# EXCLUDED_RESIDUES HETATM # PDBID_LIST 1mdl # POINT_FILE 1mdl_RMN.ptf # PROPERTIES ATOM_TYPE_IS_C, ATOM_TYPE_IS_CT, ATOM_TYPE_IS_CA, # PROPERTIES ATOM_TYPE_IS_N, ATOM_TYPE_IS_N2, ATOM_TYPE_IS_N3, # PROPERTIES ATOM_TYPE_IS_NA, ATOM_TYPE_IS_O, ATOM_TYPE_IS_O2, # PROPERTIES ATOM_TYPE_IS_OH, ATOM_TYPE_IS_S, ATOM_TYPE_IS_SH, # PROPERTIES ATOM_TYPE_IS_OTHER, PARTIAL_CHARGE, ELEMENT_IS_ANY, # PROPERTIES ELEMENT_IS_C, ELEMENT_IS_N, ELEMENT_IS_O, ELEMENT_IS_S, # PROPERTIES ELEMENT_IS_OTHER, HYDROXYL, AMIDE, AMINE, CARBONYL, # PROPERTIES RING_SYSTEM, PEPTIDE, VDW_VOLUME, CHARGE, NEG_CHARGE, # PROPERTIES POS_CHARGE, CHARGE_WITH_HIS, HYDROPHOBICITY, MOBILITY, # PROPERTIES SOLVENT_ACCESSIBILITY, RESIDUE_NAME_IS_ALA, # PROPERTIES RESIDUE_NAME_IS_ARG, RESIDUE_NAME_IS_ASN, RESIDUE_NAME_IS_ASP, # PROPERTIES RESIDUE_NAME_IS_CYS, RESIDUE_NAME_IS_GLN, RESIDUE_NAME_IS_GLU, # PROPERTIES RESIDUE_NAME_IS_GLY, RESIDUE_NAME_IS_HIS, RESIDUE_NAME_IS_ILE, # PROPERTIES RESIDUE_NAME_IS_LEU, RESIDUE_NAME_IS_LYS, RESIDUE_NAME_IS_MET, # PROPERTIES RESIDUE_NAME_IS_PHE, RESIDUE_NAME_IS_PRO, RESIDUE_NAME_IS_SER, # PROPERTIES RESIDUE_NAME_IS_THR, RESIDUE_NAME_IS_TRP, RESIDUE_NAME_IS_TYR, # PROPERTIES RESIDUE_NAME_IS_VAL, RESIDUE_NAME_IS_HOH, # PROPERTIES RESIDUE_NAME_IS_OTHER, RESIDUE_CLASS1_IS_HYDROPHOBIC, # PROPERTIES RESIDUE_CLASS1_IS_CHARGED, RESIDUE_CLASS1_IS_POLAR, # PROPERTIES RESIDUE_CLASS1_IS_UNKNOWN, RESIDUE_CLASS2_IS_NONPOLAR, # PROPERTIES RESIDUE_CLASS2_IS_POLAR, RESIDUE_CLASS2_IS_BASIC, # PROPERTIES RESIDUE_CLASS2_IS_ACIDIC, RESIDUE_CLASS2_IS_UNKNOWN, # PROPERTIES SECONDARY_STRUCTURE1_IS_3HELIX, SECONDARY_STRUCTURE1_IS_4HELIX, # PROPERTIES SECONDARY_STRUCTURE1_IS_5HELIX, SECONDARY_STRUCTURE1_IS_BRIDGE, # PROPERTIES SECONDARY_STRUCTURE1_IS_STRAND, SECONDARY_STRUCTURE1_IS_TURN, # PROPERTIES SECONDARY_STRUCTURE1_IS_BEND, SECONDARY_STRUCTURE1_IS_COIL, # PROPERTIES SECONDARY_STRUCTURE1_IS_HET, SECONDARY_STRUCTURE1_IS_UNKNOWN, # PROPERTIES SECONDARY_STRUCTURE2_IS_HELIX, SECONDARY_STRUCTURE2_IS_BETA, # PROPERTIES SECONDARY_STRUCTURE2_IS_COIL, SECONDARY_STRUCTURE2_IS_HET, # PROPERTIES SECONDARY_STRUCTURE2_IS_UNKNOWN # SHELLS 6 # SHELL_WIDTH 1.25 # VERBOSITY 0 Env_1mdl_0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.2985 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 29 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 3 0 0 0 0 0 0 0 0 0 0 0 -0.1286 4 4 0 0 0 0 0 0 0 0 0 2 134.04 0 0 0 0 2 4 116 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 