.485 179.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -68.2 -44.01 76.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.983 0.42 . . . . 36.75 110.43 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.4 mt -56.46 -47.2 82.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 CA-C-N 115.865 -0.607 . . . . 26.34 110.461 173.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.4 -43.2 93.03 Favored 'General case' 0 CA--C 1.563 1.446 0 N-CA-C 112.088 0.403 . . . . 28.920000000000002 112.088 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 62.1 ttp85 -59.77 -43.75 94.19 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 114.592 1.33 . . . . 34.990000000000002 114.592 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.14 -41.68 97.09 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 116.171 -0.468 . . . . 31.43 111.286 176.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.97 -33.03 71.56 Favored 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 114.17 1.174 . . . . 38.950000000000003 114.17 178.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . . . -59.18 -47.87 83.7 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.537 0.735 . . . . 47.289999999999999 110.332 172.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.42 -42.88 88.22 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 115.323 -0.853 . . . . 39.969999999999999 112.976 174.797 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 62.4 mt -63.85 -28.01 44.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 122.625 0.37 . . . . 44.270000000000003 111.95 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -68.94 -16.61 70.69 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 115.429 0.931 . . . . 47.130000000000003 115.429 174.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . 0.877 ' O ' ' NH2' ' B' ' 33' ' ' ARG . . . -95.38 175.55 6.54 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 117.96 0.88 . . . . 54.799999999999997 109.128 177.891 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 112.086 0.402 . . . . 67.340000000000003 112.086 -173.618 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.329 . . . . . . . . 60.530000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . . . -76.51 -21.48 55.72 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 113.813 1.042 . . . . 64.390000000000001 113.813 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.94 -43.57 29.48 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 107.678 -1.23 . . . . 60.310000000000002 107.678 170.424 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . . . -59.83 -32.56 70.78 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.496 -0.32 . . . . 53.380000000000003 110.965 172.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . . . -66.35 -43.13 86.89 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.455 0.169 . . . . 47.369999999999997 110.781 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 45.7 mt -67.69 -39.06 84.45 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.233 -0.44 . . . . 47.93 111.46 176.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . . . -66.18 -38.79 88.89 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.907 -0.588 . . . . 41.32 111.041 178.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -60.0 -42.97 95.45 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-O 121.134 0.492 . . . . 46.619999999999997 112.057 172.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . . . -62.83 -41.46 99.34 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.884 -0.598 . . . . 38.189999999999998 110.61 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 73.5 mt -59.37 -46.33 92.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 CA-C-N 115.424 -0.807 . . . . 35.479999999999997 111.825 175.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . . . -59.51 -37.1 77.41 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.754 0.65 . . . . 33.979999999999997 112.754 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -71.94 -36.36 69.88 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.192 -0.913 . . . . 54.93 111.586 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 34.7 mt -74.62 -36.2 62.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.65 0.262 . . . . 31.73 111.328 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 55.9 mt -61.81 -43.39 98.95 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.889 0.376 . . . . 27.07 110.897 175.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 9.8 t -64.51 -46.49 82.73 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.513 -0.767 . . . . 43.719999999999999 112.263 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mttt -56.61 -49.61 74.44 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 112.391 0.515 . . . . 35.380000000000003 112.391 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -60.96 -40.05 91.85 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.1 1.148 . . . . 27.27 114.1 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' TYR . . . . . 0.405 ' CZ ' ' ND2' ' B' ' 21' ' ' ASN . 28.8 t80 -60.68 -43.08 98.15 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.564 0.697 . . . . 32.939999999999998 111.541 174.652 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -66.45 -34.47 78.02 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 113.477 0.917 . . . . 36.880000000000003 113.477 176.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 40.9 mt -66.5 -40.77 89.4 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 118.187 0.449 . . . . 