Upload 8 files
#5
by
						
KexinZhang
	
							
						- opened
							
					
- model_2_multimer/config.json +945 -0
- model_2_multimer/pytorch_model.bin +3 -0
- model_3_multimer/config.json +945 -0
- model_3_multimer/pytorch_model.bin +3 -0
- model_4_multimer/config.json +945 -0
- model_4_multimer/pytorch_model.bin +3 -0
- model_5_multimer/config.json +945 -0
- model_5_multimer/pytorch_model.bin +3 -0
    	
        model_2_multimer/config.json
    ADDED
    
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| 1 | 
            +
            {
         | 
| 2 | 
            +
              "CONFIG": {
         | 
| 3 | 
            +
                "data": {
         | 
| 4 | 
            +
                  "transform": {
         | 
| 5 | 
            +
                    "common": {
         | 
| 6 | 
            +
                      "crop_size": {
         | 
| 7 | 
            +
                        "eval": null,
         | 
| 8 | 
            +
                        "finetune": 384,
         | 
| 9 | 
            +
                        "predict": null,
         | 
| 10 | 
            +
                        "train": 256
         | 
| 11 | 
            +
                      },
         | 
| 12 | 
            +
                      "feats": {
         | 
| 13 | 
            +
                        "aatype": [
         | 
| 14 | 
            +
                          "num residues placeholder"
         | 
| 15 | 
            +
                        ],
         | 
| 16 | 
            +
                        "all_atom_mask": [
         | 
| 17 | 
            +
                          "num residues placeholder",
         | 
| 18 | 
            +
                          null
         | 
| 19 | 
            +
                        ],
         | 
| 20 | 
            +
                        "all_atom_positions": [
         | 
| 21 | 
            +
                          "num residues placeholder",
         | 
| 22 | 
            +
                          null,
         | 
| 23 | 
            +
                          null
         | 
| 24 | 
            +
                        ],
         | 
| 25 | 
            +
                        "alt_chi_angles": [
         | 
| 26 | 
            +
                          "num residues placeholder",
         | 
| 27 | 
            +
                          null
         | 
| 28 | 
            +
                        ],
         | 
| 29 | 
            +
                        "assembly_num_chains": [
         | 
| 30 | 
            +
                          null
         | 
| 31 | 
            +
                        ],
         | 
| 32 | 
            +
                        "asym_id": [
         | 
| 33 | 
            +
                          "num residues placeholder"
         | 
| 34 | 
            +
                        ],
         | 
| 35 | 
            +
                        "asym_len": [
         | 
| 36 | 
            +
                          null
         | 
| 37 | 
            +
                        ],
         | 
| 38 | 
            +
                        "atom14_alt_gt_exists": [
         | 
| 39 | 
            +
                          "num residues placeholder",
         | 
| 40 | 
            +
                          null
         | 
| 41 | 
            +
                        ],
         | 
| 42 | 
            +
                        "atom14_alt_gt_positions": [
         | 
| 43 | 
            +
                          "num residues placeholder",
         | 
| 44 | 
            +
                          null,
         | 
| 45 | 
            +
                          null
         | 
| 46 | 
            +
                        ],
         | 
| 47 | 
            +
                        "atom14_atom_exists": [
         | 
| 48 | 
            +
                          "num residues placeholder",
         | 
| 49 | 
            +
                          null
         | 
| 50 | 
            +
                        ],
         | 
| 51 | 
            +
                        "atom14_atom_is_ambiguous": [
         | 
| 52 | 
            +
                          "num residues placeholder",
         | 
| 53 | 
            +
                          null
         | 
| 54 | 
            +
                        ],
         | 
| 55 | 
            +
                        "atom14_gt_exists": [
         | 
| 56 | 
            +
                          "num residues placeholder",
         | 
| 57 | 
            +
                          null
         | 
| 58 | 
            +
                        ],
         | 
| 59 | 
            +
                        "atom14_gt_positions": [
         | 
| 60 | 
            +
                          "num residues placeholder",
         | 
| 61 | 
            +
                          null,
         | 
| 62 | 
            +
                          null
         | 
| 63 | 
            +
                        ],
         | 
| 64 | 
            +
                        "atom37_atom_exists": [
         | 
| 65 | 
            +
                          "num residues placeholder",
         | 
| 66 | 
            +
                          null
         | 
| 67 | 
            +
                        ],
         | 
| 68 | 
            +
                        "backbone_rigid_mask": [
         | 
| 69 | 
            +
                          "num residues placeholder"
         | 
| 70 | 
            +
                        ],
         | 
| 71 | 
            +
                        "backbone_rigid_tensor": [
         | 
| 72 | 
            +
                          "num residues placeholder",
         | 
| 73 | 
            +
                          null,
         | 
| 74 | 
            +
                          null
         | 
| 75 | 
            +
                        ],
         | 
| 76 | 
            +
                        "bert_mask": [
         | 
| 77 | 
            +
                          "msa placeholder",
         | 
| 78 | 
            +
                          "num residues placeholder"
         | 
| 79 | 
            +
                        ],
         | 
| 80 | 
            +
                        "chi_angles_sin_cos": [
         | 
| 81 | 
            +
                          "num residues placeholder",
         | 
| 82 | 
            +
                          null,
         | 
| 83 | 
            +
                          null
         | 
| 84 | 
            +
                        ],
         | 
| 85 | 
            +
                        "chi_mask": [
         | 
| 86 | 
            +
                          "num residues placeholder",
         | 
| 87 | 
            +
                          null
         | 
| 88 | 
            +
                        ],
         | 
| 89 | 
            +
                        "cluster_bias_mask": [
         | 
| 90 | 
            +
                          "msa placeholder"
         | 
| 91 | 
            +
                        ],
         | 
| 92 | 
            +
                        "entity_id": [
         | 
| 93 | 
            +
                          "num residues placeholder"
         | 
| 94 | 
            +
                        ],
         | 
| 95 | 
            +
                        "extra_deletion_value": [
         | 
| 96 | 
            +
                          "extra msa placeholder",
         | 
| 97 | 
            +
                          "num residues placeholder"
         | 
| 98 | 
            +
                        ],
         | 
| 99 | 
            +
                        "extra_has_deletion": [
         | 
| 100 | 
            +
                          "extra msa placeholder",
         | 
| 101 | 
            +
                          "num residues placeholder"
         | 
| 102 | 
            +
                        ],
         | 
| 103 | 
            +
                        "extra_msa": [
         | 
| 104 | 
            +
                          "extra msa placeholder",
         | 
| 105 | 
            +
                          "num residues placeholder"
         | 
| 106 | 
            +
                        ],
         | 
| 107 | 
            +
                        "extra_msa_mask": [
         | 
| 108 | 
            +
                          "extra msa placeholder",
         | 
| 109 | 
            +
                          "num residues placeholder"
         | 
| 110 | 
            +
                        ],
         | 
| 111 | 
            +
                        "extra_msa_row_mask": [
         | 
| 112 | 
            +
                          "extra msa placeholder"
         | 
| 113 | 
            +
                        ],
         | 
| 114 | 
            +
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         | 
| 115 | 
            +
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         | 
| 116 | 
            +
                          "msa placeholder",
         | 
| 117 | 
            +
                          "num residues placeholder",
         | 
| 118 | 
            +
                          null
         | 
| 119 | 
            +
                        ],
         | 
| 120 | 
            +
                        "msa_mask": [
         | 
| 121 | 
            +
                          "msa placeholder",
         | 
| 122 | 
            +
                          "num residues placeholder"
         | 
| 123 | 
            +
                        ],
         | 
| 124 | 
            +
                        "msa_row_mask": [
         | 
| 125 | 
            +
                          "msa placeholder"
         | 
| 126 | 
            +
                        ],
         | 
| 127 | 
            +
                        "no_recycling_iters": [],
         | 
| 128 | 
            +
                        "num_sym": [
         | 
| 129 | 
            +
                          "num residues placeholder"
         | 
| 130 | 
            +
                        ],
         | 
| 131 | 
            +
                        "pseudo_beta": [
         | 
| 132 | 
            +
                          "num residues placeholder",
         | 
| 133 | 
            +
                          null
         | 
| 134 | 
            +
                        ],
         | 
| 135 | 
            +
                        "pseudo_beta_mask": [
         | 
| 136 | 
            +
                          "num residues placeholder"
         | 
| 137 | 
            +
                        ],
         | 
| 138 | 
            +
                        "residue_index": [
         | 
| 139 | 
            +
                          "num residues placeholder"
         | 
| 140 | 
            +
                        ],
         | 
| 141 | 
            +
                        "residx_atom14_to_atom37": [
         | 
| 142 | 
            +
                          "num residues placeholder",
         | 
| 143 | 
            +
                          null
         | 
| 144 | 
            +
                        ],
         | 
| 145 | 
            +
                        "residx_atom37_to_atom14": [
         | 
| 146 | 
            +
                          "num residues placeholder",
         | 
| 147 | 
            +
                          null
         | 
| 148 | 
            +
                        ],
         | 
| 149 | 
            +
                        "resolution": [],
         | 
| 150 | 
            +
                        "rigidgroups_alt_gt_frames": [
         | 
| 151 | 
            +
                          "num residues placeholder",
         | 
| 152 | 
            +
                          null,
         | 
| 153 | 
            +
                          null,
         | 
| 154 | 
            +
                          null
         | 
| 155 | 
            +
                        ],
         | 
| 156 | 
            +
                        "rigidgroups_group_exists": [
         | 
| 157 | 
            +
                          "num residues placeholder",
         | 
| 158 | 
            +
                          null
         | 
| 159 | 
            +
                        ],
         | 
| 160 | 
            +
                        "rigidgroups_group_is_ambiguous": [
         | 
| 161 | 
            +
                          "num residues placeholder",
         | 
| 162 | 
            +
                          null
         | 
| 163 | 
            +
                        ],
         | 
| 164 | 
            +
                        "rigidgroups_gt_exists": [
         | 
| 165 | 
            +
                          "num residues placeholder",
         | 
| 166 | 
            +
                          null
         | 
| 167 | 
            +
                        ],
         | 
| 168 | 
            +
                        "rigidgroups_gt_frames": [
         | 
| 169 | 
            +
                          "num residues placeholder",
         | 
| 170 | 
            +
                          null,
         | 
| 171 | 
            +
                          null,
         | 
| 172 | 
            +
                          null
         | 
| 173 | 
            +
                        ],
         | 
| 174 | 
            +
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         | 
| 175 | 
            +
                        "seq_mask": [
         | 
| 176 | 
            +
                          "num residues placeholder"
         | 
| 177 | 
            +
                        ],
         | 
| 178 | 
            +
                        "sym_id": [
         | 
| 179 | 
            +
                          "num residues placeholder"
         | 
| 180 | 
            +
                        ],
         | 
| 181 | 
            +
                        "target_feat": [
         | 
| 182 | 
            +
                          "num residues placeholder",
         | 
| 183 | 
            +
                          null
         | 
| 184 | 
            +
                        ],
         | 
| 185 | 
            +
                        "template_aatype": [
         | 
| 186 | 
            +
                          "num templates placeholder",
         | 
| 187 | 
            +
                          "num residues placeholder"
         | 
| 188 | 
            +
                        ],
         | 
| 189 | 
            +
