data_1opc_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 1opc _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 ' 137' ' ' VAL . . . . . . . . . . . . . 19.8 t . . . . . 0 N--CA 1.496 1.83 0 N-CA-C 108.746 -0.835 . . . . 43.37 108.746 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 8.2 tt -131.72 135.53 58.72 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 CA-C-O 123.019 1.39 . . . . 39.28 113.614 -168.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -123.91 130.53 52.74 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.583 -1.644 . . . . 25.62 109.428 175.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -146.94 142.53 27.66 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 123.64 1.686 . . . . 22.26 111.26 167.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . 48.97 -128.88 22.34 Favored Glycine 0 N--CA 1.467 0.76 0 O-C-N 119.521 -1.987 . . . . 19.78 111.566 -172.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 10.1 mtpt -91.95 8.39 37.75 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.798 -1.413 . . . . 37.89 111.081 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -105.78 144.38 32.6 Favored 'General case' 0 C--N 1.361 1.094 0 CA-C-O 125.793 2.711 . . . . 17.1 113.673 -173.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LYS . . . . . 0.41 ' NZ ' ' OD1' ' A' ' 156' ' ' ASP . 4.3 mttp -128.55 124.68 36.6 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 118.818 -2.426 . . . . 33.55 107.432 170.665 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 33.5 tp -123.01 130.73 53.17 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 117.126 -1.416 . . . . 20.35 109.815 -177.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -104.74 110.12 22.33 Favored 'General case' 0 C--O 1.2 -1.535 0 C-N-CA 124.833 1.253 . . . . 26.95 107.76 179.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -34.77 69.47 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.102 -0.954 . . . . 33.7 112.831 -170.84 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLY . . . . . 0.531 ' CA ' ' O ' ' A' ' 552' ' ' HOH . . . -69.36 -38.41 80.84 Favored Glycine 0 CA--C 1.504 -0.624 0 CA-C-O 117.245 -1.864 . . . . 36.69 115.091 173.752 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 51.9 p -108.51 -9.18 15.39 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 123.1 3.45 . . . . 30.72 113.041 -171.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 64.47 35.29 9.59 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.306 -2.121 . . . . 29.63 113.112 -175.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -96.29 126.6 41.62 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 120.257 -1.527 . . . . 30.83 107.61 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' MET . . . . . . . . . . . . . 3.5 tpp -124.89 148.95 48.04 Favored 'General case' 0 C--O 1.188 -2.137 0 CA-C-O 115.702 -2.094 . . . . 35.88 112.607 171.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -134.42 136.06 43.01 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 128.365 3.541 . . . . 19.54 108.719 -175.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 34.6 ttp180 -109.98 117.64 34.32 Favored 'General case' 0 CA--C 1.564 1.515 0 CA-C-O 115.015 -2.422 . . . . 36.0 110.901 166.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 79.4 mt-10 51.96 42.82 30.53 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 127.362 2.914 . . . . 30.69 112.477 -173.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ASP . . . . . 0.41 ' OD1' ' NZ ' ' A' ' 144' ' ' LYS . 66.3 m-20 61.5 9.56 2.76 Favored 'General case' 0 N--CA 1.427 -1.6 0 C-N-CA 131.103 3.761 . . . . 30.83 119.146 -171.468 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -95.76 129.64 33.88 Favored Pre-proline 0 CA--C 1.574 1.886 0 CA-C-N 122.692 2.496 . . . . 22.39 108.941 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -64.58 125.73 15.49 Favored 'Trans proline' 0 C--N 1.291 -2.496 1 O-C-N 129.466 4.403 . . . . 17.29 112.684 -175.63 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' MET . . . . . . . . . . . . . 11.0 ttp -128.61 127.33 23.56 Favored Pre-proline 0 N--CA 1.493 1.71 0 CA-C-N 112.828 -1.987 . . . . 42.99 107.601 -177.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -76.84 153.27 33.15 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 122.576 2.184 . . . . 22.17 112.893 -174.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -129.05 108.56 10.48 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 128.201 2.6 . . . . 30.14 107.8 176.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 17.8 p -49.98 163.51 0.14 Allowed 'General case' 0 N--CA 1.483 1.184 0 O-C-N 128.989 3.931 . . . . 26.74 110.999 166.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.1 p -55.09 -47.33 75.07 Favored 'General case' 0 C--N 1.361 1.104 0 O-C-N 120.408 -1.432 . . . . 23.61 111.812 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . -75.89 -37.04 39.9 Favored Glycine 0 N--CA 1.47 0.957 0 CA-C-O 125.232 2.573 . . . . 18.38 112.401 -173.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -56.72 -49.45 75.16 Favored 'General case' 0 C--N 1.365 1.278 0 O-C-N 120.169 -1.783 . . . . 25.95 112.833 171.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -59.61 -47.69 84.59 Favored 'General case' 0 N--CA 1.432 -1.335 0 C-N-CA 128.02 2.528 . . . . 25.59 110.774 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -58.25 -49.16 78.07 Favored 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 114.073 -3.051 . . . . 18.68 111.053 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 2.9 p -65.19 -45.86 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 124.311 2.005 . . . . 23.61 113.023 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 33.0 tp -62.39 -41.3 98.55 Favored 'General case' 0 CA--C 1.466 -2.267 0 C-N-CA 116.361 -2.136 . . . . 15.92 111.903 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -62.93 -36.01 82.0 Favored 'General case' 0 N--CA 1.438 -1.05 0 O-C-N 117.603 -3.186 . . . . 36.42 111.921 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -66.24 -44.26 84.24 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 127.616 3.579 . . . . 17.43 109.907 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 20.8 mt -58.24 -56.58 20.19 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 116.306 -3.997 . . . . 16.21 113.073 177.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 14.5 m -76.34 -24.29 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-O 122.544 1.164 . . . . 21.66 110.537 -167.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 58.4 m -76.6 -7.77 55.89 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.078 -1.014 . . . . 27.04 111.925 174.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 66.3 m80 -123.93 62.45 27.27 Favored Pre-proline 0 C--N 1.314 -0.948 0 O-C-N 118.244 -2.785 . . . . 22.98 113.159 170.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -60.11 131.34 38.56 Favored 'Trans proline' 0 CA--C 1.508 -0.816 0 CA-C-O 123.29 1.288 . . . . 22.73 111.842 -169.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 63.58 15.63 9.02 Favored 'General case' 0 N--CA 1.442 -0.868 0 O-C-N 118.205 -2.809 . . . . 33.44 114.294 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -101.83 110.07 61.19 Favored Pre-proline 0 C--O 1.221 -0.407 0 CA-C-N 120.099 1.318 . . . . 35.66 108.608 166.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -59.67 133.36 50.95 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.261 1.974 . . . . 23.07 109.579 173.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 83.3 mt -124.18 128.43 49.21 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.726 -1.213 . . . . 19.89 107.726 -168.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 94.2 p -71.32 167.67 19.01 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 117.666 -1.614 . . . . 