1 0 0 2 0 0 0 1 0 0 0 0 0 -0.8095 4 1 2 1 0 0 0 2 0 1 0 4 73.278 0 0 0 0 -3 0 158 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 2 0 0 3 0 1 0 3 0 1 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 1 4 0 0 0 0 0 4 0 1 0 0 0 -2.4525 10 5 0 5 0 0 1 0 0 4 0 7 230.683 0 0 0 0 -4 5 421 0 0 0 0 0 0 0 0 3 0 0 0 0 0 2 2 1 0 1 1 0 0 3 0 7 0 3 4 3 0 0 0 0 0 0 7 0 0 3 0 0 0 7 3 0 0 2 9 2 4 3 0 1 0 0 0 0 0 0 -2.6239 21 13 8 0 0 0 0 5.5 2.5 0 2 8 549.89 0.999 0 0.999 1.499 -2 37 1081 0 4 0 0 0 0 0 0 3 0 1 0 0 0 2 2 2 0 1 6 0 0 9 4 8 0 9 5 7 0 0 0 0 0 0 17 0 0 4 0 0 0 17 4 0 0 3 18 3 2 2 0 0 4 1 2 0 0 0 -5.0099 35 24 4 7 0 0 2 3 1 4.5 2 14 948.89 1.332 0.333 0.999 1.332 -1 57 1542 0 5 0 1 0 0 0 3 5 0 7 0 0 0 2 2 8 0 2 0 0 0 9 6 17 3 9 15 10 1 0 0 3 0 0 20 0 1 11 0 0 3 21 11 0 0 # 36.58 2.858 22.751 # 1mdl_A_398_RMN_22_V_1_A Env_1mdl_1 0 0 0 0 0 0 0 0 0 1 0 0 0 -0.6761 1 0 0 1 0 0 1 0 0 0 0 0 17.157 0 0 0 0 -1 2 39 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0.0828 3 3 0 0 0 0 0 0 0 0 0 1 100.53 0 0 0 0 1 3 117 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 3 0 0 3 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 3 0 0 2 1 0 4 0 0 0 2 0 0 0 0 0 -1.3053 9 3 4 2 0 0 0 4 0 2 0 8 180.066 0 0 0 0 -5 1 610 1 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 2 0 0 3 0 3 3 3 6 0 0 0 0 0 0 0 0 0 3 6 0 0 0 3 6 0 0 3 6 0 1 0 0 0 2 0 0 0 0 0 -0.7963 12 9 1 2 0 0 0 1 0 2 0 9 338.715 0 0 0 0 0 6 1098 2 0 0 0 0 0 0 1 2 0 0 0 0 0 0 0 1 0 0 6 0 0 8 0 3 1 8 2 2 0 0 0 0 0 0 5 0 6 1 0 0 0 11 1 0 0 2 5 0 2 1 0 0 2 0 0 0 0 0 -2.2412 12 7 3 2 0 0 0 2.5 0.5 2 0 8 310.261 0.333 0 0.333 0.333 -2 10 865 2 1 0 0 0 0 0 0 3 0 0 0 0 0 0 0 2 0 0 4 0 0 6 1 5 0 6 2 4 0 0 0 0 0 0 9 0 3 0 0 0 0 12 0 0 0 0 9 2 0 0 0 0 2 0 1 0 0 0 -1.1906 14 11 0 3 0 0 1 0 0 2 1 4 382.893 0.333 0 0.333 0.333 3 20 754 0 1 0 0 0 0 0 0 1 0 3 0 0 0 0 0 3 0 0 6 0 0 9 1 4 0 9 3 2 0 0 0 0 0 0 11 0 3 0 0 0 0 14 0 0 0 # 36.163 -4.012 22.128 # 1mdl_A_398_RMN_24_T_1_A Env_1mdl_2 0 1 0 0 0 0 0 0 0 0 0 0 0 0.2985 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 60 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 -0.7258 3 3 0 0 0 0 0 0 0 0 0 1 100.53 0 0 0 0 2 4 180 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 3 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 2 0 0 2 0 0 0 2 0 0 0 0 0 -0.7726 6 2 2 2 0 0 0 2 0 2 0 6 118.282 0 0 0 0 -4 0 391 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 2 0 0 3 0 0 3 0 