                        "template_all_atom_mask": [
         | 
| 190 | 
            +
                          "num templates placeholder",
         | 
| 191 | 
            +
                          "num residues placeholder",
         | 
| 192 | 
            +
                          null
         | 
| 193 | 
            +
                        ],
         | 
| 194 | 
            +
                        "template_all_atom_positions": [
         | 
| 195 | 
            +
                          "num templates placeholder",
         | 
| 196 | 
            +
                          "num residues placeholder",
         | 
| 197 | 
            +
                          null,
         | 
| 198 | 
            +
                          null
         | 
| 199 | 
            +
                        ],
         | 
| 200 | 
            +
                        "template_alt_torsion_angles_sin_cos": [
         | 
| 201 | 
            +
                          "num templates placeholder",
         | 
| 202 | 
            +
                          "num residues placeholder",
         | 
| 203 | 
            +
                          null,
         | 
| 204 | 
            +
                          null
         | 
| 205 | 
            +
                        ],
         | 
| 206 | 
            +
                        "template_backbone_rigid_mask": [
         | 
| 207 | 
            +
                          "num templates placeholder",
         | 
| 208 | 
            +
                          "num residues placeholder"
         | 
| 209 | 
            +
                        ],
         | 
| 210 | 
            +
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         | 
| 211 | 
            +
                          "num templates placeholder",
         | 
| 212 | 
            +
                          "num residues placeholder",
         | 
| 213 | 
            +
                          null,
         | 
| 214 | 
            +
                          null
         | 
| 215 | 
            +
                        ],
         | 
| 216 | 
            +
                        "template_mask": [
         | 
| 217 | 
            +
                          "num templates placeholder"
         | 
| 218 | 
            +
                        ],
         | 
| 219 | 
            +
                        "template_pseudo_beta": [
         | 
| 220 | 
            +
                          "num templates placeholder",
         | 
| 221 | 
            +
                          "num residues placeholder",
         | 
| 222 | 
            +
                          null
         | 
| 223 | 
            +
                        ],
         | 
| 224 | 
            +
                        "template_pseudo_beta_mask": [
         | 
| 225 | 
            +
                          "num templates placeholder",
         | 
| 226 | 
            +
                          "num residues placeholder"
         | 
| 227 | 
            +
                        ],
         | 
| 228 | 
            +
                        "template_sum_probs": [
         | 
| 229 | 
            +
                          "num templates placeholder",
         | 
| 230 | 
            +
                          null
         | 
| 231 | 
            +
                        ],
         | 
| 232 | 
            +
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         | 
| 233 | 
            +
                          "num templates placeholder",
         | 
| 234 | 
            +
                          "num residues placeholder",
         | 
| 235 | 
            +
                          null
         | 
| 236 | 
            +
                        ],
         | 
| 237 | 
            +
                        "template_torsion_angles_sin_cos": [
         | 
| 238 | 
            +
                          "num templates placeholder",
         | 
| 239 | 
            +
                          "num residues placeholder",
         | 
| 240 | 
            +
                          null,
         | 
| 241 | 
            +
                          null
         | 
| 242 | 
            +
                        ],
         | 
| 243 | 
            +
                        "true_msa": [
         | 
| 244 | 
            +
                          "msa placeholder",
         | 
| 245 | 
            +
                          "num residues placeholder"
         | 
| 246 | 
            +
                        ],
         | 
| 247 | 
            +
                        "use_clamped_fape": []
         | 
| 248 | 
            +
                      },
         | 
| 249 | 
            +
                      "max_extra_msa": {
         | 
| 250 | 
            +
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         | 
| 251 | 
            +
                        "finetune": 5120,
         | 
| 252 | 
            +
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         | 
| 253 | 
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         | 
| 254 | 
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                      },
         | 
| 255 | 
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                      "max_msa_clusters": {
         | 
| 256 | 
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         | 
| 257 | 
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         | 
| 258 | 
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         | 
| 259 | 
            +
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         | 
| 260 | 
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                      },
         | 
| 261 | 
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         | 
| 262 | 
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         | 
| 263 | 
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         | 
| 264 | 
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                      "resample_msa_in_recycling": true,
         | 
| 265 | 
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                      "subsample_templates": {
         | 
| 266 | 
            +
                        "eval": false,
         | 
| 267 | 
            +
                        "finetune": true,
         | 
| 268 | 
            +
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         | 
| 269 | 
            +
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         | 
| 270 | 
            +
                      },
         | 
| 271 | 
            +
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         | 
| 272 | 
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         | 
| 273 | 
            +
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         | 
| 274 | 
            +
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         | 
| 275 | 
            +
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         | 
| 276 | 
            +
                      },
         | 
| 277 | 
            +
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         | 
| 278 | 
            +
                        "all_atom_mask",
         | 
| 279 | 
            +
                        "all_atom_positions",
         | 
| 280 | 
            +
                        "resolution",
         | 
| 281 | 
            +
                        "use_clamped_fape",
         | 
| 282 | 
            +
                        "is_distillation"
         | 
| 283 | 
            +
                      ],
         | 
| 284 | 
            +
                      "template_features": [
         | 
| 285 | 
            +
                        "template_all_atom_positions",
         | 
| 286 | 
            +
                        "template_sum_probs",
         | 
| 287 | 
            +
                        "template_aatype",
         | 
| 288 | 
            +
                        "template_all_atom_mask"
         | 
| 289 | 
            +
                      ],
         | 
| 290 | 
            +
                      "uniform_recycling": {
         | 
| 291 | 
            +
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         | 
| 292 | 
            +
                        "finetune": true,
         | 
| 293 | 
            +
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         | 
| 294 | 
            +
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         | 
| 295 | 
            +
                      },
         | 
| 296 | 
            +
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         | 
| 297 | 
            +
                        "aatype",
         | 
| 298 | 
            +
                        "residue_index",
         | 
| 299 | 
            +
                        "msa",
         | 
| 300 | 
            +
                        "num_alignments",
         | 
| 301 | 
            +
                        "seq_length",
         | 
| 302 | 
            +
                        "between_segment_residues",
         | 
| 303 | 
            +
                        "deletion_matrix",
         | 
| 304 | 
            +
                        "no_recycling_iters"
         | 
| 305 | 
            +
                      ]
         | 
| 306 | 
            +
                    },
         | 
| 307 | 
            +
                    "make_masked_msa": {
         | 
| 308 | 
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                      "profile_prob": 0.1,
         | 
| 309 | 
            +
                      "replace_fraction": 0.15,
         | 
| 310 | 
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         | 
| 311 | 
            +
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         | 
| 312 | 
            +
                    },
         | 
| 313 | 
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         | 
| 314 | 
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                      "max_relative_feature": 32
         | 
| 315 | 
            +
                    },
         | 
| 316 | 
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                    "nearest_neighbor_clusters": {
         | 
| 317 | 
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                      "gap_agreement_weight": 0.0
         | 
| 318 | 
            +
                    },
         | 
| 319 | 
            +
                    "randomly_replace_msa_with_unknown": {
         | 
| 320 | 
            +
                      "replace_proportion": 0.0
         | 
| 321 | 
            +
                    },
         | 
| 322 | 
            +
                    "sample_msa": {
         | 
| 323 | 
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                      "reduce_msa_clusters_by_max_templates": false
         | 
| 324 | 
            +
                    }
         | 
| 325 | 
            +
                  }
         | 
| 326 | 
            +
                },
         | 
| 327 | 
            +
                "globals": {
         | 
| 328 | 
            +
                  "is_multimer": false,
         | 
| 329 | 
            +
                  "mode": "predict",
         | 
| 330 | 
            +
                  "num_recycles": 3,
         | 
| 331 | 
            +
                  "recycle_early_stop_tolerance": 0.5,
         | 
| 332 | 
            +
                  "use_templates": false
         | 
| 333 | 
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                },
         | 
| 334 | 
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                "model": {
         | 
| 335 | 
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                  "auxiliary_heads": {
         | 
| 336 | 
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         | 
| 337 | 
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         | 
| 338 | 
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         | 
| 339 | 
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         | 
| 340 | 
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         | 
| 341 | 
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         | 
| 342 | 
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         | 
| 343 | 
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                    "predicted_lddt_head_c_hidden": 128,
         | 
| 344 | 
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                    "predicted_lddt_head_num_bins": 50,
         | 
| 345 | 
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         | 
| 346 | 
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                  },
         | 
| 347 | 
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         | 
| 348 | 
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         | 
| 349 | 
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         | 
| 350 | 
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                    "c_h_u": 128,
         | 
| 351 | 
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                    "c_h_z": 32,
         | 
| 352 | 
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         | 
| 353 | 
            +
                    "c_s": 384,
         | 
| 354 | 
            +
                    "c_z": 128,
         | 
| 355 | 
            +
                    "fused": false,
         | 
| 356 | 
            +
                    "h_m": 8,
         | 
| 357 | 
            +
                    "h_z": 4,
         | 
| 358 | 
            +
                    "msa_global_col_attention": false,
         | 
| 359 | 
            +
                    "n_trans": 4,
         | 
| 360 | 
            +
                    "num_blocks": 48,
         | 
| 361 | 
            +
                    "opm_first": false,
         | 
| 362 | 
            +
                    "ouput_single": true
         | 
| 363 | 
            +
                  },
         | 
| 364 | 
            +
                  "extra_msa_stack": {
         | 
| 365 | 
            +
                    "c_h_m": 8,
         | 
| 366 | 
            +
                    "c_h_opm": 32,
         | 
| 367 | 
            +
                    "c_h_u": 128,
         | 
| 368 | 
            +
                    "c_h_z": 32,
         | 
| 369 | 
            +
                    "c_m": 64,
         | 
| 370 | 
            +
                    "c_z": 128,
         | 
| 371 | 
            +
                    "fused": false,