15.09 107.158 -176.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' ARG . . . . . 0.508 ' NH2' ' O ' ' A' ' 583' ' ' HOH . 0.0 OUTLIER -56.47 -44.68 80.81 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 114.386 1.254 . . . . 38.5 114.386 168.818 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -55.91 -48.29 75.92 Favored 'General case' 0 C--N 1.379 1.852 0 N-CA-C 114.153 1.168 . . . . 29.07 114.153 174.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 1.2 tptp -65.09 -34.16 77.75 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 119.602 -1.936 . . . . 33.09 111.987 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' LEU . . . . . . . . . . . . . 20.7 mt -68.57 -48.45 64.19 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 122.412 1.101 . . . . 22.43 112.955 173.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' MET . . . . . . . . . . . . . 26.4 mmm -51.31 -52.5 44.7 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-O 115.101 -2.381 . . . . 54.39 109.421 174.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -56.12 -51.49 67.72 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 126.039 2.087 . . . . 31.91 111.916 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 67.8 mt -65.34 -33.25 75.52 Favored 'General case' 0 C--O 1.248 1.018 0 CA-C-O 123.347 1.546 . . . . 28.34 114.648 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' ALA . . . . . . . . . . . . . . . -59.89 -24.02 63.94 Favored 'General case' 0 C--O 1.249 1.028 0 N-CA-C 118.323 2.712 . . . . 31.37 118.323 168.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' ARG . . . . . . . . . . . . . 33.6 mtm105 -61.13 119.02 7.56 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 115.049 1.5 . . . . 45.62 115.049 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . -123.55 -165.16 12.22 Favored Glycine 0 CA--C 1.53 0.995 0 N-CA-C 109.279 -1.528 . . . . 32.78 109.279 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 -82.28 16.66 1.93 Allowed 'General case' 0 C--O 1.242 0.666 0 N-CA-C 116.74 2.126 . . . . 29.53 116.74 172.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -135.5 171.1 14.93 Favored 'General case' 0 CA--C 1.518 -0.284 0 O-C-N 120.857 -1.152 . . . . 27.97 108.278 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -51.98 105.82 0.13 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 127.441 2.297 . . . . 32.38 109.8 162.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -148.79 -73.35 0.19 Allowed 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 105.815 -1.92 . . . . 33.52 105.815 -170.535 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -62.59 -30.78 71.58 Favored 'General case' 0 C--O 1.251 1.145 0 CA-C-N 114.45 -1.25 . . . . 35.21 113.055 -176.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' MET . . . . . . . . . . . . . 92.1 mtp -100.03 6.86 45.04 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 120.632 -1.293 . . . . 42.19 110.945 -170.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' GLU . . . . . 0.523 ' OE2' ' NH2' ' A' ' 199' ' ' ARG . 31.4 tt0 -61.7 -56.51 18.95 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 118.716 -2.49 . . . . 36.03 114.308 178.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' ARG . . . . . 0.523 ' NH2' ' OE2' ' A' ' 198' ' ' GLU . 43.6 mtm-85 -140.28 169.46 17.63 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.656 -1.277 . . . . 48.7 109.789 174.265 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.63 152.8 21.5 Favored 'General case' 0 C--O 1.248 0.996 0 O-C-N 124.684 1.24 . . . . 31.19 110.985 174.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 19.5 mm -62.01 -42.26 94.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 CA-C-O 117.576 -1.202 . . . . 26.51 109.561 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -64.13 -38.16 90.08 Favored 'General case' 0 C--O 1.251 1.153 0 CA-C-N 120.173 1.352 . . . . 28.02 111.783 -175.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 25.4 t -67.39 -37.38 78.86 Favored 'Isoleucine or valine' 0 C--O 1.261 1.693 0 C-N-CA 124.257 1.023 . . . . 24.03 111.298 174.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' GLN . . . . . . . . . . . . 0.271 20.1 mm-40 -64.56 -45.44 87.08 Favored 'General case' 0 C--O 1.252 1.23 0 CA-C-O 117.646 -1.169 . . . . 27.05 109.41 173.387 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ILE . . . . . . . . . . . . . 29.4 mm -59.78 -43.05 90.82 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 O-C-N 124.749 1.28 . . . . 16.96 111.968 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 27.4 t -62.51 -48.51 79.25 Favored 'General case' 0 C--O 1.252 1.223 0 O-C-N 124.677 1.236 . . . . 18.8 110.119 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ARG . . . . . . . . . . . . . 54.0 mtp85 -59.75 -44.75 93.68 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 117.867 -1.063 . . . . 28.16 113.673 173.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' LEU . . . . . . . . . . . . . 48.7 mt -61.42 -37.61 84.13 Favored 'General case' 0 C--O 1.26 1.616 0 CA-C-N 122.152 2.251 . . . . 17.98 112.722 174.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -66.75 -40.07 88.14 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.723 -1.236 . . . . 18.32 110.927 176.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' ARG . . . . . . . . . . . . . 1.6 mtp180 -69.71 -24.94 63.64 Favored 'General case' 0 C--O 1.257 1.499 0 O-C-N 119.628 -1.92 . . . . 40.72 112.007 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' MET . . . . . . . . . . . . . 14.3 mtp -76.83 -44.34 32.78 Favored 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 126.966 2.107 . . . . 43.78 112.557 170.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' VAL . . . . . . . . . . . . . 13.0 m -110.06 -12.04 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.098 0 O-C-N 119.156 -2.215 . . . . 21.08 114.58 -165.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -110.06 139.88 44.72 Favored 'General case' 0 CA--C 1.55 0.964 0 O-C-N 116.593 -3.817 . . . . 22.57 106.248 -164.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -62.25 -38.26 88.59 Favored 'General case' 0 C--N 1.316 -0.867 0 O-C-N 126.623 2.452 . . . . 32.42 113.255 166.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -135.5 108.71 10.19 Favored Pre-proline 0 N--CA 1.474 0.728 0 CA-C-O 116.236 -1.84 . . . . 26.83 107.105 173.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -59.54 -25.45 78.8 Favored 'Trans proline' 0 C--N 1.295 -2.24 0 C-N-CA 121.971 1.781 . . . . 23.22 113.936 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' ALA . . . . . . . . . . . . . . . -70.25 -25.18 63.25 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 116.019 1.859 . . . . 20.03 116.019 174.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -134.17 70.22 73.78 Favored Pre-proline 0 C--O 1.257 1.464 0 O-C-N 120.039 -1.663 . . . . 27.17 110.62 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -71.78 142.31 39.15 Favored 'Trans proline' 0 C--O 1.245 0.855 0 C-N-CA 120.966 1.111 . . . . 20.33 111.874 -165.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 37.6 tpt85 -90.45 -47.4 7.75 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 115.886 1.809 . . . . 24.7 115.886 172.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -91.81 -42.2 10.23 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 125.411 1.484 . . . . 28.86 111.579 -170.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' ILE . . . . . . . . . . . . . 79.6 mt -108.44 88.66 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 126.987 2.679 . . . . 18.99 109.878 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -97.32 157.1 16.14 Favored 'General case' 0 N--CA 1.412 -2.369 0 C-N-CA 128.059 2.544 . . . . 21.5 110.388 -169.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' THR . . . . . . . . . . . . . 