26.32 111.52 174.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . 0.538 ' OE2' ' NZ ' ' A' ' 15' ' ' LYS . 12.4 mm-40 -59.8 -37.37 78.93 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 123.175 0.297 . . . . 30.780000000000001 111.797 176.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ASN . . . . . 0.405 ' ND2' ' CZ ' ' B' ' 17' ' ' TYR . 32.1 m-80 -67.57 -37.11 82.15 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 111.569 0.211 . . . . 37.880000000000003 111.569 176.659 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -68.27 -43.08 78.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.452 0.47 . . . . 48.289999999999999 111.145 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 46.4 mt -54.89 -48.52 74.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.425 0.631 . . . . 25.719999999999999 111.18 173.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.83 -45.7 89.39 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 121.143 0.496 . . . . 24.149999999999999 111.903 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 12.8 mtt85 -61.41 -41.25 96.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 114.165 1.172 . . . . 42.32 114.165 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 67.8 mt -63.88 -43.27 96.54 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 110.316 -0.253 . . . . 24.989999999999998 110.316 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.04 -40.15 94.38 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.763 -0.775 . . . . 33.159999999999997 111.185 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . . . -59.43 -47.86 83.86 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-O 120.756 0.312 . . . . 38.079999999999998 111.713 174.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 62.5 tp -59.68 -41.11 89.96 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.527 0.565 . . . . 22.829999999999998 112.527 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.78 -33.25 59.11 Favored 'Isoleucine or valine' 0 C--O 1.247 0.929 0 CA-C-O 121.281 0.562 . . . . 24.039999999999999 109.901 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -72.42 -10.05 74.33 Favored Glycine 0 C--O 1.221 -0.66 0 N-CA-C 115.329 0.892 . . . . 25.809999999999999 115.329 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -126.31 -15.44 5.69 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 114.334 1.235 . . . . 44.93 114.334 -179.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ARG . . . . . 0.877 ' NH2' ' O ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 120.815 0.341 . . . . 30.0 111.61 -169.136 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.863 0 N-CA-C 108.717 -0.845 . . . . 55.640000000000001 108.717 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' MET . . . . . 0.619 ' HG3' ' HE1' ' B' ' 2' ' ' MET . 0.0 OUTLIER -84.84 -45.25 12.48 Favored 'General case' 0 C--O 1.225 -0.234 0 O-C-N 123.862 0.726 . . . . 69.0 110.38 -164.879 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . . . -59.37 -34.25 72.18 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-O 119.47 -0.3 . . . . 56.439999999999998 111.196 174.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . . . -67.88 -42.51 81.13 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.054 0.222 . . . . 50.68 110.918 177.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . 0.482 ' CD1' ' HG3' ' B' ' 2' ' ' MET . 57.3 mt -67.55 -39.73 84.96 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.383 0.427 . . . . 44.399999999999999 112.008 174.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . . . -66.58 -37.75 85.58 Favored 'General case' 0 C--O 1.22 -0.49 0 O-C-N 123.384 0.428 . . . . 48.520000000000003 110.348 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -61.14 -43.74 98.41 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 122.951 0.5 . . . . 48.890000000000001 111.251 173.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -63.38 -42.97 98.85 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.155 0.582 . . . . 42.079999999999998 111.506 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . 0.44 HD12 HD22 ' B' ' 5' ' ' LEU . 97.4 mt -61.83 -44.94 99.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 109.402 -0.592 . . . . 35.899999999999999 109.402 175.74 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -60.69 -37.05 80.35 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 111.697 0.258 . . . . 43.009999999999998 111.697 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . . . -70.86 -36.83 72.99 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.321 1.048 . . . . 31.280000000000001 111.294 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 82.8 mt -74.28 -38.16 63.47 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 120.93 0.395 . . . . 33.490000000000002 111.316 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.9 mt -62.0 -42.25 98.94 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.301 0.572 . . . . 34.049999999999997 110.911 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.0 t -63.35 -45.36 91.54 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.439 -0.8 . . . . 37.600000000000001 110.615 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . 0.538 ' NZ ' ' OE2' ' B' ' 20' ' ' GLU . 0.0 OUTLIER -58.76 -50.18 74.87 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 120.977 0.418 . . . . 36.770000000000003 110.81 174.114 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -50.65 -46.68 58.