2 1 3 3 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 3 0 1 0 0 0 2 0 0 0 0 0 -1.9346 6 3 1 2 0 0 0 1 0 2 0 5 137.655 0 0 0 0 -2 2 305 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 3 0 0 2 0 0 2 0 3 1 2 4 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 4 8 0 2 0 0 0 1 0 1 0 0 0 -0.3674 16 12 2 2 0 0 1 2 0 1 0 9 459.045 0 0 0 0 1 13 760 0 0 0 0 0 0 0 3 0 0 1 0 0 0 0 0 7 0 0 5 0 0 6 0 7 3 6 10 0 0 0 0 0 0 0 13 0 0 3 0 0 0 13 3 0 0 2 10 0 4 0 0 0 2 0 2 0 0 0 -2.1875 20 12 4 4 0 0 2 4 0 2 0 12 515.97 0 0 0 0 -5 12 923 2 0 0 0 0 0 0 3 3 0 1 0 0 0 4 0 6 0 1 0 0 0 7 0 10 3 7 10 3 0 0 1 0 0 0 13 0 1 5 0 0 1 14 5 0 0 # 40.887 -0.17 20.701 # 1mdl_A_398_RMN_29_V_1_A Env_1mdl_3 0 1 0 0 0 0 0 0 0 0 0 0 0 -0.1825 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0.2153 3 2 1 0 0 0 0 1 0 0 0 3 81.157 0 0 0 0 -1 0 6 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 0 0 3 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 3 0 0 0 1 1 0 1 0 0 0 1 0 0 0 0 0 -0.2062 4 2 1 1 0 0 0 1 0 1 0 3 92.651 0 0 0 0 -2 1 74 1 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 1 0 0 0 0 0 3 0 1 0 3 1 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 1 10 2 1 0 0 0 4 0 0 0 0 0 -3.8368 18 13 1 4 0 0 0 1 0 4 2 8 481.765 0 0 0 0 5 26 290 0 0 0 0 0 0 0 0 0 0 8 0 0 2 3 0 2 0 0 3 0 0 16 0 2 0 16 2 0 0 0 0 0 0 0 15 0 3 0 0 0 0 18 0 0 0 4 13 3 4 0 0 0 2 0 1 0 0 0 -1.4224 27 20 4 3 0 0 1 4 0 2 3 13 739.984 0 0 0 0 4 31 569 1 0 3 0 0 0 0 0 0 0 9 0 0 3 5 0 3 0 0 3 0 0 21 0 6 0 21 6 0 0 0 0 0 0 0 22 0 5 0 0 0 0 27 0 0 0 7 11 1 5 0 0 0 6 0 0 0 0 0 -2.5389 30 19 5 6 0 0 0 5 0 6 1 22 756.419 0 0 0 0 -5 14 1022 2 0 4 2 0 0 0 2 0 0 5 0 0 4 2 0 1 0 4 4 0 0 17 2 9 2 17 11 0 2 0 0 0 0 0 21 0 6 3 0 0 0 27 3 0 0 # 41.761 6.765 16.471 # 1mdl_A_398_RMN_32_A_1_A Env_1mdl_4 0 0 0 1 0 0 0 0 0 0 0 0 0 -0.2547 1 0 1 0 0 0 0 1 0 0 0 1 14.137 0 0 0 0 -1 0 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 2 4 0 0 0 0 0 0 0 0 0 0 0 1.1913 6 6 0 0 0 0 0 0 0 0 0 3 201.06 0 0 0 0 2 4 27 1 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 1 0 1 0 0 0 2 0 0 0 0 0 -1.5246 4 1 1 2 0 0 0 1 0 2 0 4 70.635 0 0 0 0 -3 0 9 2 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 2 3 2 5 0 0 0 3 0 0 0 0 0 -3.5519 15 7 5 3 0 0 0 5 0 3 2 8 323.12 0 0 0 0 -4 17 472 4 0 3 0 0 0 0 0 0 0 1 0 0 2 1 0 2 0 1 1 0 0 9 0 6 0 9 6 0 0 0 1 0 0 0 10 0 2 2 0 0 1 12 2 0 0 7 17 2 3 0 0 0 4 0 1 0 0 0 -1.0537 34 26 3 5 0 0 1 3 0 4 2 20 956.884 0 0 0 0 4 29 1183 3 0 4 