         | 
| 372 | 
            +
                    "h_m": 8,
         | 
| 373 | 
            +
                    "h_z": 4,
         | 
| 374 | 
            +
                    "msa_global_col_attention": true,
         | 
| 375 | 
            +
                    "n_trans": 4,
         | 
| 376 | 
            +
                    "num_blocks": 4,
         | 
| 377 | 
            +
                    "opm_first": false
         | 
| 378 | 
            +
                  },
         | 
| 379 | 
            +
                  "feature_embedder": {
         | 
| 380 | 
            +
                    "c_e": 64,
         | 
| 381 | 
            +
                    "c_m": 256,
         | 
| 382 | 
            +
                    "c_t": 64,
         | 
| 383 | 
            +
                    "c_taf": 57,
         | 
| 384 | 
            +
                    "c_tpf": 88,
         | 
| 385 | 
            +
                    "c_z": 128,
         | 
| 386 | 
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                    "extra_msa_dim": 25,
         | 
| 387 | 
            +
                    "max_relative_feature": 32,
         | 
| 388 | 
            +
                    "msa_dim": 49,
         | 
| 389 | 
            +
                    "num_bins": 15,
         | 
| 390 | 
            +
                    "tf_dim": 22
         | 
| 391 | 
            +
                  },
         | 
| 392 | 
            +
                  "loss": {
         | 
| 393 | 
            +
                    "distogram_loss": {
         | 
| 394 | 
            +
                      "eps": 1e-06,
         | 
| 395 | 
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                      "max_bin": 21.6875,
         | 
| 396 | 
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                      "min_bin": 2.3125,
         | 
| 397 | 
            +
                      "no_bins": 64,
         | 
| 398 | 
            +
                      "weight": 0.3
         | 
| 399 | 
            +
                    },
         | 
| 400 | 
            +
                    "experimentally_resolved_loss": {
         | 
| 401 | 
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                      "eps": 1e-08,
         | 
| 402 | 
            +
                      "max_resolution": 3.0,
         | 
| 403 | 
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                      "min_resolution": 0.1,
         | 
| 404 | 
            +
                      "weight": 0.0
         | 
| 405 | 
            +
                    },
         | 
| 406 | 
            +
                    "fape_loss": {
         | 
| 407 | 
            +
                      "backbone": {
         | 
| 408 | 
            +
                        "clamp_distance": 10.0,
         | 
| 409 | 
            +
                        "loss_unit_distance": 10.0,
         | 
| 410 | 
            +
                        "weight": 0.5
         | 
| 411 | 
            +
                      },
         | 
| 412 | 
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                      "eps": 0.0001,
         | 
| 413 | 
            +
                      "sidechain": {
         | 
| 414 | 
            +
                        "clamp_distance": 10.0,
         | 
| 415 | 
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                        "length_scale": 10.0,
         | 
| 416 | 
            +
                        "weight": 0.5
         | 
| 417 | 
            +
                      },
         | 
| 418 | 
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                      "weight": 1.0
         | 
| 419 | 
            +
                    },
         | 
| 420 | 
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                    "masked_msa_loss": {
         | 
| 421 | 
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                      "eps": 1e-08,
         | 
| 422 | 
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                      "weight": 2.0
         | 
| 423 | 
            +
                    },
         | 
| 424 | 
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                    "predicted_lddt_loss": {
         | 
| 425 | 
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                      "cutoff": 15.0,
         | 
| 426 | 
            +
                      "eps": 1e-10,
         | 
| 427 | 
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                      "max_resolution": 3.0,
         | 
| 428 | 
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                      "min_resolution": 0.1,
         | 
| 429 | 
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                      "no_bins": 50,
         | 
| 430 | 
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                      "weight": 0.01
         | 
| 431 | 
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                    },
         | 
| 432 | 
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                    "predicted_tm_loss": {
         | 
| 433 | 
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                      "eps": 1e-08,
         | 
| 434 | 
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                      "max_bin": 31,
         | 
| 435 | 
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                      "max_resolution": 3.0,
         | 
| 436 | 
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                      "min_resolution": 0.1,
         | 
| 437 | 
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                      "no_bins": 64,
         | 
| 438 | 
            +
                      "weight": 0.1
         | 
| 439 | 
            +
                    },
         | 
| 440 | 
            +
                    "supervised_chi_loss": {
         | 
| 441 | 
            +
                      "angle_norm_weight": 0.01,
         | 
| 442 | 
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                      "chi_weight": 0.5,
         | 
| 443 | 
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                      "eps": 1e-06,
         | 
| 444 | 
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                      "weight": 1.0
         | 
| 445 | 
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                    },
         | 
| 446 | 
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                    "violation_loss": {
         | 
| 447 | 
            +
                      "clash_overlap_tolerance": 1.5,
         | 
| 448 | 
            +
                      "eps": 1e-06,
         | 
| 449 | 
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                      "violation_tolerance_factor": 12.0,
         | 
| 450 | 
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                      "weight": 0.0
         | 
| 451 | 
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                    }
         | 
| 452 | 
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                  },
         | 
| 453 | 
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                  "structure_module": {
         | 
| 454 | 
            +
                    "c_s": 384,
         | 
| 455 | 
            +
                    "c_sc": 128,
         | 
| 456 | 
            +
                    "c_z": 128,
         | 
| 457 | 
            +
                    "dropout": 0.1,
         | 
| 458 | 
            +
                    "ipa_scalar_bias": true,
         | 
| 459 | 
            +
                    "no_angles": 7,
         | 
| 460 | 
            +
                    "num_head": 12,
         | 
| 461 | 
            +
                    "num_layer": 8,
         | 
| 462 | 
            +
                    "num_point_qk": 4,
         | 
| 463 | 
            +
                    "num_point_v": 8,
         | 
| 464 | 
            +
                    "num_scalar_qk": 16,
         | 
| 465 | 
            +
                    "num_scalar_v": 16,
         | 
| 466 | 
            +
                    "position_scale": 10.0,
         | 
| 467 | 
            +
                    "separate_kv": false
         | 
| 468 | 
            +
                  },
         | 
| 469 | 
            +
                  "template_pair_stack": {
         | 
| 470 | 
            +
                    "attention_first": true,
         | 
| 471 | 
            +
                    "c_h_t": 16,
         | 
| 472 | 
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                    "c_h_u": 64,
         | 
| 473 | 
            +
                    "c_t": 64,
         | 
| 474 | 
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                    "c_z": 128,
         | 
| 475 | 
            +
                    "fused": false,
         | 
| 476 | 
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                    "h_t": 4,
         | 
| 477 | 
            +
                    "n_trans": 2,
         | 
| 478 | 
            +
                    "num_blocks": 2
         | 
| 479 | 
            +
                  }
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    | @@ -0,0 +1,3 @@ | |
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        model_3_multimer/config.json
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    | @@ -0,0 +1,945 @@ | |
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| 1 | 
            +
            {
         | 
| 2 | 
            +
              "CONFIG": {
         | 
| 3 | 
            +
                "data": {
         | 
| 4 | 
            +
                  "transform": {
         | 
| 5 | 
            +
                    "common": {
         | 
| 6 | 
            +
                      "crop_size": {
         | 
| 7 | 
            +
                        "eval": null,
         | 
| 8 | 
            +
                        "finetune": 384,
         | 
| 9 | 
            +
                        "predict": null,
         | 
| 10 | 
            +
                        "train": 256
         | 
| 11 | 
            +
                      },
         | 
| 12 | 
            +
                      "feats": {
         | 
| 13 | 
            +
                        "aatype": [
         | 
| 14 | 
            +
                          "num residues placeholder"
         | 
| 15 | 
            +
                        ],
         | 
| 16 | 
            +
                        "all_atom_mask": [
         | 
| 17 | 
            +
                          "num residues placeholder",
         | 
| 18 | 
            +
                          null
         | 
| 19 | 
            +
                        ],
         | 
| 20 | 
            +
                        "all_atom_positions": [
         | 
| 21 | 
            +
                          "num residues placeholder",
         | 
| 22 | 
            +
                          null,
         | 
| 23 | 
            +
                          null
         | 
| 24 | 
            +
                        ],
         | 
| 25 | 
            +
                        "alt_chi_angles": [
         | 
| 26 | 
            +
                          "num residues placeholder",
         | 
| 27 | 
            +
                          null
         | 
| 28 | 
            +
                        ],
         | 
| 29 | 
            +
                        "assembly_num_chains": [
         | 
| 30 | 
            +
                          null
         | 
| 31 | 
            +
                        ],
         | 
| 32 | 
            +
                        "asym_id": [
         | 
| 33 | 
            +
                          "num residues placeholder"
         | 
| 34 | 
            +
                        ],
         | 
| 35 | 
            +
                        "asym_len": [
         | 
| 36 | 
            +
                          null
         | 
| 37 | 
            +
                        ],
         | 
| 38 | 
            +
                        "atom14_alt_gt_exists": [
         | 
| 39 | 
            +
                          "num residues placeholder",
         | 
| 40 | 
            +
                          null
         | 
| 41 | 
            +
                        ],
         | 
| 42 | 
            +
                        "atom14_alt_gt_positions": [
         | 
| 43 | 
            +
                          "num residues placeholder",
         | 
| 44 | 
            +
                          null,
         | 
| 45 | 
            +
                          null
         | 
| 46 | 
            +
                        ],
         | 
| 47 | 
            +
                        "atom14_atom_exists": [
         | 
| 48 | 
            +
                          "num residues placeholder",
         | 
| 49 | 
            +
                          null
         | 
| 50 | 
            +
                        ],
         | 
| 51 | 
            +
                        "atom14_atom_is_ambiguous": [
         | 
| 52 | 
            +
                          "num residues placeholder",
         | 
| 53 | 
            +
                          null
         | 
| 54 | 
            +
                        ],
         | 
| 55 | 
            +
                        "atom14_gt_exists": [
         | 
| 56 | 
            +
                          "num residues placeholder",
         | 
| 57 | 
            +
                          null
         | 
| 58 | 
            +
                        ],
         | 
| 59 | 
            +
                        "atom14_gt_positions": [
         | 
| 60 | 
            +
                          "num residues placeholder",
         | 
| 61 | 
            +
                          null,
         | 
| 62 | 
            +
                          null
         | 
| 63 | 
            +
                        ],
         | 
| 64 | 
            +
                        "atom37_atom_exists": [
         | 
| 65 | 
            +
                          "num residues placeholder",
         | 
| 66 | 
            +
                          null
         | 
| 67 | 
            +
                        ],
         | 
| 68 | 
            +
                        "backbone_rigid_mask": [
         | 
| 69 | 
            +
                          "num residues placeholder"
         | 
| 70 | 
            +
                        ],
         | 
| 71 | 