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.762 -0.654 . . . . 31.579999999999998 111.534 178.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -62.57 -45.18 94.11 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.617 -0.719 . . . . 58.020000000000003 110.992 -178.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . . . -63.24 -37.54 87.63 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-N 116.204 -0.453 . . . . 31.629999999999999 111.54 176.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.2 mt -66.97 -40.85 87.54 Favored 'General case' 0 C--O 1.243 0.747 0 CA-C-N 117.969 0.349 . . . . 26.780000000000001 111.726 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -61.4 -37.46 83.54 Favored 'General case' 0 C--O 1.239 0.532 0 O-C-N 123.468 0.48 . . . . 34.899999999999999 111.596 175.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -67.09 -37.06 83.29 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 110.485 -0.191 . . . . 34.609999999999999 110.485 179.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -68.2 -44.01 76.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.983 0.42 . . . . 36.75 110.43 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.4 mt -56.46 -47.2 82.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 CA-C-N 115.865 -0.607 . . . . 26.34 110.461 173.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.4 -43.2 93.03 Favored 'General case' 0 CA--C 1.563 1.446 0 N-CA-C 112.088 0.403 . . . . 28.920000000000002 112.088 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 62.1 ttp85 -59.77 -43.75 94.19 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 114.592 1.33 . . . . 34.990000000000002 114.592 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.14 -41.68 97.09 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 116.171 -0.468 . . . . 31.43 111.286 176.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.97 -33.03 71.56 Favored 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 114.17 1.174 . . . . 38.950000000000003 114.17 178.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . . . -59.18 -47.87 83.7 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.537 0.735 . . . . 47.289999999999999 110.332 172.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . 0.501 HD23 ' O ' ' A' ' 29' ' ' LEU . 1.0 OUTLIER -58.42 -42.88 88.22 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 115.323 -0.853 . . . . 39.969999999999999 112.976 174.797 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 62.4 mt -63.85 -28.01 44.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 122.625 0.37 . . . . 44.270000000000003 111.95 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -68.94 -16.61 70.69 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 115.429 0.931 . . . . 47.130000000000003 115.429 174.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . 0.877 ' O ' ' NH2' ' B' ' 33' ' ' ARG . . . -95.38 175.55 6.54 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 117.96 0.88 . . . . 54.799999999999997 109.128 177.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 112.086 0.402 . . . . 67.340000000000003 112.086 -173.618 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.329 . . . . . . . . 60.530000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . . . -76.51 -21.48 55.72 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 113.813 1.042 . . . . 64.390000000000001 113.813 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' MET . . . . . 0.619 ' HE1' ' HG3' ' A' ' 2' ' ' MET . 0.0 OUTLIER -77.94 -43.57 29.48 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 107.678 -1.23 . . . . 60.310000000000002 107.678 170.424 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . . . -59.83 -32.56 70.78 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.496 -0.32 . . . . 53.380000000000003 110.965 172.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . . . -66.35 -43.13 86.89 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.455 0.169 . . . . 47.369999999999997 110.781 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . 0.44 HD22 HD12 ' A' ' 9' ' ' ILE . 45.7 mt -67.69 -39.06 84.45 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.233 -0.44 . . . . 47.93 111.46 176.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . . . -66.18 -38.79 88.89 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.907 -0.588 . . . . 41.32 111.041 178.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -60.0 -42.97 95.45 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-O 121.134 0.492 . . . . 46.619999999999997 112.057 172.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . . . -62.83 -41.46 99.34 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.884 -0.598 . . . . 38.189999999999998 110.61 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 73.5 mt -59.37 -46.33 92.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 CA-C-N 115.424 -0.807 . . . . 35.479999999999997 111.825 175.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . . . -59.51 -37.1 77.41 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.754 0.65 . . . . 33.979999999999997 112.754 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -71.94 -36.36 69.88 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.192 -0.913 . . . . 54.93 111.586 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 34.7 mt -74.62 -36.2 62.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.65 0.262 . . . . 31.73 111.328 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 55.9 mt -61.81 -43.39 98.95 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.889 0.376 . . . . 