4.8 m -100.58 136.66 40.11 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 113.87 -1.514 . . . . 17.93 108.327 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' VAL . . . . . . . . . . . . . 39.6 t -115.79 114.2 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.173 0 N-CA-C 106.284 -1.747 . . . . 21.12 106.284 175.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' TRP . . . . . . . . . . . . . 4.4 m95 -62.45 138.75 58.52 Favored 'General case' 0 C--N 1.309 -1.168 0 O-C-N 127.458 2.974 . . . . 26.58 105.209 -167.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . 95.87 -14.5 64.61 Favored Glycine 0 N--CA 1.483 1.813 0 N-CA-C 107.521 -2.232 . . . . 25.43 107.521 169.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' LEU . . . . . . . . . . . . . 6.8 mp -128.16 -77.04 0.56 Allowed 'General case' 0 C--O 1.252 1.231 0 O-C-N 119.16 -2.376 . . . . 30.08 108.182 -152.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' GLY . . . . . . . . . . . . . . . 170.51 -137.74 4.6 Favored Glycine 0 CA--C 1.574 3.761 0 C-N-CA 116.155 -2.926 . . . . 18.04 106.488 -163.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -132.61 157.2 45.37 Favored 'General case' 0 C--O 1.258 1.546 0 N-CA-C 106.779 -1.563 . . . . 18.63 106.779 -170.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' VAL . . . . . . . . . . . . . 12.5 p -145.77 138.7 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 118.901 -1.119 . . . . 16.59 109.326 -176.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -86.13 126.68 34.39 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 124.983 1.427 . . . . 21.75 112.04 167.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' VAL . . . . . . . . . . . . . 42.4 t -115.45 110.14 45.33 Favored Pre-proline 0 CA--C 1.558 1.257 0 N-CA-C 107.446 -1.316 . . . . 20.68 107.446 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' PRO . . . . . 0.51 ' O ' ' CB ' ' A' ' 235' ' ' ASP . 3.1 Cg_endo -66.76 171.0 11.58 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 125.139 2.126 . . . . 25.44 114.192 -172.732 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' ASP . . . . . 0.51 ' CB ' ' O ' ' A' ' 234' ' ' PRO . 4.4 m-20 . . . . . 0 C--O 1.25 1.09 0 N-CA-C 120.947 3.684 . . . . 35.95 120.947 173.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' HOH . . . . . 0.46 ' O ' ' NH2' ' A' ' 182' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' HOH . . . . . 0.531 ' O ' ' CA ' ' A' ' 148' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 565' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 583' ' ' HOH . . . . . 0.508 ' O ' ' NH2' ' A' ' 182' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' VAL . . . . . 0.715 HG11 HD22 ' A' ' 147' ' ' LEU . 19.8 t . . . . . 0 N--CA 1.496 1.83 0 N-CA-C 108.746 -0.835 . . . . 43.369999999999997 108.746 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ILE . . . . . 0.589 ' CG2' ' HB3' ' A' ' 145' ' ' LEU . 8.2 tt -131.72 135.53 58.72 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 CA-C-O 123.019 1.39 . . . . 39.280000000000001 113.614 -168.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -123.91 130.53 52.74 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.583 -1.644 . . . . 25.620000000000001 109.428 175.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -146.94 142.53 27.66 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 123.64 1.686 . . . . 22.260000000000002 111.26 167.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . 48.97 -128.88 22.34 Favored Glycine 0 N--CA 1.467 0.76 0 O-C-N 119.521 -1.987 . . . . 19.780000000000001 111.566 -172.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 10.1 mtpt -91.95 8.39 37.75 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.798 -1.413 . . . . 37.890000000000001 111.081 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' PHE . . . . . 0.605 ' CE1' ' HD3' ' A' ' 154' ' ' ARG . 89.8 m-85 -105.78 144.38 32.6 Favored 'General case' 0 C--N 1.361 1.094 0 CA-C-O 125.793 2.711 . . . . 17.100000000000001 113.673 -173.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -128.55 124.68 36.6 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 118.818 -2.426 . . . . 33.549999999999997 107.432 170.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' LEU . . . . . 0.589 ' HB3' ' CG2' ' A' ' 138' ' ' ILE . 33.5 tp -123.01 130.73 53.17 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 117.126 -1.416 . . . . 20.350000000000001 109.815 -177.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -104.74 110.12 22.33 Favored 'General case' 0 C--O 1.2 -1.535 0 C-N-CA 124.833 1.253 . . . . 26.949999999999999 107.76 179.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LEU . . . . . 0.715 HD22 HG11 ' A' ' 137' ' ' VAL . 0.0 OUTLIER -71.87 -34.77 69.47 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.102 -0.954 . . . . 33.700000000000003 112.831 -170.84 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLY . . . . . 0.913 ' HA3' ' O ' ' A' ' 552' ' ' HOH . . . -69.36 -38.41 80.84 Favored Glycine 0 CA--C 1.504 -0.624 0 CA-C-O 117.245 -1.864 . . . . 36.689999999999998 115.091 173.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 51.9 p -108.51 -9.18 15.39 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 123.1 3.45 . . . . 30.719999999999999 113.041 -171.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ARG . . . . . 0.547 ' HG3' ' CD1' ' A' ' 166' ' ' PHE . 11.1 ttm180 64.47 35.29 9.59 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.306 -2.121 . . . . 29.629999999999999 113.112 -175.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -96.29 126.6 41.62 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 120.257 -1.527 . . . . 30.829999999999998 107.61 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' MET . . . . . 0.88 ' HG2' ' HE2' ' A' ' 159' ' ' MET . 3.5 tpp -124.89 148.95 48.04 Favored 'General case' 0 C--O 1.188 -2.137 0 CA-C-O 115.702 -2.094 . . . . 35.880000000000003 112.607 171.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' PHE . . . . . 0.77 ' N ' ' HG3' ' A' ' 152' ' ' MET . 94.8 m-85 -134.42 136.06 43.01 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 128.365 3.541 . . . . 19.539999999999999 108.719 -175.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ARG . . . . . 0.605 ' HD3' ' CE1' ' A' ' 143' ' ' PHE . 34.6 ttp180 -109.98 117.64 34.32 Favored 'General case' 0 CA--C 1.564 1.515 0 CA-C-O 115.015 -2.422 . . . . 36.0 110.901 166.122 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 79.4 mt-10 51.96 42.82 30.53 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 127.362 2.914 . . . . 30.690000000000001 112.477 -173.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 61.5 9.56 2.76 Favored 'General case' 0 N--CA 1.427 -1.6 0 C-N-CA 131.103 3.761 . . . . 30.829999999999998 119.146 -171.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -95.76 129.64 33.88 Favored Pre-proline 0 CA--C 1.574 1.886 0 CA-C-N 122.692 2.496 . . . . 22.390000000000001 108.941 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -64.58 125.73 15.49 Favored 'Trans proline' 0 C--N 1.291 -2.496 1 O-C-N 129.466 4.403 . . . . 17.289999999999999 112.684 -175.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' MET . . . . . 0.88 ' HE2' ' HG2' ' A' ' 152' ' ' MET . 11.0 ttp -128.61 127.33 23.56 Favored Pre-proline 0 N--CA 1.493 1.71 0 CA-C-N 112.828 -1.987 . . . . 42.990000000000002 107.601 -177.03 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -76.84 153.27 33.15 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 122.576 2.184 . . . . 22.170000000000002 112.893 -174.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' LEU . . . . . 0.416 ' CD1' ' HE3' ' A' ' 211' ' ' MET . 0.0 OUTLIER -129.05 108.56 10.48 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 128.201 2.6 . . . . 