            +
                        "backbone_rigid_tensor": [
         | 
| 72 | 
            +
                          "num residues placeholder",
         | 
| 73 | 
            +
                          null,
         | 
| 74 | 
            +
                          null
         | 
| 75 | 
            +
                        ],
         | 
| 76 | 
            +
                        "bert_mask": [
         | 
| 77 | 
            +
                          "msa placeholder",
         | 
| 78 | 
            +
                          "num residues placeholder"
         | 
| 79 | 
            +
                        ],
         | 
| 80 | 
            +
                        "chi_angles_sin_cos": [
         | 
| 81 | 
            +
                          "num residues placeholder",
         | 
| 82 | 
            +
                          null,
         | 
| 83 | 
            +
                          null
         | 
| 84 | 
            +
                        ],
         | 
| 85 | 
            +
                        "chi_mask": [
         | 
| 86 | 
            +
                          "num residues placeholder",
         | 
| 87 | 
            +
                          null
         | 
| 88 | 
            +
                        ],
         | 
| 89 | 
            +
                        "cluster_bias_mask": [
         | 
| 90 | 
            +
                          "msa placeholder"
         | 
| 91 | 
            +
                        ],
         | 
| 92 | 
            +
                        "entity_id": [
         | 
| 93 | 
            +
                          "num residues placeholder"
         | 
| 94 | 
            +
                        ],
         | 
| 95 | 
            +
                        "extra_deletion_value": [
         | 
| 96 | 
            +
                          "extra msa placeholder",
         | 
| 97 | 
            +
                          "num residues placeholder"
         | 
| 98 | 
            +
                        ],
         | 
| 99 | 
            +
                        "extra_has_deletion": [
         | 
| 100 | 
            +
                          "extra msa placeholder",
         | 
| 101 | 
            +
                          "num residues placeholder"
         | 
| 102 | 
            +
                        ],
         | 
| 103 | 
            +
                        "extra_msa": [
         | 
| 104 | 
            +
                          "extra msa placeholder",
         | 
| 105 | 
            +
                          "num residues placeholder"
         | 
| 106 | 
            +
                        ],
         | 
| 107 | 
            +
                        "extra_msa_mask": [
         | 
| 108 | 
            +
                          "extra msa placeholder",
         | 
| 109 | 
            +
                          "num residues placeholder"
         | 
| 110 | 
            +
                        ],
         | 
| 111 | 
            +
                        "extra_msa_row_mask": [
         | 
| 112 | 
            +
                          "extra msa placeholder"
         | 
| 113 | 
            +
                        ],
         | 
| 114 | 
            +
                        "is_distillation": [],
         | 
| 115 | 
            +
                        "msa_feat": [
         | 
| 116 | 
            +
                          "msa placeholder",
         | 
| 117 | 
            +
                          "num residues placeholder",
         | 
| 118 | 
            +
                          null
         | 
| 119 | 
            +
                        ],
         | 
| 120 | 
            +
                        "msa_mask": [
         | 
| 121 | 
            +
                          "msa placeholder",
         | 
| 122 | 
            +
                          "num residues placeholder"
         | 
| 123 | 
            +
                        ],
         | 
| 124 | 
            +
                        "msa_row_mask": [
         | 
| 125 | 
            +
                          "msa placeholder"
         | 
| 126 | 
            +
                        ],
         | 
| 127 | 
            +
                        "no_recycling_iters": [],
         | 
| 128 | 
            +
                        "num_sym": [
         | 
| 129 | 
            +
                          "num residues placeholder"
         | 
| 130 | 
            +
                        ],
         | 
| 131 | 
            +
                        "pseudo_beta": [
         | 
| 132 | 
            +
                          "num residues placeholder",
         | 
| 133 | 
            +
                          null
         | 
| 134 | 
            +
                        ],
         | 
| 135 | 
            +
                        "pseudo_beta_mask": [
         | 
| 136 | 
            +
                          "num residues placeholder"
         | 
| 137 | 
            +
                        ],
         | 
| 138 | 
            +
                        "residue_index": [
         | 
| 139 | 
            +
                          "num residues placeholder"
         | 
| 140 | 
            +
                        ],
         | 
| 141 | 
            +
                        "residx_atom14_to_atom37": [
         | 
| 142 | 
            +
                          "num residues placeholder",
         | 
| 143 | 
            +
                          null
         | 
| 144 | 
            +
                        ],
         | 
| 145 | 
            +
                        "residx_atom37_to_atom14": [
         | 
| 146 | 
            +
                          "num residues placeholder",
         | 
| 147 | 
            +
                          null
         | 
| 148 | 
            +
                        ],
         | 
| 149 | 
            +
                        "resolution": [],
         | 
| 150 | 
            +
                        "rigidgroups_alt_gt_frames": [
         | 
| 151 | 
            +
                          "num residues placeholder",
         | 
| 152 | 
            +
                          null,
         | 
| 153 | 
            +
                          null,
         | 
| 154 | 
            +
                          null
         | 
| 155 | 
            +
                        ],
         | 
| 156 | 
            +
                        "rigidgroups_group_exists": [
         | 
| 157 | 
            +
                          "num residues placeholder",
         | 
| 158 | 
            +
                          null
         | 
| 159 | 
            +
                        ],
         | 
| 160 | 
            +
                        "rigidgroups_group_is_ambiguous": [
         | 
| 161 | 
            +
                          "num residues placeholder",
         | 
| 162 | 
            +
                          null
         | 
| 163 | 
            +
                        ],
         | 
| 164 | 
            +
                        "rigidgroups_gt_exists": [
         | 
| 165 | 
            +
                          "num residues placeholder",
         | 
| 166 | 
            +
                          null
         | 
| 167 | 
            +
                        ],
         | 
| 168 | 
            +
                        "rigidgroups_gt_frames": [
         | 
| 169 | 
            +
                          "num residues placeholder",
         | 
| 170 | 
            +
                          null,
         | 
| 171 | 
            +
                          null,
         | 
| 172 | 
            +
                          null
         | 
| 173 | 
            +
                        ],
         | 
| 174 | 
            +
                        "seq_length": [],
         | 
| 175 | 
            +
                        "seq_mask": [
         | 
| 176 | 
            +
                          "num residues placeholder"
         | 
| 177 | 
            +
                        ],
         | 
| 178 | 
            +
                        "sym_id": [
         | 
| 179 | 
            +
                          "num residues placeholder"
         | 
| 180 | 
            +
                        ],
         | 
| 181 | 
            +
                        "target_feat": [
         | 
| 182 | 
            +
                          "num residues placeholder",
         | 
| 183 | 
            +
                          null
         | 
| 184 | 
            +
                        ],
         | 
| 185 | 
            +
                        "template_aatype": [
         | 
| 186 | 
            +
                          "num templates placeholder",
         | 
| 187 | 
            +
                          "num residues placeholder"
         | 
| 188 | 
            +
                        ],
         | 
| 189 | 
            +
                        "template_all_atom_mask": [
         | 
| 190 | 
            +
                          "num templates placeholder",
         | 
| 191 | 
            +
                          "num residues placeholder",
         | 
| 192 | 
            +
                          null
         | 
| 193 | 
            +
                        ],
         | 
| 194 | 
            +
                        "template_all_atom_positions": [
         | 
| 195 | 
            +
                          "num templates placeholder",
         | 
| 196 | 
            +
                          "num residues placeholder",
         | 
| 197 | 
            +
                          null,
         | 
| 198 | 
            +
                          null
         | 
| 199 | 
            +
                        ],
         | 
| 200 | 
            +
                        "template_alt_torsion_angles_sin_cos": [
         | 
| 201 | 
            +
                          "num templates placeholder",
         | 
| 202 | 
            +
                          "num residues placeholder",
         | 
| 203 | 
            +
                          null,
         | 
| 204 | 
            +
                          null
         | 
| 205 | 
            +
                        ],
         | 
| 206 | 
            +
                        "template_backbone_rigid_mask": [
         | 
| 207 | 
            +
                          "num templates placeholder",
         | 
| 208 | 
            +
                          "num residues placeholder"
         | 
| 209 | 
            +
                        ],
         | 
| 210 | 
            +
                        "template_backbone_rigid_tensor": [
         | 
| 211 | 
            +
                          "num templates placeholder",
         | 
| 212 | 
            +
                          "num residues placeholder",
         | 
| 213 | 
            +
                          null,
         | 
| 214 | 
            +
                          null
         | 
| 215 | 
            +
                        ],
         | 
| 216 | 
            +
                        "template_mask": [
         | 
| 217 | 
            +
                          "num templates placeholder"
         | 
| 218 | 
            +
                        ],
         | 
| 219 | 
            +
                        "template_pseudo_beta": [
         | 
| 220 | 
            +
                          "num templates placeholder",
         | 
| 221 | 
            +
                          "num residues placeholder",
         | 
| 222 | 
            +
                          null
         | 
| 223 | 
            +
                        ],
         | 
| 224 | 
            +
                        "template_pseudo_beta_mask": [
         | 
| 225 | 
            +
                          "num templates placeholder",
         | 
| 226 | 
            +
                          "num residues placeholder"
         | 
| 227 | 
            +
                        ],
         | 
| 228 | 
            +
                        "template_sum_probs": [
         | 
| 229 | 
            +
                          "num templates placeholder",
         | 
| 230 | 
            +
                          null
         | 
| 231 | 
            +
                        ],
         | 
| 232 | 
            +
                        "template_torsion_angles_mask": [
         | 
| 233 | 
            +
                          "num templates placeholder",
         | 
| 234 | 
            +
                          "num residues placeholder",
         | 
| 235 | 
            +
                          null
         | 
| 236 | 
            +
                        ],
         | 
| 237 | 
            +
                        "template_torsion_angles_sin_cos": [
         | 
| 238 | 
            +
                          "num templates placeholder",
         | 
| 239 | 
            +
                          "num residues placeholder",
         | 
| 240 | 
            +
                          null,
         | 
| 241 | 
            +
                          null
         | 
| 242 | 
            +
                        ],
         | 
| 243 | 
            +
                        "true_msa": [
         | 
| 244 | 
            +
                          "msa placeholder",
         | 
| 245 | 
            +
                          "num residues placeholder"
         | 
| 246 | 
            +
                        ],
         | 
| 247 | 
            +
                        "use_clamped_fape": []
         | 
| 248 | 
            +
                      },
         | 
| 249 | 
            +
                      "max_extra_msa": {
         | 
| 250 | 
            +
                        "eval": 512,
         | 
| 251 | 
            +
                        "finetune": 5120,
         | 
| 252 | 
            +
                        "predict": 1024,
         | 
| 253 | 
            +
                        "train": 1024
         | 
| 254 | 
            +
                      },
         | 
| 255 | 
            +
                      "max_msa_clusters": {
         | 
| 256 | 
            +
                        "eval": 128,
         | 
| 257 | 
            +
                        "finetune": 512,
         | 
| 258 | 
            +
                        "predict": 512,
         | 
| 259 | 
            +
                        "train": 128
         | 
| 260 | 
            +
                      },
         | 
| 261 | 
            +
                      "max_templates": 4,