27.07 110.897 175.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 9.8 t -64.51 -46.49 82.73 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.513 -0.767 . . . . 43.719999999999999 112.263 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mttt -56.61 -49.61 74.44 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 112.391 0.515 . . . . 35.380000000000003 112.391 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASN . . . . . . . . . . . . . 69.5 m-20 -60.96 -40.05 91.85 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.1 1.148 . . . . 27.27 114.1 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -60.68 -43.08 98.15 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.564 0.697 . . . . 32.939999999999998 111.541 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -66.45 -34.47 78.02 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 113.477 0.917 . . . . 36.880000000000003 113.477 176.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 40.9 mt -66.5 -40.77 89.4 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 118.187 0.449 . . . . 26.32 111.52 174.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . 0.538 ' OE2' ' NZ ' ' A' ' 15' ' ' LYS . 12.4 mm-40 -59.8 -37.37 78.93 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 123.175 0.297 . . . . 30.780000000000001 111.797 176.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -67.57 -37.11 82.15 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 111.569 0.211 . . . . 37.880000000000003 111.569 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -68.27 -43.08 78.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.452 0.47 . . . . 48.289999999999999 111.145 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 46.4 mt -54.89 -48.52 74.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.425 0.631 . . . . 25.719999999999999 111.18 173.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.83 -45.7 89.39 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 121.143 0.496 . . . . 24.149999999999999 111.903 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ARG . . . . . 0.486 ' HD2' ' H11' ' B' ' 101' ' ' GOL . 12.8 mtt85 -61.41 -41.25 96.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 114.165 1.172 . . . . 42.32 114.165 174.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 67.8 mt -63.88 -43.27 96.54 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 110.316 -0.253 . . . . 24.989999999999998 110.316 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.04 -40.15 94.38 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.763 -0.775 . . . . 33.159999999999997 111.185 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' B' ' 32' ' ' GLU . . . -59.43 -47.86 83.86 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-O 120.756 0.312 . . . . 38.079999999999998 111.713 174.571 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 62.5 tp -59.68 -41.11 89.96 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.527 0.565 . . . . 22.829999999999998 112.527 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . 0.405 HD13 HD13 ' A' ' 29' ' ' LEU . 48.8 mt -62.78 -33.25 59.11 Favored 'Isoleucine or valine' 0 C--O 1.247 0.929 0 CA-C-O 121.281 0.562 . . . . 24.039999999999999 109.901 177.489 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -72.42 -10.05 74.33 Favored Glycine 0 C--O 1.221 -0.66 0 N-CA-C 115.329 0.892 . . . . 25.809999999999999 115.329 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' B' ' 28' ' ' LYS . 2.0 pt-20 -126.31 -15.44 5.69 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 114.334 1.235 . . . . 44.93 114.334 -179.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ARG . . . . . 0.877 ' NH2' ' O ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 120.815 0.341 . . . . 30.0 111.61 -169.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GOL . . . . . 0.486 ' H11' ' HD2' ' B' ' 25' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.863 0 N-CA-C 108.717 -0.845 . . . . 55.640000000000001 108.717 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' MET . . . . . 0.619 ' HG3' ' HE1' ' B' ' 2' ' ' MET . 0.0 OUTLIER -84.84 -45.25 12.48 Favored 'General case' 0 C--O 1.225 -0.234 0 O-C-N 123.862 0.726 . . . . 69.0 110.38 -164.879 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . . . -59.37 -34.25 72.18 Favored 'General case' 0 C--O 1.215 -0.748 0 CA-C-O 119.47 -0.3 . . . . 56.439999999999998 111.196 174.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . . . -67.88 -42.51 81.13 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.054 0.222 . . . . 50.68 110.918 177.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.482 ' CD1' ' HG3' ' B' ' 2' ' ' MET . 57.3 mt -67.55 -39.73 84.96 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.383 0.427 . . . . 44.399999999999999 112.008 174.229 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . . . -66.58 -37.75 85.58 Favored 'General case' 0 C--O 1.22 -0.49 0 O-C-N 123.384 0.428 . . . . 48.520000000000003 110.348 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -61.14 -43.74 98.41 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 122.951 0.5 . . . . 48.890000000000001 111.251 173.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.3 tmtm? -63.38 -42.97 98.85 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.155 0.582 . . . . 42.079999999999998 111.506 -179.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.44 HD12 HD22 ' B' ' 5' ' ' LEU . 97.4 mt -61.83 -44.94 99.