30.140000000000001 107.8 176.471 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 17.8 p -49.98 163.51 0.14 Allowed 'General case' 0 N--CA 1.483 1.184 0 O-C-N 128.989 3.931 . . . . 26.739999999999998 110.999 166.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.1 p -55.09 -47.33 75.07 Favored 'General case' 0 C--N 1.361 1.104 0 O-C-N 120.408 -1.432 . . . . 23.609999999999999 111.812 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLY . . . . . 0.64 ' O ' HG12 ' A' ' 168' ' ' VAL . . . -75.89 -37.04 39.9 Favored Glycine 0 N--CA 1.47 0.957 0 CA-C-O 125.232 2.573 . . . . 18.379999999999999 112.401 -173.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -56.72 -49.45 75.16 Favored 'General case' 0 C--N 1.365 1.278 0 O-C-N 120.169 -1.783 . . . . 25.949999999999999 112.833 171.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' PHE . . . . . 0.547 ' CD1' ' HG3' ' A' ' 150' ' ' ARG . 63.8 t80 -59.61 -47.69 84.59 Favored 'General case' 0 N--CA 1.432 -1.335 0 C-N-CA 128.02 2.528 . . . . 25.59 110.774 177.078 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -58.25 -49.16 78.07 Favored 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 114.073 -3.051 . . . . 18.68 111.053 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' VAL . . . . . 0.919 HG13 HD11 ' A' ' 208' ' ' LEU . 2.9 p -65.19 -45.86 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 124.311 2.005 . . . . 23.609999999999999 113.023 -178.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 33.0 tp -62.39 -41.3 98.55 Favored 'General case' 0 CA--C 1.466 -2.267 0 C-N-CA 116.361 -2.136 . . . . 15.92 111.903 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' LYS . . . . . 0.574 ' HE2' ' O ' ' A' ' 514' ' ' HOH . 6.8 ttpm? -62.93 -36.01 82.0 Favored 'General case' 0 N--CA 1.438 -1.05 0 O-C-N 117.603 -3.186 . . . . 36.420000000000002 111.921 177.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -66.24 -44.26 84.24 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 127.616 3.579 . . . . 17.43 109.907 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' LEU . . . . . 0.438 ' HB3' ' HB2' ' A' ' 232' ' ' PHE . 20.8 mt -58.24 -56.58 20.19 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 116.306 -3.997 . . . . 16.210000000000001 113.073 177.72 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 173' ' ' VAL . . . . . 0.504 ' HB ' ' CD1' ' A' ' 138' ' ' ILE . 14.5 m -76.34 -24.29 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-O 122.544 1.164 . . . . 21.66 110.537 -167.312 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 58.4 m -76.6 -7.77 55.89 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.078 -1.014 . . . . 27.039999999999999 111.925 174.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 66.3 m80 -123.93 62.45 27.27 Favored Pre-proline 0 C--N 1.314 -0.948 0 O-C-N 118.244 -2.785 . . . . 22.98 113.159 170.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -60.11 131.34 38.56 Favored 'Trans proline' 0 CA--C 1.508 -0.816 0 CA-C-O 123.29 1.288 . . . . 22.73 111.842 -169.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 63.58 15.63 9.02 Favored 'General case' 0 N--CA 1.442 -0.868 0 O-C-N 118.205 -2.809 . . . . 33.439999999999998 114.294 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -101.83 110.07 61.19 Favored Pre-proline 0 C--O 1.221 -0.407 0 CA-C-N 120.099 1.318 . . . . 35.659999999999997 108.608 166.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' PRO . . . . . 0.639 ' HB3' HG21 ' A' ' 225' ' ' VAL . 2.6 Cg_endo -59.67 133.36 50.95 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.261 1.974 . . . . 23.07 109.579 173.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 83.3 mt -124.18 128.43 49.21 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.726 -1.213 . . . . 19.890000000000001 107.726 -168.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 94.2 p -71.32 167.67 19.01 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 117.666 -1.614 . . . . 15.09 107.158 -176.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' ARG . . . . . 0.871 HH11 ' HB3' ' A' ' 182' ' ' ARG . 0.0 OUTLIER -56.47 -44.68 80.81 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 114.386 1.254 . . . . 38.5 114.386 168.818 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 183' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -55.91 -48.29 75.92 Favored 'General case' 0 C--N 1.379 1.852 0 N-CA-C 114.153 1.168 . . . . 29.07 114.153 174.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 1.2 tptp -65.09 -34.16 77.75 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 119.602 -1.936 . . . . 33.090000000000003 111.987 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' LEU . . . . . . . . . . . . . 20.7 mt -68.57 -48.45 64.19 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 122.412 1.101 . . . . 22.43 112.955 173.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' MET . . . . . 0.523 ' CE ' ' HB1' ' A' ' 196' ' ' ALA . 26.4 mmm -51.31 -52.5 44.7 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-O 115.101 -2.381 . . . . 54.390000000000001 109.421 174.11 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 187' ' ' ASN . . . . . 0.51 ' HA ' ' HE ' ' A' ' 190' ' ' ARG . 59.3 m-20 -56.12 -51.49 67.72 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 126.039 2.087 . . . . 31.91 111.916 -179.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 67.8 mt -65.34 -33.25 75.52 Favored 'General case' 0 C--O 1.248 1.018 0 CA-C-O 123.347 1.546 . . . . 28.34 114.648 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' ALA . . . . . . . . . . . . . . . -59.89 -24.02 63.94 Favored 'General case' 0 C--O 1.249 1.028 0 N-CA-C 118.323 2.712 . . . . 31.370000000000001 118.323 168.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 190' ' ' ARG . . . . . 0.51 ' HE ' ' HA ' ' A' ' 187' ' ' ASN . 33.6 mtm105 -61.13 119.02 7.56 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 115.049 1.5 . . . . 45.619999999999997 115.049 178.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . -123.55 -165.16 12.22 Favored Glycine 0 CA--C 1.53 0.995 0 N-CA-C 109.279 -1.528 . . . . 32.780000000000001 109.279 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 -82.28 16.66 1.93 Allowed 'General case' 0 C--O 1.242 0.666 0 N-CA-C 116.74 2.126 . . . . 29.530000000000001 116.74 172.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -135.5 171.1 14.93 Favored 'General case' 0 CA--C 1.518 -0.284 0 O-C-N 120.857 -1.152 . . . . 27.969999999999999 108.278 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -51.98 105.82 0.13 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 127.441 2.297 . . . . 32.380000000000003 109.8 162.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -148.79 -73.35 0.19 Allowed 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 105.815 -1.92 . . . . 33.520000000000003 105.815 -170.535 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 196' ' ' ALA . . . . . 0.523 ' HB1' ' CE ' ' A' ' 186' ' ' MET . . . -62.59 -30.78 71.58 Favored 'General case' 0 C--O 1.251 1.145 0 CA-C-N 114.45 -1.25 . . . . 35.210000000000001 113.055 -176.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 197' ' ' MET . . . . . . . . . . . . . 92.1 mtp -100.03 6.86 45.04 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 120.632 -1.293 . . . . 42.189999999999998 110.945 -170.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' GLU . . . . . 0.523 ' OE2' ' NH2' ' A' ' 199' ' ' ARG . 31.4 tt0 -61.7 -56.51 18.95 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 118.716 -2.49 . . . . 36.030000000000001 114.308 178.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 199' ' ' ARG . . . . . 0.523 ' NH2' ' OE2' ' A' ' 198' ' ' GLU . 43.6 mtm-85 -140.28 169.46 17.63 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.656 -1.277 . . . . 48.700000000000003 109.789 174.