         | 
| 262 | 
            +
                      "no_recycling_iters": 3,
         | 
| 263 | 
            +
                      "reduce_msa_clusters_by_max_templates": false,
         | 
| 264 | 
            +
                      "resample_msa_in_recycling": true,
         | 
| 265 | 
            +
                      "subsample_templates": {
         | 
| 266 | 
            +
                        "eval": false,
         | 
| 267 | 
            +
                        "finetune": true,
         | 
| 268 | 
            +
                        "predict": false,
         | 
| 269 | 
            +
                        "train": true
         | 
| 270 | 
            +
                      },
         | 
| 271 | 
            +
                      "supervised": {
         | 
| 272 | 
            +
                        "eval": true,
         | 
| 273 | 
            +
                        "finetune": true,
         | 
| 274 | 
            +
                        "predict": false,
         | 
| 275 | 
            +
                        "train": true
         | 
| 276 | 
            +
                      },
         | 
| 277 | 
            +
                      "supervised_features": [
         | 
| 278 | 
            +
                        "all_atom_mask",
         | 
| 279 | 
            +
                        "all_atom_positions",
         | 
| 280 | 
            +
                        "resolution",
         | 
| 281 | 
            +
                        "use_clamped_fape",
         | 
| 282 | 
            +
                        "is_distillation"
         | 
| 283 | 
            +
                      ],
         | 
| 284 | 
            +
                      "template_features": [
         | 
| 285 | 
            +
                        "template_all_atom_positions",
         | 
| 286 | 
            +
                        "template_sum_probs",
         | 
| 287 | 
            +
                        "template_aatype",
         | 
| 288 | 
            +
                        "template_all_atom_mask"
         | 
| 289 | 
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| 291 | 
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| 295 | 
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| 296 | 
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| 297 | 
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| 298 | 
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| 299 | 
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| 300 | 
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| 301 | 
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| 302 | 
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| 303 | 
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| 304 | 
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| 305 | 
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| 306 | 
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| 307 | 
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| 480 | 
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| 481 | 
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                  "model.evoformer_stack.opm_first": true,
         | 
| 923 | 
            +
                  "model.extra_msa_stack.fused": true,
         | 
| 924 | 
            +
                  "model.extra_msa_stack.opm_first": true,
         | 
| 925 | 
            +
                  "model.feature_embedder.c_taf": 34,
         | 
| 926 | 
            +
                  "model.feature_embedder.tf_dim": 21,
         | 
| 927 | 
            +
                  "model.structure_module.ipa_scalar_bias": false,
         | 
| 928 | 
            +
                  "model.structure_module.position_scale": 20,
         | 
| 929 | 
            +
                  "model.structure_module.separate_kv": true,
         | 
| 930 | 
            +
                  "model.template_pair_stack.attention_first": false
         | 
| 931 | 
            +
                },
         | 
| 932 | 
            +
                "model_5_ptm": {
         | 
| 933 | 
            +
                  "model.auxiliary_heads.tm_enabled": true
         | 
| 934 | 
            +
                }
         | 
| 935 | 
            +
              },
         | 
| 936 | 
            +
              "_config": null,
         | 
| 937 | 
            +
              "architectures": [
         | 
| 938 | 
            +
                "STFold"
         | 
| 939 | 
            +
              ],
         | 
| 940 | 
            +
              "mode": "predict",
         | 
| 941 | 
            +
              "model_type": "STFold",
         | 
| 942 | 
            +
              "stfold_type": "model_3_multimer",
         | 
| 943 | 
            +
              "torch_dtype": "float32",
         | 
| 944 | 
            +
              "transformers_version": "4.31.0.dev0"
         | 
| 945 | 
            +
            }
         | 
    	
        model_3_multimer/pytorch_model.bin
    ADDED
    
    | @@ -0,0 +1,3 @@ | |
|  | |
|  | |
|  | 
|  | |
| 1 | 
            +
            version https://git-lfs.github.com/spec/v1
         | 
| 2 | 
            +
            oid sha256:8a9f0525fa91235bb5482fb0e2aba5ea4659cd641ebb29ed3a74c02ab5163709
         | 
| 3 | 
            +
            size 374735391
         | 
    	
        model_4_multimer/config.json
    ADDED
    
    | @@ -0,0 +1,945 @@ | |
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|  | 
|  | |
| 1 | 
            +
            {
         | 
| 2 | 
            +
              "CONFIG": {
         | 
| 3 | 
            +
                "data": {
         | 
| 4 | 
            +
                  "transform": {
         | 
| 5 | 
            +
                    "common": {
         | 
| 6 | 
            +
                      "crop_size": {
         | 
| 7 | 
            +
                        "eval": null,
         | 
| 8 | 
            +
                        "finetune": 384,
         | 
| 9 | 
            +
                        "predict": null,
         | 
| 10 | 
            +
                        "train": 256
         | 
| 11 | 
            +
                      },
         | 
| 12 | 
            +
                      "feats": {
         | 
| 13 | 
            +
                        "aatype": [
         | 
| 14 | 
            +
                          "num residues placeholder"
         | 
| 15 | 
            +
                        ],
         | 
| 16 | 
            +
                        "all_atom_mask": [
         | 
| 17 | 
            +
                          "num residues placeholder",
         | 
| 18 | 
            +
                          null
         | 
| 19 | 
            +
                        ],
         | 
| 20 | 
            +
                        "all_atom_positions": [
         | 
| 21 | 
            +
                          "num residues placeholder",
         | 
| 22 | 
            +
                          null,
         | 
| 23 | 
            +
                          null
         | 
| 24 | 
            +
                        ],
         | 
| 25 | 
            +
                        "alt_chi_angles": [
         | 
| 26 | 
            +
                          "num residues placeholder",
         | 
| 27 | 
            +
                          null
         | 
| 28 | 
            +
                        ],
         | 
| 29 | 
            +
                        "assembly_num_chains": [
         | 
| 30 | 
            +
                          null
         | 
| 31 | 
            +
                        ],
         | 
| 32 | 
            +
                        "asym_id": [
         | 
| 33 | 
            +
                          "num residues placeholder"
         | 
| 34 | 
            +
                        ],
         | 
| 35 | 
            +
                        "asym_len": [
         | 
| 36 | 
            +
                          null
         | 
| 37 | 
            +
                        ],
         | 
| 38 | 
            +
                        "atom14_alt_gt_exists": [
         | 
| 39 | 
            +
                          "num residues placeholder",
         | 
| 40 | 
            +
                          null
         | 
| 41 | 
            +
                        ],
         | 
| 42 | 
            +
                        "atom14_alt_gt_positions": [
         | 
| 43 | 
            +
                          "num residues placeholder",
         | 
| 44 | 
            +
                          null,
         | 
| 45 | 
            +
                          null
         | 
| 46 | 
            +
                        ],
         | 
| 47 | 
            +
                        "atom14_atom_exists": [
         | 
| 48 | 
            +
                          "num residues placeholder",
         | 
| 49 | 
            +
                          null
         | 
| 50 | 
            +
                        ],
         | 
| 51 | 
            +
                        "atom14_atom_is_ambiguous": [
         | 
| 52 | 
            +
                          "num residues placeholder",
         | 
| 53 | 
            +
                          null
         | 
| 54 | 
            +
                        ],
         | 
| 55 | 
            +
                        "atom14_gt_exists": [
         | 
| 56 | 
            +
                          "num residues placeholder",
         | 
| 57 | 
            +
                          null
         | 
| 58 | 
            +
                        ],
         | 
| 59 | 
            +
                        "atom14_gt_positions": [
         | 
| 60 | 
            +
                          "num residues placeholder",
         | 
| 61 | 
            +
                          null,
         | 
| 62 | 
            +
                          null
         | 
| 63 | 
            +
                        ],
         | 
| 64 | 
            +
                        "atom37_atom_exists": [
         | 
| 65 | 
            +
                          "num residues placeholder",
         | 
| 66 | 
            +
                          null
         | 
| 67 | 
            +
                        ],
         | 
| 68 | 
            +
                        "backbone_rigid_mask": [
         | 
| 69 | 
            +
                          "num residues placeholder"
         | 
| 70 | 
            +
                        ],
         | 
| 71 | 
            +
                        "backbone_rigid_tensor": [
         | 
| 72 | 
            +
                          "num residues placeholder",
         | 
| 73 | 
            +
                          null,
         | 
| 74 | 
            +
                          null
         | 
| 75 | 
            +
                        ],
         | 
| 76 | 
            +
                        "bert_mask": [
         | 
| 77 | 
            +
                          "msa placeholder",
         | 
| 78 | 
            +
                          "num residues placeholder"
         | 
| 79 | 
            +
                        ],
         | 
| 80 | 
            +
                        "chi_angles_sin_cos": [
         | 
| 81 | 
            +
                          "num residues placeholder",
         | 
| 82 | 
            +
                          null,
         | 
| 83 | 
            +
                          null
         | 
| 84 | 
            +
                        ],
         | 
| 85 | 
            +
                        "chi_mask": [
         | 
| 86 | 
            +
                          "num residues placeholder",
         | 
| 87 | 
            +
                          null
         | 
| 88 | 
            +
                        ],
         | 
| 89 | 
            +
                        "cluster_bias_mask": [
         | 
| 90 | 
            +
                          "msa placeholder"
         | 
| 91 | 
            +
                        ],
         | 
| 92 | 
            +
                        "entity_id": [
         | 
| 93 | 
            +
                          "num residues placeholder"
         | 
| 94 | 
            +
                        ],
         | 
| 95 | 
            +
                        "extra_deletion_value": [
         | 
| 96 | 
            +
                          "extra msa placeholder",
         | 
| 97 | 
            +
                          "num residues placeholder"
         | 
| 98 | 
            +
                        ],
         | 
| 99 | 
            +
                        "extra_has_deletion": [
         | 
| 100 | 
            +
                          "extra msa placeholder",
         | 
| 101 | 
            +
                          "num residues placeholder"
         | 
| 102 | 
            +
                        ],
         | 
| 103 | 
            +
                        "extra_msa": [
         | 
| 104 | 
            +
                          "extra msa placeholder",
         | 
| 105 | 
            +
                          "num residues placeholder"
         | 
| 106 | 
            +
                        ],
         | 
| 107 | 
            +
                        "extra_msa_mask": [
         | 
| 108 | 
            +
                          "extra msa placeholder",
         | 
| 109 | 
            +
                          "num residues placeholder"
         | 
| 110 | 
            +
                        ],
         | 
| 111 | 
            +
                        "extra_msa_row_mask": [
         | 
| 112 | 
            +
                          "extra msa placeholder"
         | 
| 113 | 
            +
                        ],
         | 
| 114 | 
            +
                        "is_distillation": [],
         | 
| 115 | 
            +
                        "msa_feat": [
         | 
| 116 | 
            +
                          "msa placeholder",
         | 
| 117 | 
            +
                          "num residues placeholder",
         | 
| 118 | 
            +
                          null
         | 
| 119 | 
            +
                        ],
         | 
| 120 | 
            +
                        "msa_mask": [
         | 
| 121 | 
            +
                          "msa placeholder",
         | 
| 122 | 
            +
                          "num residues placeholder"
         | 