0 0 0 0 0 0 0 9 0 0 4 4 0 5 0 3 2 0 0 22 0 12 0 22 12 0 0 0 4 4 0 0 17 0 6 3 0 0 8 23 3 0 0 2 12 2 6 0 0 0 5 0 0 0 0 0 -5.4028 27 16 6 5 0 0 0 6 0 5 2 17 664.474 0 0 0 0 -3 20 877 0 0 1 0 0 0 0 0 0 0 4 0 0 5 2 0 4 0 1 10 0 0 21 0 6 0 21 6 0 0 0 3 2 0 0 20 0 2 0 0 0 5 22 0 0 0 # 42.946 3.997 13.391 # 1mdl_A_398_RMN_33_P_1_A Env_1mdl_5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 0 0 -0.6869 6 6 0 0 0 0 0 0 0 0 6 0 153.184 0 0 0 0 6 21 174 0 0 0 0 0 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 6 0 0 0 0 0 0 0 0 6 0 0 0 0 0 0 6 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 -0.4498 2 1 1 0 0 0 0 1 0 0 0 1 47.647 0 0 0 0 0 1 108 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 1 0 1 1 0 0 0 0 0 0 0 1 0 1 0 0 0 0 2 0 0 0 2 7 4 1 0 0 0 1 0 0 0 0 0 -1.3069 15 13 1 1 0 0 0 1 0 1 4 6 427.363 0 0 0 0 7 24 592 2 0 0 0 0 0 0 0 0 0 4 0 0 3 0 0 0 0 6 0 0 0 9 0 6 0 9 6 0 0 0 0 0 0 0 3 0 10 2 0 0 0 13 2 0 0 5 10 1 3 0 0 0 3 0 1 0 0 0 -1.5963 23 16 3 4 0 0 1 3 0 3 2 12 610.29 0 0 0 0 1 32 541 5 0 0 0 0 0 0 0 0 0 5 0 1 1 5 0 1 0 5 0 0 0 17 0 6 0 17 6 0 0 0 0 0 0 0 11 1 9 2 0 0 0 21 2 0 0 0 9 5 2 0 0 0 3 1 0 1 0 0 -4.3539 21 14 2 4 1 0 0 2 0 3.5 5 9 537.609 0.333 0.333 0 0.333 4 33 182 3 0 0 1 0 0 0 0 1 0 7 0 1 3 2 0 2 0 1 0 0 0 16 1 4 0 16 3 1 1 0 0 0 0 2 11 1 3 4 0 0 0 17 4 0 0 # 37.516 5.839 13.613 # 1mdl_A_398_RMN_52_F_1_A Env_1mdl_6 0 0 1 0 0 0 0 0 0 0 0 0 0 0.8076 1 1 0 0 0 0 0 0 0 0 0 0 20.579 0.333 0 0.333 0.333 0 5 74 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 1 0 0 3 0 0 0 0 0 0 0 0 -2.2062 4 1 3 0 0 0 0 1 2 0 0 0 102.947 0.666 0 0.666 0.666 -3 19 296 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 0 0 0 4 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0.039 1 1 0 0 0 0 0 0 0 0 0 0 33.51 0 0 0 0 1 2 74 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 3 0 1 0 0 0 2 0 0 0 0 0 -1.4752 7 4 1 2 0 0 0 1 0 2 0 1 168.526 0 0 0 0 -1 12 296 0 1 3 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 0 0 1 1 5 0 1 4 2 0 0 0 0 0 0 3 3 0 1 0 0 0 6 1 0 0 2 8 0 2 0 0 0 1 1 0 0 0 0 -1.4366 14 10 2 2 0 0 0 2 0 1.5 0 8 389.005 0.333 0.333 0 0.333 0 10 404 0 1 1 1 0 0 0 0 2 0 1 0 0 0 0 3 3 0 0 2 0 0 3 2 9 0 3 7 3 1 0 0 0 0 0 5 1 1 7 0 0 0 7 7 0 0 5 7 0 4 0 0 0 3 2 3 0 0 0 -4.3285 24 12 4 8 0 0 3 4 0 4 0 15 559.964 0.999 0.999 0 0.999 -9 20 726 0 2 2 4 0 0 1 0 3 0 3 0 0 0 0 3 3 0 0 3 0 0 6 7 11 0 6 8 5 5 0 0 0 0 0 12 3 2 7 0 0 0 17 7 0 0 # 31.716 1.525 20.669 # 1mdl_A_398_RMN_166_R_1_A