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.63 152.8 21.5 Favored 'General case' 0 C--O 1.248 0.996 0 O-C-N 124.684 1.24 . . . . 31.190000000000001 110.985 174.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 19.5 mm -62.01 -42.26 94.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 CA-C-O 117.576 -1.202 . . . . 26.510000000000002 109.561 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -64.13 -38.16 90.08 Favored 'General case' 0 C--O 1.251 1.153 0 CA-C-N 120.173 1.352 . . . . 28.02 111.783 -175.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 25.4 t -67.39 -37.38 78.86 Favored 'Isoleucine or valine' 0 C--O 1.261 1.693 0 C-N-CA 124.257 1.023 . . . . 24.030000000000001 111.298 174.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' GLN . . . . . . . . . . . . 0.271 20.1 mm-40 -64.56 -45.44 87.08 Favored 'General case' 0 C--O 1.252 1.23 0 CA-C-O 117.646 -1.169 . . . . 27.050000000000001 109.41 173.387 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ILE . . . . . . . . . . . . . 29.4 mm -59.78 -43.05 90.82 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 O-C-N 124.749 1.28 . . . . 16.960000000000001 111.968 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 27.4 t -62.51 -48.51 79.25 Favored 'General case' 0 C--O 1.252 1.223 0 O-C-N 124.677 1.236 . . . . 18.800000000000001 110.119 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ARG . . . . . . . . . . . . . 54.0 mtp85 -59.75 -44.75 93.68 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 117.867 -1.063 . . . . 28.16 113.673 173.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' LEU . . . . . 0.919 HD11 HG13 ' A' ' 168' ' ' VAL . 48.7 mt -61.42 -37.61 84.13 Favored 'General case' 0 C--O 1.26 1.616 0 CA-C-N 122.152 2.251 . . . . 17.98 112.722 174.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 209' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -66.75 -40.07 88.14 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.723 -1.236 . . . . 18.32 110.927 176.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 210' ' ' ARG . . . . . 0.616 ' HD2' ' O ' ' A' ' 551' ' ' HOH . 1.6 mtp180 -69.71 -24.94 63.64 Favored 'General case' 0 C--O 1.257 1.499 0 O-C-N 119.628 -1.92 . . . . 40.719999999999999 112.007 179.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 211' ' ' MET . . . . . 0.416 ' HE3' ' CD1' ' A' ' 161' ' ' LEU . 14.3 mtp -76.83 -44.34 32.78 Favored 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 126.966 2.107 . . . . 43.780000000000001 112.557 170.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 212' ' ' VAL . . . . . . . . . . . . . 13.0 m -110.06 -12.04 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.098 0 O-C-N 119.156 -2.215 . . . . 21.079999999999998 114.58 -165.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 213' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -110.06 139.88 44.72 Favored 'General case' 0 CA--C 1.55 0.964 0 O-C-N 116.593 -3.817 . . . . 22.57 106.248 -164.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -62.25 -38.26 88.59 Favored 'General case' 0 C--N 1.316 -0.867 0 O-C-N 126.623 2.452 . . . . 32.420000000000002 113.255 166.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 215' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -135.5 108.71 10.19 Favored Pre-proline 0 N--CA 1.474 0.728 0 CA-C-O 116.236 -1.84 . . . . 26.829999999999998 107.105 173.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -59.54 -25.45 78.8 Favored 'Trans proline' 0 C--N 1.295 -2.24 0 C-N-CA 121.971 1.781 . . . . 23.219999999999999 113.936 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' ALA . . . . . . . . . . . . . . . -70.25 -25.18 63.25 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 116.019 1.859 . . . . 20.030000000000001 116.019 174.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -134.17 70.22 73.78 Favored Pre-proline 0 C--O 1.257 1.464 0 O-C-N 120.039 -1.663 . . . . 27.170000000000002 110.62 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 219' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -71.78 142.31 39.15 Favored 'Trans proline' 0 C--O 1.245 0.855 0 C-N-CA 120.966 1.111 . . . . 20.329999999999998 111.874 -165.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' ARG . . . . . 0.494 HH22 ' HB2' ' A' ' 235' ' ' ASP . 37.6 tpt85 -90.45 -47.4 7.75 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 115.886 1.809 . . . . 24.699999999999999 115.886 172.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 221' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -91.81 -42.2 10.23 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 125.411 1.484 . . . . 28.859999999999999 111.579 -170.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 222' ' ' ILE . . . . . . . . . . . . . 79.6 mt -108.44 88.66 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 126.987 2.679 . . . . 18.989999999999998 109.878 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 223' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -97.32 157.1 16.14 Favored 'General case' 0 N--CA 1.412 -2.369 0 C-N-CA 128.059 2.544 . . . . 21.5 110.388 -169.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' THR . . . . . . . . . . . . . 4.8 m -100.58 136.66 40.11 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 113.87 -1.514 . . . . 17.93 108.327 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 225' ' ' VAL . . . . . 0.639 HG21 ' HB3' ' A' ' 179' ' ' PRO . 39.6 t -115.79 114.2 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.173 0 N-CA-C 106.284 -1.747 . . . . 21.120000000000001 106.284 175.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 226' ' ' TRP . . . . . 0.569 ' HB3' ' O ' ' A' ' 542' ' ' HOH . 4.4 m95 -62.45 138.75 58.52 Favored 'General case' 0 C--N 1.309 -1.168 0 O-C-N 127.458 2.974 . . . . 26.579999999999998 105.209 -167.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . 95.87 -14.5 64.61 Favored Glycine 0 N--CA 1.483 1.813 0 N-CA-C 107.521 -2.232 . . . . 25.43 107.521 169.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 228' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 565' ' ' HOH . 6.8 mp -128.16 -77.04 0.56 Allowed 'General case' 0 C--O 1.252 1.231 0 O-C-N 119.16 -2.376 . . . . 30.079999999999998 108.182 -152.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 229' ' ' GLY . . . . . . . . . . . . . . . 170.51 -137.74 4.6 Favored Glycine 0 CA--C 1.574 3.761 0 C-N-CA 116.155 -2.926 . . . . 18.039999999999999 106.488 -163.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 230' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -132.61 157.2 45.37 Favored 'General case' 0 C--O 1.258 1.546 0 N-CA-C 106.779 -1.563 . . . . 18.629999999999999 106.779 -170.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 231' ' ' VAL . . . . . . . . . . . . . 12.5 p -145.77 138.7 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 118.901 -1.119 . . . . 16.59 109.326 -176.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 232' ' ' PHE . . . . . 0.438 ' HB2' ' HB3' ' A' ' 172' ' ' LEU . 81.3 t80 -86.13 126.68 34.39 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 124.983 1.427 . . . . 21.75 112.04 167.583 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 233' ' ' VAL . . . . . . . . . . . . . 42.4 t -115.45 110.14 45.33 Favored Pre-proline 0 CA--C 1.558 1.257 0 N-CA-C 107.446 -1.316 . . . . 20.68 107.446 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 234' ' ' PRO . . . . . 0.751 ' O ' ' HB2' ' A' ' 235' ' ' ASP . 3.1 Cg_endo -66.76 171.0 11.58 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 125.139 2.126 . . . . 25.440000000000001 114.192 -172.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 235' ' ' ASP . . . . . 0.751 ' HB2' ' O ' ' A' ' 234' ' ' PRO . 4.4 m-20 . . . . . 0 C--O 1.25 1.09 0 N-CA-C 120.947 3.684 . . . . 35.950000000000003 120.947 173.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . 0.574 ' O ' ' HE2' ' A' ' 170' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 540' ' ' HOH . . . . . 0.46 ' O ' ' NH2' ' A' ' 182' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 542' ' ' HOH . . . . . 0.569 ' O ' ' HB3' ' A' ' 226' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 551' ' ' HOH . . . . . 0.616 ' O ' ' HD2' ' A' ' 210' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 552' ' ' HOH . . . . . 0.913 ' O ' ' HA3' ' A' ' 148' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 565' ' ' HOH . . . . . 0.556 ' O ' ' HB3' ' A' ' 228' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 583' ' ' HOH . . . . . 0.508 ' O ' ' NH2' ' A' ' 182' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.715 HG11 HD22 ' A' ' 147' ' ' LEU . 19.8 t . . . . . 0 N--CA 1.496 1.83 0 N-CA-C 108.746 -0.835 . . . . 43.369999999999997 108.746 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ILE . . . . . 0.589 ' CG2' ' HB3' ' A' ' 145' ' ' LEU . 8.2 tt -131.72 135.53 58.72 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 CA-C-O 123.019 1.39 . . . . 39.280000000000001 113.614 -168.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -123.91 130.53 52.74 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 113.583 -1.644 . . . . 25.620000000000001 109.428 175.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -146.94 142.53 27.66 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 123.64 1.686 . . . . 22.260000000000002 111.26 167.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . 48.97 -128.88 22.34 Favored Glycine 0 N--CA 1.467 0.76 0 O-C-N 119.521 -1.987 . . . . 19.780000000000001 111.566 -172.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 10.1 mtpt -91.95 8.39 37.75 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 120.798 -1.413 . . . . 37.890000000000001 111.081 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' PHE . . . . . 0.605 ' CE1' ' HD3' ' A' ' 154' ' ' ARG . 89.8 m-85 -105.78 144.38 32.6 Favored 'General case' 0 C--N 1.361 1.094 0 CA-C-O 125.793 2.711 . . . . 17.100000000000001 113.673 -173.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LYS . . . . . . . . . . . . . 4.3 mttp -128.55 124.68 36.6 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 118.818 -2.426 . . . . 33.549999999999997 107.432 170.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.589 ' HB3' ' CG2' ' A' ' 138' ' ' ILE . 33.5 tp -123.01 130.73 53.17 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 117.126 -1.416 . . . . 20.350000000000001 109.815 -177.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 31.9 t-20 -104.74 110.12 22.33 Favored 'General case' 0 C--O 1.2 -1.535 0 C-N-CA 124.833 1.253 . . . . 26.949999999999999 107.76 179.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.715 HD22 HG11 ' A' ' 137' ' ' VAL . 0.0 OUTLIER -71.87 -34.77 69.47 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.102 -0.954 . . . . 33.700000000000003 112.831 -170.84 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLY . . . . . 0.913 ' HA3' ' O ' ' A' ' 552' ' ' HOH . . . -69.36 -38.41 80.84 Favored Glycine 0 CA--C 1.504 -0.624 0 CA-C-O 117.245 -1.864 . . . . 36.689999999999998 115.091 173.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 51.9 p -108.51 -9.18 15.39 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 123.1 3.45 . . . . 30.719999999999999 113.041 -171.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ARG . . . . . 0.547 ' HG3' ' CD1' ' A' ' 166' ' ' PHE . 11.1 ttm180 64.47 35.29 9.59 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 119.306 -2.121 . . . . 29.629999999999999 113.112 -175.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -96.29 126.6 41.62 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 120.257 -1.527 . . . . 30.829999999999998 107.61 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' MET . . . . . 0.88 ' HG2' ' HE2' ' A' ' 159' ' ' MET . 3.5 tpp -124.89 148.95 48.04 Favored 'General case' 0 C--O 1.188 -2.137 0 CA-C-O 115.702 -2.094 . . . . 35.880000000000003 112.607 171.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' PHE . . . . . 0.77 ' N ' ' HG3' ' A' ' 152' ' ' MET . 94.8 m-85 -134.42 136.06 43.01 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 128.365 3.541 . . . . 19.539999999999999 108.719 -175.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ARG . . . . . 0.605 ' HD3' ' CE1' ' A' ' 143' ' ' PHE . 34.6 ttp180 -109.98 117.64 34.32 Favored 'General case' 0 CA--C 1.564 1.515 0 CA-C-O 115.015 -2.422 . . . . 36.0 110.901 166.122 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' GLU . . . . . . . . . . . . . 79.4 mt-10 51.96 42.82 30.53 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 127.362 2.914 . . . . 30.690000000000001 112.477 -173.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 61.5 9.56 2.76 Favored 'General case' 0 N--CA 1.427 -1.6 0 C-N-CA 131.103 3.761 . . . . 30.829999999999998 119.146 -171.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -95.76 129.64 33.88 Favored Pre-proline 0 CA--C 1.574 1.886 0 CA-C-N 122.692 2.496 . . . . 22.390000000000001 108.941 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -64.58 125.73 15.49 Favored 'Trans proline' 0 C--N 1.291 -2.496 1 O-C-N 129.466 4.403 . . . . 17.289999999999999 112.684 -175.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' MET . . . . . 0.88 ' HE2' ' HG2' ' A' ' 152' ' ' MET . 11.0 ttp -128.61 127.33 23.56 Favored Pre-proline 0 N--CA 1.493 1.71 0 CA-C-N 112.828 -1.987 . . . . 42.990000000000002 107.601 -177.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -76.84 153.27 33.15 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 122.576 2.184 . . . . 22.170000000000002 112.893 -174.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' LEU . . . . . 0.416 ' CD1' ' HE3' ' A' ' 211' ' ' MET . 0.0 OUTLIER -129.05 108.56 10.48 Favored 'General case' 0 C--N 1.3 -1.546 0 C-N-CA 128.201 2.6 . . . . 30.140000000000001 107.8 176.471 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' THR . . . . . . . . . . . . . 17.8 p -49.98 163.51 0.14 Allowed 'General case' 0 N--CA 1.483 1.184 0 O-C-N 128.989 3.931 . . . . 26.739999999999998 110.999 166.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.1 p -55.09 -47.33 75.07 Favored 'General case' 0 C--N 1.361 1.104 0 O-C-N 120.408 -1.432 . . . . 23.609999999999999 111.812 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLY . . . . . 0.64 ' O ' HG12 ' A' ' 168' ' ' VAL . . . -75.89 -37.04 39.9 Favored Glycine 0 N--CA 1.47 0.957 0 CA-C-O 125.232 2.573 . . . . 18.379999999999999 112.401 -173.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -56.72 -49.45 75.16 Favored 'General case' 0 C--N 1.365 1.278 0 O-C-N 120.169 -1.783 . . . . 25.949999999999999 112.833 171.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' PHE . . . . . 0.547 ' CD1' ' HG3' ' A' ' 150' ' ' ARG . 63.8 t80 -59.61 -47.69 84.59 Favored 'General case' 0 N--CA 1.432 -1.335 0 C-N-CA 128.02 2.528 . . . . 25.59 110.774 177.078 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -58.25 -49.16 78.07 Favored 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 114.073 -3.051 . . . . 18.68 111.053 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' VAL . . . . . 0.919 HG13 HD11 ' A' ' 208' ' ' LEU . 2.9 p -65.19 -45.86 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 124.311 2.005 . . . . 23.609999999999999 113.023 -178.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 33.0 tp -62.39 -41.3 98.55 Favored 'General case' 0 CA--C 1.466 -2.267 0 C-N-CA 116.361 -2.136 . . . . 15.92 111.903 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' LYS . . . . . 0.574 ' HE2' ' O ' ' A' ' 514' ' ' HOH . 6.8 ttpm? -62.93 -36.01 82.0 Favored 'General case' 0 N--CA 1.438 -1.05 0 O-C-N 117.603 -3.186 . . . . 36.420000000000002 111.921 177.