| 123 | 
            +
                        ],
         | 
| 124 | 
            +
                        "msa_row_mask": [
         | 
| 125 | 
            +
                          "msa placeholder"
         | 
| 126 | 
            +
                        ],
         | 
| 127 | 
            +
                        "no_recycling_iters": [],
         | 
| 128 | 
            +
                        "num_sym": [
         | 
| 129 | 
            +
                          "num residues placeholder"
         | 
| 130 | 
            +
                        ],
         | 
| 131 | 
            +
                        "pseudo_beta": [
         | 
| 132 | 
            +
                          "num residues placeholder",
         | 
| 133 | 
            +
                          null
         | 
| 134 | 
            +
                        ],
         | 
| 135 | 
            +
                        "pseudo_beta_mask": [
         | 
| 136 | 
            +
                          "num residues placeholder"
         | 
| 137 | 
            +
                        ],
         | 
| 138 | 
            +
                        "residue_index": [
         | 
| 139 | 
            +
                          "num residues placeholder"
         | 
| 140 | 
            +
                        ],
         | 
| 141 | 
            +
                        "residx_atom14_to_atom37": [
         | 
| 142 | 
            +
                          "num residues placeholder",
         | 
| 143 | 
            +
                          null
         | 
| 144 | 
            +
                        ],
         | 
| 145 | 
            +
                        "residx_atom37_to_atom14": [
         | 
| 146 | 
            +
                          "num residues placeholder",
         | 
| 147 | 
            +
                          null
         | 
| 148 | 
            +
                        ],
         | 
| 149 | 
            +
                        "resolution": [],
         | 
| 150 | 
            +
                        "rigidgroups_alt_gt_frames": [
         | 
| 151 | 
            +
                          "num residues placeholder",
         | 
| 152 | 
            +
                          null,
         | 
| 153 | 
            +
                          null,
         | 
| 154 | 
            +
                          null
         | 
| 155 | 
            +
                        ],
         | 
| 156 | 
            +
                        "rigidgroups_group_exists": [
         | 
| 157 | 
            +
                          "num residues placeholder",
         | 
| 158 | 
            +
                          null
         | 
| 159 | 
            +
                        ],
         | 
| 160 | 
            +
                        "rigidgroups_group_is_ambiguous": [
         | 
| 161 | 
            +
                          "num residues placeholder",
         | 
| 162 | 
            +
                          null
         | 
| 163 | 
            +
                        ],
         | 
| 164 | 
            +
                        "rigidgroups_gt_exists": [
         | 
| 165 | 
            +
                          "num residues placeholder",
         | 
| 166 | 
            +
                          null
         | 
| 167 | 
            +
                        ],
         | 
| 168 | 
            +
                        "rigidgroups_gt_frames": [
         | 
| 169 | 
            +
                          "num residues placeholder",
         | 
| 170 | 
            +
                          null,
         | 
| 171 | 
            +
                          null,
         | 
| 172 | 
            +
                          null
         | 
| 173 | 
            +
                        ],
         | 
| 174 | 
            +
                        "seq_length": [],
         | 
| 175 | 
            +
                        "seq_mask": [
         | 
| 176 | 
            +
                          "num residues placeholder"
         | 
| 177 | 
            +
                        ],
         | 
| 178 | 
            +
                        "sym_id": [
         | 
| 179 | 
            +
                          "num residues placeholder"
         | 
| 180 | 
            +
                        ],
         | 
| 181 | 
            +
                        "target_feat": [
         | 
| 182 | 
            +
                          "num residues placeholder",
         | 
| 183 | 
            +
                          null
         | 
| 184 | 
            +
                        ],
         | 
| 185 | 
            +
                        "template_aatype": [
         | 
| 186 | 
            +
                          "num templates placeholder",
         | 
| 187 | 
            +
                          "num residues placeholder"
         | 
| 188 | 
            +
                        ],
         | 
| 189 | 
            +
                        "template_all_atom_mask": [
         | 
| 190 | 
            +
                          "num templates placeholder",
         | 
| 191 | 
            +
                          "num residues placeholder",
         | 
| 192 | 
            +
                          null
         | 
| 193 | 
            +
                        ],
         | 
| 194 | 
            +
                        "template_all_atom_positions": [
         | 
| 195 | 
            +
                          "num templates placeholder",
         | 
| 196 | 
            +
                          "num residues placeholder",
         | 
| 197 | 
            +
                          null,
         | 
| 198 | 
            +
                          null
         | 
| 199 | 
            +
                        ],
         | 
| 200 | 
            +
                        "template_alt_torsion_angles_sin_cos": [
         | 
| 201 | 
            +
                          "num templates placeholder",
         | 
| 202 | 
            +
                          "num residues placeholder",
         | 
| 203 | 
            +
                          null,
         | 
| 204 | 
            +
                          null
         | 
| 205 | 
            +
                        ],
         | 
| 206 | 
            +
                        "template_backbone_rigid_mask": [
         | 
| 207 | 
            +
                          "num templates placeholder",
         | 
| 208 | 
            +
                          "num residues placeholder"
         | 
| 209 | 
            +
                        ],
         | 
| 210 | 
            +
                        "template_backbone_rigid_tensor": [
         | 
| 211 | 
            +
                          "num templates placeholder",
         | 
| 212 | 
            +
                          "num residues placeholder",
         | 
| 213 | 
            +
                          null,
         | 
| 214 | 
            +
                          null
         | 
| 215 | 
            +
                        ],
         | 
| 216 | 
            +
                        "template_mask": [
         | 
| 217 | 
            +
                          "num templates placeholder"
         | 
| 218 | 
            +
                        ],
         | 
| 219 | 
            +
                        "template_pseudo_beta": [
         | 
| 220 | 
            +
                          "num templates placeholder",
         | 
| 221 | 
            +
                          "num residues placeholder",
         | 
| 222 | 
            +
                          null
         | 
| 223 | 
            +
                        ],
         | 
| 224 | 
            +
                        "template_pseudo_beta_mask": [
         | 
| 225 | 
            +
                          "num templates placeholder",
         | 
| 226 | 
            +
                          "num residues placeholder"
         | 
| 227 | 
            +
                        ],
         | 
| 228 | 
            +
                        "template_sum_probs": [
         | 
| 229 | 
            +
                          "num templates placeholder",
         | 
| 230 | 
            +
                          null
         | 
| 231 | 
            +
                        ],
         | 
| 232 | 
            +
                        "template_torsion_angles_mask": [
         | 
| 233 | 
            +
                          "num templates placeholder",
         | 
| 234 | 
            +
                          "num residues placeholder",
         | 
| 235 | 
            +
                          null
         | 
| 236 | 
            +
                        ],
         | 
| 237 | 
            +
                        "template_torsion_angles_sin_cos": [
         | 
| 238 | 
            +
                          "num templates placeholder",
         | 
| 239 | 
            +
                          "num residues placeholder",
         | 
| 240 | 
            +
                          null,
         | 
| 241 | 
            +
                          null
         | 
| 242 | 
            +
                        ],
         | 
| 243 | 
            +
                        "true_msa": [
         | 
| 244 | 
            +
                          "msa placeholder",
         | 
| 245 | 
            +
                          "num residues placeholder"
         | 
| 246 | 
            +
                        ],
         | 
| 247 | 
            +
                        "use_clamped_fape": []
         | 
| 248 | 
            +
                      },
         | 
| 249 | 
            +
                      "max_extra_msa": {
         | 
| 250 | 
            +
                        "eval": 512,
         | 
| 251 | 
            +
                        "finetune": 5120,
         | 
| 252 | 
            +
                        "predict": 1024,
         | 
| 253 | 
            +
                        "train": 1024
         | 
| 254 | 
            +
                      },
         | 
| 255 | 
            +
                      "max_msa_clusters": {
         | 
| 256 | 
            +
                        "eval": 128,
         | 
| 257 | 
            +
                        "finetune": 512,
         | 
| 258 | 
            +
                        "predict": 512,
         | 
| 259 | 
            +
                        "train": 128
         | 
| 260 | 
            +
                      },
         | 
| 261 | 
            +
                      "max_templates": 4,
         | 
| 262 | 
            +
                      "no_recycling_iters": 3,
         | 
| 263 | 
            +
                      "reduce_msa_clusters_by_max_templates": false,
         | 
| 264 | 
            +
                      "resample_msa_in_recycling": true,
         | 
| 265 | 
            +
                      "subsample_templates": {
         | 
| 266 | 
            +
                        "eval": false,
         | 
| 267 | 
            +
                        "finetune": true,
         | 
| 268 | 
            +
                        "predict": false,
         | 
| 269 | 
            +
                        "train": true
         | 
| 270 | 
            +
                      },
         | 
| 271 | 
            +
                      "supervised": {
         | 
| 272 | 
            +
                        "eval": true,
         | 
| 273 | 
            +
                        "finetune": true,
         | 
| 274 | 
            +
                        "predict": false,
         | 
| 275 | 
            +
                        "train": true
         | 
| 276 | 
            +
                      },
         | 
| 277 | 
            +
                      "supervised_features": [
         | 
| 278 | 
            +
                        "all_atom_mask",
         | 
| 279 | 
            +
                        "all_atom_positions",
         | 
| 280 | 
            +
                        "resolution",
         | 
| 281 | 
            +
                        "use_clamped_fape",
         | 
| 282 | 
            +
                        "is_distillation"
         | 
| 283 | 
            +
                      ],
         | 
| 284 | 
            +
                      "template_features": [
         | 
| 285 | 
            +
                        "template_all_atom_positions",
         | 
| 286 | 
            +
                        "template_sum_probs",
         | 
| 287 | 
            +
                        "template_aatype",
         | 
| 288 | 
            +
                        "template_all_atom_mask"
         | 
| 289 | 
            +
                      ],
         | 
| 290 | 
            +
                      "uniform_recycling": {
         | 
| 291 | 
            +
                        "eval": false,
         | 
| 292 | 
            +
                        "finetune": true,
         | 
| 293 | 
            +
                        "predict": false,
         | 
| 294 | 
            +
                        "train": true
         | 
| 295 | 
            +
                      },
         | 
| 296 | 
            +
                      "unsupervised_features": [
         | 
| 297 | 
            +
                        "aatype",
         | 
| 298 | 
            +
                        "residue_index",
         | 
| 299 | 
            +
                        "msa",
         | 
| 300 | 
            +
                        "num_alignments",
         | 
| 301 | 
            +
                        "seq_length",
         | 
| 302 | 
            +
                        "between_segment_residues",
         | 
| 303 | 
            +
                        "deletion_matrix",
         | 
| 304 | 
            +
                        "no_recycling_iters"
         | 
| 305 | 
            +
                      ]
         | 
| 306 | 
            +
                    },
         | 
| 307 | 
            +
                    "make_masked_msa": {
         | 
| 308 | 
            +
                      "profile_prob": 0.1,
         | 
| 309 | 
            +
                      "replace_fraction": 0.15,
         | 
| 310 | 
            +
                      "same_prob": 0.1,
         | 
| 311 | 
            +
                      "uniform_prob": 0.1
         | 
| 312 | 
            +
                    },
         | 
| 313 | 
            +