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 N-CA-C 109.402 -0.592 . . . . 35.899999999999999 109.402 175.74 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -60.69 -37.05 80.35 Favored 'General case' 0 C--O 1.22 -0.459 0 N-CA-C 111.697 0.258 . . . . 43.009999999999998 111.697 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . . . -70.86 -36.83 72.99 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.321 1.048 . . . . 31.280000000000001 111.294 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 82.8 mt -74.28 -38.16 63.47 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 120.93 0.395 . . . . 33.490000000000002 111.316 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.9 mt -62.0 -42.25 98.94 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.301 0.572 . . . . 34.049999999999997 110.911 176.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.0 t -63.35 -45.36 91.54 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.439 -0.8 . . . . 37.600000000000001 110.615 177.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.538 ' NZ ' ' OE2' ' B' ' 20' ' ' GLU . 0.0 OUTLIER -58.76 -50.18 74.87 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-O 120.977 0.418 . . . . 36.770000000000003 110.81 174.114 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.467 ' HB2' HD21 ' B' ' 16' ' ' ASN . 14.2 t30 -50.65 -46.68 58.55 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.762 -0.654 . . . . 31.579999999999998 111.534 178.024 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -62.57 -45.18 94.11 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.617 -0.719 . . . . 58.020000000000003 110.992 -178.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . . . -63.24 -37.54 87.63 Favored 'General case' 0 CA--C 1.503 -0.855 0 CA-C-N 116.204 -0.453 . . . . 31.629999999999999 111.54 176.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 89.2 mt -66.97 -40.85 87.54 Favored 'General case' 0 C--O 1.243 0.747 0 CA-C-N 117.969 0.349 . . . . 26.780000000000001 111.726 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -61.4 -37.46 83.54 Favored 'General case' 0 C--O 1.239 0.532 0 O-C-N 123.468 0.48 . . . . 34.899999999999999 111.596 175.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -67.09 -37.06 83.29 Favored 'General case' 0 C--O 1.224 -0.245 0 N-CA-C 110.485 -0.191 . . . . 34.609999999999999 110.485 179.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -68.2 -44.01 76.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.983 0.42 . . . . 36.75 110.43 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.4 mt -56.46 -47.2 82.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 CA-C-N 115.865 -0.607 . . . . 26.34 110.461 173.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.4 -43.2 93.03 Favored 'General case' 0 CA--C 1.563 1.446 0 N-CA-C 112.088 0.403 . . . . 28.920000000000002 112.088 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 62.1 ttp85 -59.77 -43.75 94.19 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 114.592 1.33 . . . . 34.990000000000002 114.592 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 73.6 mt -64.14 -41.68 97.09 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 116.171 -0.468 . . . . 31.43 111.286 176.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -69.97 -33.03 71.56 Favored 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 114.17 1.174 . . . . 38.950000000000003 114.17 178.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . . . -59.18 -47.87 83.7 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.537 0.735 . . . . 47.289999999999999 110.332 172.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.501 HD23 ' O ' ' A' ' 29' ' ' LEU . 1.0 OUTLIER -58.42 -42.88 88.22 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-N 115.323 -0.853 . . . . 39.969999999999999 112.976 174.797 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 62.4 mt -63.85 -28.01 44.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 122.625 0.37 . . . . 44.270000000000003 111.95 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -68.94 -16.61 70.69 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 115.429 0.931 . . . . 47.130000000000003 115.429 174.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.877 ' O ' ' NH2' ' B' ' 33' ' ' ARG . . . -95.38 175.55 6.54 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 117.96 0.88 . . . . 54.799999999999997 109.128 177.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 112.086 0.402 . . . . 67.340000000000003 112.086 -173.618 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.329 . . . . . . . . 60.530000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ARG . . . . . . . . . . . . . . . -76.51 -21.48 55.72 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 113.813 1.042 . . . . 64.390000000000001 113.813 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' MET . . . . . 0.619 ' HE1' ' HG3' ' A' ' 2' ' ' MET . 0.0 OUTLIER -77.94 -43.57 29.48 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 107.678 -1.23 . . . . 60.310000000000002 107.678 170.424 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LYS . . . . . . . . . . . . . . . -59.83 -32.56 70.78 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.496 -0.32 . . . . 53.380000000000003 110.965 172.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . . . -66.35 -43.13 86.89 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.455 0.169 . . . . 47.369999999999997 110.781 176.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.44 HD22 HD12 ' A' ' 9' ' ' ILE . 