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -66.24 -44.26 84.24 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 127.616 3.579 . . . . 17.43 109.907 -179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' LEU . . . . . 0.438 ' HB3' ' HB2' ' A' ' 232' ' ' PHE . 20.8 mt -58.24 -56.58 20.19 Favored 'General case' 0 C--N 1.348 0.527 0 O-C-N 116.306 -3.997 . . . . 16.210000000000001 113.073 177.72 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' VAL . . . . . 0.504 ' HB ' ' CD1' ' A' ' 138' ' ' ILE . 14.5 m -76.34 -24.29 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 CA-C-O 122.544 1.164 . . . . 21.66 110.537 -167.312 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 58.4 m -76.6 -7.77 55.89 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.078 -1.014 . . . . 27.039999999999999 111.925 174.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 66.3 m80 -123.93 62.45 27.27 Favored Pre-proline 0 C--N 1.314 -0.948 0 O-C-N 118.244 -2.785 . . . . 22.98 113.159 170.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -60.11 131.34 38.56 Favored 'Trans proline' 0 CA--C 1.508 -0.816 0 CA-C-O 123.29 1.288 . . . . 22.73 111.842 -169.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 63.58 15.63 9.02 Favored 'General case' 0 N--CA 1.442 -0.868 0 O-C-N 118.205 -2.809 . . . . 33.439999999999998 114.294 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -101.83 110.07 61.19 Favored Pre-proline 0 C--O 1.221 -0.407 0 CA-C-N 120.099 1.318 . . . . 35.659999999999997 108.608 166.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' PRO . . . . . 0.639 ' HB3' HG21 ' A' ' 225' ' ' VAL . 2.6 Cg_endo -59.67 133.36 50.95 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 122.261 1.974 . . . . 23.07 109.579 173.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' LEU . . . . . . . . . . . . . 83.3 mt -124.18 128.43 49.21 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.726 -1.213 . . . . 19.890000000000001 107.726 -168.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' SER . . . . . . . . . . . . . 94.2 p -71.32 167.67 19.01 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 117.666 -1.614 . . . . 15.09 107.158 -176.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' ARG . . . . . 0.871 HH11 ' HB3' ' A' ' 182' ' ' ARG . 0.0 OUTLIER -56.47 -44.68 80.81 Favored 'General case' 0 CA--C 1.494 -1.187 0 N-CA-C 114.386 1.254 . . . . 38.5 114.386 168.818 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' ASP . . . . . . . . . . . . . 88.2 m-20 -55.91 -48.29 75.92 Favored 'General case' 0 C--N 1.379 1.852 0 N-CA-C 114.153 1.168 . . . . 29.07 114.153 174.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 1.2 tptp -65.09 -34.16 77.75 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 119.602 -1.936 . . . . 33.090000000000003 111.987 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' LEU . . . . . . . . . . . . . 20.7 mt -68.57 -48.45 64.19 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 122.412 1.101 . . . . 22.43 112.955 173.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' MET . . . . . 0.523 ' CE ' ' HB1' ' A' ' 196' ' ' ALA . 26.4 mmm -51.31 -52.5 44.7 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-O 115.101 -2.381 . . . . 54.390000000000001 109.421 174.11 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' ASN . . . . . 0.51 ' HA ' ' HE ' ' A' ' 190' ' ' ARG . 59.3 m-20 -56.12 -51.49 67.72 Favored 'General case' 0 N--CA 1.434 -1.247 0 O-C-N 126.039 2.087 . . . . 31.91 111.916 -179.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 67.8 mt -65.34 -33.25 75.52 Favored 'General case' 0 C--O 1.248 1.018 0 CA-C-O 123.347 1.546 . . . . 28.34 114.648 179.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' ALA . . . . . . . . . . . . . . . -59.89 -24.02 63.94 Favored 'General case' 0 C--O 1.249 1.028 0 N-CA-C 118.323 2.712 . . . . 31.370000000000001 118.323 168.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' ARG . . . . . 0.51 ' HE ' ' HA ' ' A' ' 187' ' ' ASN . 33.6 mtm105 -61.13 119.02 7.56 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 115.049 1.5 . . . . 45.619999999999997 115.049 178.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . -123.55 -165.16 12.22 Favored Glycine 0 CA--C 1.53 0.995 0 N-CA-C 109.279 -1.528 . . . . 32.780000000000001 109.279 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 -82.28 16.66 1.93 Allowed 'General case' 0 C--O 1.242 0.666 0 N-CA-C 116.74 2.126 . . . . 29.530000000000001 116.74 172.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -135.5 171.1 14.93 Favored 'General case' 0 CA--C 1.518 -0.284 0 O-C-N 120.857 -1.152 . . . . 27.969999999999999 108.278 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -51.98 105.82 0.13 Allowed 'General case' 0 N--CA 1.436 -1.174 0 C-N-CA 127.441 2.297 . . . . 32.380000000000003 109.8 162.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -148.79 -73.35 0.19 Allowed 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 105.815 -1.92 . . . . 33.520000000000003 105.815 -170.535 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' ALA . . . . . 0.523 ' HB1' ' CE ' ' A' ' 186' ' ' MET . . . -62.59 -30.78 71.58 Favored 'General case' 0 C--O 1.251 1.145 0 CA-C-N 114.45 -1.25 . . . . 35.210000000000001 113.055 -176.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' MET . . . . . . . . . . . . . 92.1 mtp -100.03 6.86 45.04 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 120.632 -1.293 . . . . 42.189999999999998 110.945 -170.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' GLU . . . . . 0.523 ' OE2' ' NH2' ' A' ' 199' ' ' ARG . 31.4 tt0 -61.7 -56.51 18.95 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 118.716 -2.49 . . . . 36.030000000000001 114.308 178.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' ARG . . . . . 0.523 ' NH2' ' OE2' ' A' ' 198' ' ' GLU . 43.6 mtm-85 -140.28 169.46 17.63 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.656 -1.277 . . . . 48.700000000000003 109.789 174.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.63 152.8 21.5 Favored 'General case' 0 C--O 1.248 0.996 0 O-C-N 124.684 1.24 . . . . 31.190000000000001 110.985 174.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 19.5 mm -62.01 -42.26 94.2 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 CA-C-O 117.576 -1.202 . . . . 26.510000000000002 109.561 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -64.13 -38.16 90.08 Favored 'General case' 0 C--O 1.251 1.153 0 CA-C-N 120.173 1.352 . . . . 28.02 111.783 -175.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' VAL . . . . . . . . . . . . . 25.4 t -67.39 -37.38 78.86 Favored 'Isoleucine or valine' 0 C--O 1.261 1.693 0 C-N-CA 124.257 1.023 . . . . 24.030000000000001 111.298 174.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' GLN . . . . . . . . . . . . 0.271 20.1 mm-40 -64.56 -45.44 87.08 Favored 'General case' 0 C--O 1.252 1.23 0 CA-C-O 117.646 -1.169 . . . . 27.050000000000001 109.41 173.387 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ILE . . . . . . . . . . . . . 29.4 mm -59.78 -43.05 90.82 Favored 'Isoleucine or valine' 0 C--O 1.243 0.728 0 O-C-N 124.749 1.28 . . . . 16.960000000000001 111.968 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' SER . . . . . . . . . . . . . 27.4 t -62.51 -48.51 79.25 Favored 'General case' 0 C--O 1.252 1.223 0 O-C-N 124.677 1.236 . . . . 18.800000000000001 110.119 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ARG . . . . . . . . . . . . . 54.0 mtp85 -59.75 -44.75 93.68 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 117.867 -1.063 . . . . 28.16 113.673 173.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' LEU . . . . . 0.919 HD11 HG13 ' A' ' 168' ' ' VAL . 48.7 mt -61.42 -37.61 84.13 Favored 'General case' 0 C--O 1.26 1.616 0 CA-C-N 122.152 2.251 . . . . 17.98 112.722 174.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -66.75 -40.07 88.14 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.723 -1.236 . . . . 