                    "make_relative_encoding_feat": {
         | 
| 314 | 
            +
                      "max_relative_feature": 32
         | 
| 315 | 
            +
                    },
         | 
| 316 | 
            +
                    "nearest_neighbor_clusters": {
         | 
| 317 | 
            +
                      "gap_agreement_weight": 0.0
         | 
| 318 | 
            +
                    },
         | 
| 319 | 
            +
                    "randomly_replace_msa_with_unknown": {
         | 
| 320 | 
            +
                      "replace_proportion": 0.0
         | 
| 321 | 
            +
                    },
         | 
| 322 | 
            +
                    "sample_msa": {
         | 
| 323 | 
            +
                      "reduce_msa_clusters_by_max_templates": false
         | 
| 324 | 
            +
                    }
         | 
| 325 | 
            +
                  }
         | 
| 326 | 
            +
                },
         | 
| 327 | 
            +
                "globals": {
         | 
| 328 | 
            +
                  "is_multimer": false,
         | 
| 329 | 
            +
                  "mode": "predict",
         | 
| 330 | 
            +
                  "num_recycles": 3,
         | 
| 331 | 
            +
                  "recycle_early_stop_tolerance": 0.5,
         | 
| 332 | 
            +
                  "use_templates": false
         | 
| 333 | 
            +
                },
         | 
| 334 | 
            +
                "model": {
         | 
| 335 | 
            +
                  "auxiliary_heads": {
         | 
| 336 | 
            +
                    "c_m": 256,
         | 
| 337 | 
            +
                    "c_s": 384,
         | 
| 338 | 
            +
                    "c_z": 128,
         | 
| 339 | 
            +
                    "distogram_head_num_bins": 64,
         | 
| 340 | 
            +
                    "experimentally_resolved_head_c_out": 37,
         | 
| 341 | 
            +
                    "masked_msa_head_c_out": 23,
         | 
| 342 | 
            +
                    "predicted_aligned_error_head_num_bins": 64,
         | 
| 343 | 
            +
                    "predicted_lddt_head_c_hidden": 128,
         | 
| 344 | 
            +
                    "predicted_lddt_head_num_bins": 50,
         | 
| 345 | 
            +
                    "tm_enabled": false
         | 
| 346 | 
            +
                  },
         | 
| 347 | 
            +
                  "evoformer_stack": {
         | 
| 348 | 
            +
                    "c_h_m": 32,
         | 
| 349 | 
            +
                    "c_h_opm": 32,
         | 
| 350 | 
            +
                    "c_h_u": 128,
         | 
| 351 | 
            +
                    "c_h_z": 32,
         | 
| 352 | 
            +
                    "c_m": 256,
         | 
| 353 | 
            +
                    "c_s": 384,
         | 
| 354 | 
            +
                    "c_z": 128,
         | 
| 355 | 
            +
                    "fused": false,
         | 
| 356 | 
            +
                    "h_m": 8,
         | 
| 357 | 
            +
                    "h_z": 4,
         | 
| 358 | 
            +
                    "msa_global_col_attention": false,
         | 
| 359 | 
            +
                    "n_trans": 4,
         | 
| 360 | 
            +
                    "num_blocks": 48,
         | 
| 361 | 
            +
                    "opm_first": false,
         | 
| 362 | 
            +
                    "ouput_single": true
         | 
| 363 | 
            +
                  },
         | 
| 364 | 
            +
                  "extra_msa_stack": {
         | 
| 365 | 
            +
                    "c_h_m": 8,
         | 
| 366 | 
            +
                    "c_h_opm": 32,
         | 
| 367 | 
            +
                    "c_h_u": 128,
         | 
| 368 | 
            +
                    "c_h_z": 32,
         | 
| 369 | 
            +
                    "c_m": 64,
         | 
| 370 | 
            +
                    "c_z": 128,
         | 
| 371 | 
            +
                    "fused": false,
         | 
| 372 | 
            +
                    "h_m": 8,
         | 
| 373 | 
            +
                    "h_z": 4,
         | 
| 374 | 
            +
                    "msa_global_col_attention": true,
         | 
| 375 | 
            +
                    "n_trans": 4,
         | 
| 376 | 
            +
                    "num_blocks": 4,
         | 
| 377 | 
            +
                    "opm_first": false
         | 
| 378 | 
            +
                  },
         | 
| 379 | 
            +
                  "feature_embedder": {
         | 
| 380 | 
            +
                    "c_e": 64,
         | 
| 381 | 
            +
                    "c_m": 256,
         | 
| 382 | 
            +
                    "c_t": 64,
         | 
| 383 | 
            +
                    "c_taf": 57,
         | 
| 384 | 
            +
                    "c_tpf": 88,
         | 
| 385 | 
            +
                    "c_z": 128,
         | 
| 386 | 
            +
                    "extra_msa_dim": 25,
         | 
| 387 | 
            +
                    "max_relative_feature": 32,
         | 
| 388 | 
            +
                    "msa_dim": 49,
         | 
| 389 | 
            +
                    "num_bins": 15,
         | 
| 390 | 
            +
                    "tf_dim": 22
         | 
| 391 | 
            +
                  },
         | 
| 392 | 
            +
                  "loss": {
         | 
| 393 | 
            +
                    "distogram_loss": {
         | 
| 394 | 
            +
                      "eps": 1e-06,
         | 
| 395 | 
            +
                      "max_bin": 21.6875,
         | 
| 396 | 
            +
                      "min_bin": 2.3125,
         | 
| 397 | 
            +
                      "no_bins": 64,
         | 
| 398 | 
            +
                      "weight": 0.3
         | 
| 399 | 
            +
                    },
         | 
| 400 | 
            +
                    "experimentally_resolved_loss": {
         | 
| 401 | 
            +
                      "eps": 1e-08,
         | 
| 402 | 
            +
                      "max_resolution": 3.0,
         | 
| 403 | 
            +
                      "min_resolution": 0.1,
         | 
| 404 | 
            +
                      "weight": 0.0
         | 
| 405 | 
            +
                    },
         | 
| 406 | 
            +
                    "fape_loss": {
         | 
| 407 | 
            +
                      "backbone": {
         | 
| 408 | 
            +
                        "clamp_distance": 10.0,
         | 
| 409 | 
            +
                        "loss_unit_distance": 10.0,
         | 
| 410 | 
            +
                        "weight": 0.5
         | 
| 411 | 
            +
                      },
         | 
| 412 | 
            +
                      "eps": 0.0001,
         | 
| 413 | 
            +
                      "sidechain": {
         | 
| 414 | 
            +
                        "clamp_distance": 10.0,
         | 
| 415 | 
            +
                        "length_scale": 10.0,
         | 
| 416 | 
            +
                        "weight": 0.5
         | 
| 417 | 
            +
                      },
         | 
| 418 | 
            +
                      "weight": 1.0
         | 
| 419 | 
            +
                    },
         | 
| 420 | 
            +
                    "masked_msa_loss": {
         | 
| 421 | 
            +
                      "eps": 1e-08,
         | 
| 422 | 
            +
                      "weight": 2.0
         | 
| 423 | 
            +
                    },
         | 
| 424 | 
            +
                    "predicted_lddt_loss": {
         | 
| 425 | 
            +
                      "cutoff": 15.0,
         | 
| 426 | 
            +
                      "eps": 1e-10,
         | 
| 427 | 
            +
                      "max_resolution": 3.0,
         | 
| 428 | 
            +
                      "min_resolution": 0.1,
         | 
| 429 | 
            +
                      "no_bins": 50,
         | 
| 430 | 
            +
                      "weight": 0.01
         | 
| 431 | 
            +
                    },
         | 
| 432 | 
            +
                    "predicted_tm_loss": {
         | 
| 433 | 
            +
                      "eps": 1e-08,
         | 
| 434 | 
            +
                      "max_bin": 31,
         | 
| 435 | 
            +
                      "max_resolution": 3.0,
         | 
| 436 | 
            +
                      "min_resolution": 0.1,
         | 
| 437 | 
            +
                      "no_bins": 64,
         | 
| 438 | 
            +
                      "weight": 0.1
         | 
| 439 | 
            +
                    },
         | 
| 440 | 
            +
                    "supervised_chi_loss": {
         | 
| 441 | 
            +
                      "angle_norm_weight": 0.01,
         | 
| 442 | 
            +
                      "chi_weight": 0.5,
         | 
| 443 | 
            +
                      "eps": 1e-06,
         | 
| 444 | 
            +
                      "weight": 1.0
         | 
| 445 | 
            +
                    },
         | 
| 446 | 
            +
                    "violation_loss": {
         | 
| 447 | 
            +
                      "clash_overlap_tolerance": 1.5,
         | 
| 448 | 
            +
                      "eps": 1e-06,
         | 
| 449 | 
            +
                      "violation_tolerance_factor": 12.0,
         | 
| 450 | 
            +
                      "weight": 0.0
         | 
| 451 | 
            +
                    }
         | 
| 452 | 
            +
                  },
         | 
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    | @@ -0,0 +1,945 @@ | |
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| 1 | 
            +
            {
         | 
| 2 | 
            +
              "CONFIG": {
         | 
| 3 | 
            +
                "data": {
         | 
| 4 | 
            +
                  "transform": {
         | 
| 5 | 
            +
                    "common": {
         | 
| 6 | 
            +
                      "crop_size": {
         | 
| 7 | 
            +
                        "eval": null,
         | 
| 8 | 
            +
                        "finetune": 384,
         | 
| 9 | 
            +
                        "predict": null,
         | 
| 10 | 
            +
                        "train": 256
         | 
| 11 | 
            +
                      },
         | 
| 12 | 
            +
                      "feats": {
         | 
| 13 | 
            +
                        "aatype": [
         | 
| 14 | 
            +
                          "num residues placeholder"
         | 
| 15 | 
            +
                        ],
         | 
| 16 | 
            +
                        "all_atom_mask": [
         | 
| 17 | 
            +
                          "num residues placeholder",
         | 
| 18 | 
            +
                          null
         | 
| 19 | 
            +
                        ],
         | 
| 20 | 
            +
                        "all_atom_positions": [
         | 
| 21 | 
            +
                          "num residues placeholder",
         | 
| 22 | 
            +
                          null,
         | 
| 23 | 
            +
                          null
         | 
| 24 | 
            +
                        ],
         | 
| 25 | 
            +
                        "alt_chi_angles": [
         | 
| 26 | 
            +
                          "num residues placeholder",
         | 
| 27 | 
            +
                          null
         | 
| 28 | 
            +
                        ],
         | 
| 29 | 
            +
                        "assembly_num_chains": [
         | 
| 30 | 
            +
                          null
         | 
| 31 | 
            +
                        ],
         | 
| 32 | 
            +
                        "asym_id": [
         | 
| 33 | 
            +
                          "num residues placeholder"
         | 
| 34 | 
            +
                        ],
         | 
| 35 | 
            +
                        "asym_len": [
         | 
| 36 | 
            +
                          null
         | 
| 37 | 
            +
                        ],
         | 
| 38 | 
            +
                        "atom14_alt_gt_exists": [
         | 
| 39 | 
            +
                          "num residues placeholder",
         | 
| 40 | 
            +
                          null
         | 
| 41 | 
            +
                        ],
         | 
| 42 | 
            +
                        "atom14_alt_gt_positions": [
         | 
| 43 | 
            +
                          "num residues placeholder",
         | 
| 44 | 
            +
                          null,
         | 
| 45 | 
            +
                          null
         | 
| 46 | 
            +
                        ],
         | 
| 47 | 
            +
                        "atom14_atom_exists": [
         | 
| 48 | 
            +
                          "num residues placeholder",
         | 
| 49 | 
            +
                          null
         | 
| 50 | 
            +
                        ],
         | 
| 51 | 
            +
                        "atom14_atom_is_ambiguous": [
         | 
| 52 | 
            +
                          "num residues placeholder",
         | 
| 53 | 
            +
                          null
         | 
| 54 | 
            +
                        ],
         | 
| 55 | 
            +
                        "atom14_gt_exists": [
         | 
| 56 | 
            +
                          "num residues placeholder",
         | 
| 57 | 
            +
                          null
         | 
| 58 | 
            +
                        ],
         | 
| 59 | 
            +
                        "atom14_gt_positions": [
         | 
| 60 | 
            +
                          "num residues placeholder",
         | 
| 61 | 