45.7 mt -67.69 -39.06 84.45 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.233 -0.44 . . . . 47.93 111.46 176.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . . . -66.18 -38.79 88.89 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.907 -0.588 . . . . 41.32 111.041 178.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -60.0 -42.97 95.45 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-O 121.134 0.492 . . . . 46.619999999999997 112.057 172.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . . . -62.83 -41.46 99.34 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.884 -0.598 . . . . 38.189999999999998 110.61 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 73.5 mt -59.37 -46.33 92.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.538 0 CA-C-N 115.424 -0.807 . . . . 35.479999999999997 111.825 175.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . . . -59.51 -37.1 77.41 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 112.754 0.65 . . . . 33.979999999999997 112.754 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -71.94 -36.36 69.88 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.192 -0.913 . . . . 54.93 111.586 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 34.7 mt -74.62 -36.2 62.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.65 0.262 . . . . 31.73 111.328 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 55.9 mt -61.81 -43.39 98.95 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.889 0.376 . . . . 27.07 110.897 175.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 9.8 t -64.51 -46.49 82.73 Favored 'General case' 0 CA--C 1.552 1.055 0 CA-C-N 115.513 -0.767 . . . . 43.719999999999999 112.263 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mttt -56.61 -49.61 74.44 Favored 'General case' 0 C--O 1.244 0.801 0 N-CA-C 112.391 0.515 . . . . 35.380000000000003 112.391 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASN . . . . . 0.467 HD21 ' HB2' ' A' ' 16' ' ' ASN . 4.1 m120 -60.96 -40.05 91.85 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 114.1 1.148 . . . . 27.27 114.1 179.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -60.68 -43.08 98.15 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.564 0.697 . . . . 32.939999999999998 111.541 174.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -66.45 -34.47 78.02 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 113.477 0.917 . . . . 36.880000000000003 113.477 176.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 40.9 mt -66.5 -40.77 89.4 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 118.187 0.449 . . . . 26.32 111.52 174.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . 0.538 ' OE2' ' NZ ' ' A' ' 15' ' ' LYS . 12.4 mm-40 -59.8 -37.37 78.93 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 123.175 0.297 . . . . 30.780000000000001 111.797 176.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -67.57 -37.11 82.15 Favored 'General case' 0 CA--C 1.514 -0.407 0 N-CA-C 111.569 0.211 . . . . 37.880000000000003 111.569 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . 82.7 tt0 -68.27 -43.08 78.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.452 0.47 . . . . 48.289999999999999 111.145 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 46.4 mt -54.89 -48.52 74.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.425 0.631 . . . . 25.719999999999999 111.18 173.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.83 -45.7 89.39 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 121.143 0.496 . . . . 24.149999999999999 111.903 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ARG . . . . . 0.486 ' HD2' ' H11' ' B' ' 101' ' ' GOL . 12.8 mtt85 -61.41 -41.25 96.85 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 114.165 1.172 . . . . 42.32 114.165 174.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 67.8 mt -63.88 -43.27 96.54 Favored 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 110.316 -0.253 . . . . 24.989999999999998 110.316 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -65.04 -40.15 94.38 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.763 -0.775 . . . . 33.159999999999997 111.185 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' B' ' 32' ' ' GLU . . . -59.43 -47.86 83.86 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-O 120.756 0.312 . . . . 38.079999999999998 111.713 174.571 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 62.5 tp -59.68 -41.11 89.96 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 112.527 0.565 . . . . 22.829999999999998 112.527 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.405 HD13 HD13 ' A' ' 29' ' ' LEU . 48.8 mt -62.78 -33.25 59.11 Favored 'Isoleucine or valine' 0 C--O 1.247 0.929 0 CA-C-O 121.281 0.562 . . . . 24.039999999999999 109.901 177.489 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' GLY . . . . . . . . . . . . . . . -72.42 -10.05 74.33 Favored Glycine 0 C--O 1.221 -0.66 0 N-CA-C 115.329 0.892 . . . . 25.809999999999999 115.329 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' B' ' 28' ' ' LYS . 2.0 pt-20 -126.31 -15.44 5.69 Favored 'General case' 0 C--O 1.212 -0.876 0 N-CA-C 114.334 1.235 . . . . 44.93 114.334 -179.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ARG . . . . . 0.877 ' NH2' ' O ' ' A' ' 32' ' ' GLU . 0.6 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 120.815 0.341 . . . . 30.0 111.61 -169.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GOL . . . . . 0.486 ' H11' ' HD2' ' B' ' 25' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_