18.32 110.927 176.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' ARG . . . . . 0.616 ' HD2' ' O ' ' A' ' 551' ' ' HOH . 1.6 mtp180 -69.71 -24.94 63.64 Favored 'General case' 0 C--O 1.257 1.499 0 O-C-N 119.628 -1.92 . . . . 40.719999999999999 112.007 179.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' MET . . . . . 0.416 ' HE3' ' CD1' ' A' ' 161' ' ' LEU . 14.3 mtp -76.83 -44.34 32.78 Favored 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 126.966 2.107 . . . . 43.780000000000001 112.557 170.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' VAL . . . . . . . . . . . . . 13.0 m -110.06 -12.04 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.098 0 O-C-N 119.156 -2.215 . . . . 21.079999999999998 114.58 -165.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' GLU . . . . . . . . . . . . . 77.1 mm-40 -110.06 139.88 44.72 Favored 'General case' 0 CA--C 1.55 0.964 0 O-C-N 116.593 -3.817 . . . . 22.57 106.248 -164.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -62.25 -38.26 88.59 Favored 'General case' 0 C--N 1.316 -0.867 0 O-C-N 126.623 2.452 . . . . 32.420000000000002 113.255 166.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -135.5 108.71 10.19 Favored Pre-proline 0 N--CA 1.474 0.728 0 CA-C-O 116.236 -1.84 . . . . 26.829999999999998 107.105 173.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -59.54 -25.45 78.8 Favored 'Trans proline' 0 C--N 1.295 -2.24 0 C-N-CA 121.971 1.781 . . . . 23.219999999999999 113.936 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' ALA . . . . . . . . . . . . . . . -70.25 -25.18 63.25 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 116.019 1.859 . . . . 20.030000000000001 116.019 174.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -134.17 70.22 73.78 Favored Pre-proline 0 C--O 1.257 1.464 0 O-C-N 120.039 -1.663 . . . . 27.170000000000002 110.62 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -71.78 142.31 39.15 Favored 'Trans proline' 0 C--O 1.245 0.855 0 C-N-CA 120.966 1.111 . . . . 20.329999999999998 111.874 -165.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' ARG . . . . . 0.494 HH22 ' HB2' ' A' ' 235' ' ' ASP . 37.6 tpt85 -90.45 -47.4 7.75 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 115.886 1.809 . . . . 24.699999999999999 115.886 172.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -91.81 -42.2 10.23 Favored 'General case' 0 CA--C 1.567 1.598 0 C-N-CA 125.411 1.484 . . . . 28.859999999999999 111.579 -170.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' ILE . . . . . . . . . . . . . 79.6 mt -108.44 88.66 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 126.987 2.679 . . . . 18.989999999999998 109.878 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -97.32 157.1 16.14 Favored 'General case' 0 N--CA 1.412 -2.369 0 C-N-CA 128.059 2.544 . . . . 21.5 110.388 -169.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' THR . . . . . . . . . . . . . 4.8 m -100.58 136.66 40.11 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 113.87 -1.514 . . . . 17.93 108.327 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' VAL . . . . . 0.639 HG21 ' HB3' ' A' ' 179' ' ' PRO . 39.6 t -115.79 114.2 45.56 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.173 0 N-CA-C 106.284 -1.747 . . . . 21.120000000000001 106.284 175.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' TRP . . . . . 0.569 ' HB3' ' O ' ' A' ' 542' ' ' HOH . 4.4 m95 -62.45 138.75 58.52 Favored 'General case' 0 C--N 1.309 -1.168 0 O-C-N 127.458 2.974 . . . . 26.579999999999998 105.209 -167.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' GLY . . . . . . . . . . . . . . . 95.87 -14.5 64.61 Favored Glycine 0 N--CA 1.483 1.813 0 N-CA-C 107.521 -2.232 . . . . 25.43 107.521 169.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' LEU . . . . . 0.556 ' HB3' ' O ' ' A' ' 565' ' ' HOH . 6.8 mp -128.16 -77.04 0.56 Allowed 'General case' 0 C--O 1.252 1.231 0 O-C-N 119.16 -2.376 . . . . 30.079999999999998 108.182 -152.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' GLY . . . . . . . . . . . . . . . 170.51 -137.74 4.6 Favored Glycine 0 CA--C 1.574 3.761 0 C-N-CA 116.155 -2.926 . . . . 18.039999999999999 106.488 -163.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -132.61 157.2 45.37 Favored 'General case' 0 C--O 1.258 1.546 0 N-CA-C 106.779 -1.563 . . . . 18.629999999999999 106.779 -170.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' VAL . . . . . . . . . . . . . 12.5 p -145.77 138.7 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 118.901 -1.119 . . . . 16.59 109.326 -176.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' PHE . . . . . 0.438 ' HB2' ' HB3' ' A' ' 172' ' ' LEU . 81.3 t80 -86.13 126.68 34.39 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 124.983 1.427 . . . . 21.75 112.04 167.583 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' VAL . . . . . . . . . . . . . 42.4 t -115.45 110.14 45.33 Favored Pre-proline 0 CA--C 1.558 1.257 0 N-CA-C 107.446 -1.316 . . . . 20.68 107.446 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' PRO . . . . . 0.751 ' O ' ' HB2' ' A' ' 235' ' ' ASP . 3.1 Cg_endo -66.76 171.0 11.58 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 125.139 2.126 . . . . 25.440000000000001 114.192 -172.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' ASP . . . . . 0.751 ' HB2' ' O ' ' A' ' 234' ' ' PRO . 4.4 m-20 . . . . . 0 C--O 1.25 1.09 0 N-CA-C 120.947 3.684 . . . . 35.950000000000003 120.947 173.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . 0.574 ' O ' ' HE2' ' A' ' 170' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' HOH . . . . . 0.46 ' O ' ' NH2' ' A' ' 182' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' HOH . . . . . 0.569 ' O ' ' HB3' ' A' ' 226' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' HOH . . . . . 0.616 ' O ' ' HD2' ' A' ' 210' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' HOH . . . . . 0.913 ' O ' ' HA3' ' A' ' 148' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 555' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 556' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 557' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 558' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 559' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 560' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 561' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 562' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 563' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 564' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 565' ' ' HOH . . . . . 0.556 ' O ' ' HB3' ' A' ' 228' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 566' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 567' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 568' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 569' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 570' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 571' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 572' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 573' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 574' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 575' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 576' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 577' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 578' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 579' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 580' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 581' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 582' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 583' ' ' HOH . . . . . 0.508 ' O ' ' NH2' ' A' ' 182' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_