            +
                          null,
         | 
| 62 | 
            +
                          null
         | 
| 63 | 
            +
                        ],
         | 
| 64 | 
            +
                        "atom37_atom_exists": [
         | 
| 65 | 
            +
                          "num residues placeholder",
         | 
| 66 | 
            +
                          null
         | 
| 67 | 
            +
                        ],
         | 
| 68 | 
            +
                        "backbone_rigid_mask": [
         | 
| 69 | 
            +
                          "num residues placeholder"
         | 
| 70 | 
            +
                        ],
         | 
| 71 | 
            +
                        "backbone_rigid_tensor": [
         | 
| 72 | 
            +
                          "num residues placeholder",
         | 
| 73 | 
            +
                          null,
         | 
| 74 | 
            +
                          null
         | 
| 75 | 
            +
                        ],
         | 
| 76 | 
            +
                        "bert_mask": [
         | 
| 77 | 
            +
                          "msa placeholder",
         | 
| 78 | 
            +
                          "num residues placeholder"
         | 
| 79 | 
            +
                        ],
         | 
| 80 | 
            +
                        "chi_angles_sin_cos": [
         | 
| 81 | 
            +
                          "num residues placeholder",
         | 
| 82 | 
            +
                          null,
         | 
| 83 | 
            +
                          null
         | 
| 84 | 
            +
                        ],
         | 
| 85 | 
            +
                        "chi_mask": [
         | 
| 86 | 
            +
                          "num residues placeholder",
         | 
| 87 | 
            +
                          null
         | 
| 88 | 
            +
                        ],
         | 
| 89 | 
            +
                        "cluster_bias_mask": [
         | 
| 90 | 
            +
                          "msa placeholder"
         | 
| 91 | 
            +
                        ],
         | 
| 92 | 
            +
                        "entity_id": [
         | 
| 93 | 
            +
                          "num residues placeholder"
         | 
| 94 | 
            +
                        ],
         | 
| 95 | 
            +
                        "extra_deletion_value": [
         | 
| 96 | 
            +
                          "extra msa placeholder",
         | 
| 97 | 
            +
                          "num residues placeholder"
         | 
| 98 | 
            +
                        ],
         | 
| 99 | 
            +
                        "extra_has_deletion": [
         | 
| 100 | 
            +
                          "extra msa placeholder",
         | 
| 101 | 
            +
                          "num residues placeholder"
         | 
| 102 | 
            +
                        ],
         | 
| 103 | 
            +
                        "extra_msa": [
         | 
| 104 | 
            +
                          "extra msa placeholder",
         | 
| 105 | 
            +
                          "num residues placeholder"
         | 
| 106 | 
            +
                        ],
         | 
| 107 | 
            +
                        "extra_msa_mask": [
         | 
| 108 | 
            +
                          "extra msa placeholder",
         | 
| 109 | 
            +
                          "num residues placeholder"
         | 
| 110 | 
            +
                        ],
         | 
| 111 | 
            +
                        "extra_msa_row_mask": [
         | 
| 112 | 
            +
                          "extra msa placeholder"
         | 
| 113 | 
            +
                        ],
         | 
| 114 | 
            +
                        "is_distillation": [],
         | 
| 115 | 
            +
                        "msa_feat": [
         | 
| 116 | 
            +
                          "msa placeholder",
         | 
| 117 | 
            +
                          "num residues placeholder",
         | 
| 118 | 
            +
                          null
         | 
| 119 | 
            +
                        ],
         | 
| 120 | 
            +
                        "msa_mask": [
         | 
| 121 | 
            +
                          "msa placeholder",
         | 
| 122 | 
            +
                          "num residues placeholder"
         | 
| 123 | 
            +
                        ],
         | 
| 124 | 
            +
                        "msa_row_mask": [
         | 
| 125 | 
            +
                          "msa placeholder"
         | 
| 126 | 
            +
                        ],
         | 
| 127 | 
            +
                        "no_recycling_iters": [],
         | 
| 128 | 
            +
                        "num_sym": [
         | 
| 129 | 
            +
                          "num residues placeholder"
         | 
| 130 | 
            +
                        ],
         | 
| 131 | 
            +
                        "pseudo_beta": [
         | 
| 132 | 
            +
                          "num residues placeholder",
         | 
| 133 | 
            +
                          null
         | 
| 134 | 
            +
                        ],
         | 
| 135 | 
            +
                        "pseudo_beta_mask": [
         | 
| 136 | 
            +
                          "num residues placeholder"
         | 
| 137 | 
            +
                        ],
         | 
| 138 | 
            +
                        "residue_index": [
         | 
| 139 | 
            +
                          "num residues placeholder"
         | 
| 140 | 
            +
                        ],
         | 
| 141 | 
            +
                        "residx_atom14_to_atom37": [
         | 
| 142 | 
            +
                          "num residues placeholder",
         | 
| 143 | 
            +
                          null
         | 
| 144 | 
            +
                        ],
         | 
| 145 | 
            +
                        "residx_atom37_to_atom14": [
         | 
| 146 | 
            +
                          "num residues placeholder",
         | 
| 147 | 
            +
                          null
         | 
| 148 | 
            +
                        ],
         | 
| 149 | 
            +
                        "resolution": [],
         | 
| 150 | 
            +
                        "rigidgroups_alt_gt_frames": [
         | 
| 151 | 
            +
                          "num residues placeholder",
         | 
| 152 | 
            +
                          null,
         | 
| 153 | 
            +
                          null,
         | 
| 154 | 
            +
                          null
         | 
| 155 | 
            +
                        ],
         | 
| 156 | 
            +
                        "rigidgroups_group_exists": [
         | 
| 157 | 
            +
                          "num residues placeholder",
         | 
| 158 | 
            +
                          null
         | 
| 159 | 
            +
                        ],
         | 
| 160 | 
            +
                        "rigidgroups_group_is_ambiguous": [
         | 
| 161 | 
            +
                          "num residues placeholder",
         | 
| 162 | 
            +
                          null
         | 
| 163 | 
            +
                        ],
         | 
| 164 | 
            +
                        "rigidgroups_gt_exists": [
         | 
| 165 | 
            +
                          "num residues placeholder",
         | 
| 166 | 
            +
                          null
         | 
| 167 | 
            +
                        ],
         | 
| 168 | 
            +
                        "rigidgroups_gt_frames": [
         | 
| 169 | 
            +
                          "num residues placeholder",
         | 
| 170 | 
            +
                          null,
         | 
| 171 | 
            +
                          null,
         | 
| 172 | 
            +
                          null
         | 
| 173 | 
            +
                        ],
         | 
| 174 | 
            +
                        "seq_length": [],
         | 
| 175 | 
            +
                        "seq_mask": [
         | 
| 176 | 
            +
                          "num residues placeholder"
         | 
| 177 | 
            +
                        ],
         | 
| 178 | 
            +
                        "sym_id": [
         | 
| 179 | 
            +
                          "num residues placeholder"
         | 
| 180 | 
            +
                        ],
         | 
| 181 | 
            +
                        "target_feat": [
         | 
| 182 | 
            +
                          "num residues placeholder",
         | 
| 183 | 
            +
                          null
         | 
| 184 | 
            +
                        ],
         | 
| 185 | 
            +
                        "template_aatype": [
         | 
| 186 | 
            +
                          "num templates placeholder",
         | 
| 187 | 
            +
                          "num residues placeholder"
         | 
| 188 | 
            +
                        ],
         | 
| 189 | 
            +
                        "template_all_atom_mask": [
         | 
| 190 | 
            +
                          "num templates placeholder",
         | 
| 191 | 
            +
                          "num residues placeholder",
         | 
| 192 | 
            +
                          null
         | 
| 193 | 
            +
                        ],
         | 
| 194 | 
            +
                        "template_all_atom_positions": [
         | 
| 195 | 
            +
                          "num templates placeholder",
         | 
| 196 | 
            +
                          "num residues placeholder",
         | 
| 197 | 
            +
                          null,
         | 
| 198 | 
            +
                          null
         | 
| 199 | 
            +
                        ],
         | 
| 200 | 
            +
                        "template_alt_torsion_angles_sin_cos": [
         | 
| 201 | 
            +
                          "num templates placeholder",
         | 
| 202 | 
            +
                          "num residues placeholder",
         | 
| 203 | 
            +
                          null,
         | 
| 204 | 
            +
                          null
         | 
| 205 | 
            +
                        ],
         | 
| 206 | 
            +
                        "template_backbone_rigid_mask": [
         | 
| 207 | 
            +
                          "num templates placeholder",
         | 
| 208 | 
            +
                          "num residues placeholder"
         | 
| 209 | 
            +
                        ],
         | 
| 210 | 
            +
                        "template_backbone_rigid_tensor": [
         | 
| 211 | 
            +
                          "num templates placeholder",
         | 
| 212 | 
            +
                          "num residues placeholder",
         | 
| 213 | 
            +
                          null,
         | 
| 214 | 
            +
                          null
         | 
| 215 | 
            +
                        ],
         | 
| 216 | 
            +
                        "template_mask": [
         | 
| 217 | 
            +
                          "num templates placeholder"
         | 
| 218 | 
            +
                        ],
         | 
| 219 | 
            +
                        "template_pseudo_beta": [
         | 
| 220 | 
            +
                          "num templates placeholder",
         | 
| 221 | 
            +
                          "num residues placeholder",
         | 
| 222 | 
            +
                          null
         | 
| 223 | 
            +
                        ],
         | 
| 224 | 
            +
                        "template_pseudo_beta_mask": [
         | 
| 225 | 
            +
                          "num templates placeholder",
         | 
| 226 | 
            +
                          "num residues placeholder"
         | 
| 227 | 
            +
                        ],
         | 
| 228 | 
            +
                        "template_sum_probs": [
         | 
| 229 | 
            +
                          "num templates placeholder",
         | 
| 230 | 
            +
                          null
         | 
| 231 | 
            +
                        ],
         | 
| 232 | 
            +
                        "template_torsion_angles_mask": [
         | 
| 233 | 
            +
                          "num templates placeholder",
         | 
| 234 | 
            +
                          "num residues placeholder",
         | 
| 235 | 
            +
                          null
         | 
| 236 | 
            +
                        ],
         | 
| 237 | 
            +
                        "template_torsion_angles_sin_cos": [
         | 
| 238 | 
            +
                          "num templates placeholder",
         | 
| 239 | 
            +
                          "num residues placeholder",
         | 
| 240 | 
            +
                          null,
         | 
| 241 | 
            +
                          null
         | 
| 242 | 
            +
                        ],
         | 
| 243 | 
            +
                        "true_msa": [
         | 
| 244 | 
            +
                          "msa placeholder",
         | 
| 245 | 
            +
                          "num residues placeholder"
         | 
| 246 | 
            +
                        ],
         | 
| 247 | 
            +
                        "use_clamped_fape": []
         | 
| 248 | 
            +
                      },
         | 
| 249 | 
            +
                      "max_extra_msa": {
         | 
| 250 | 
            +
                        "eval": 512,
         | 
| 251 | 
            +
                        "finetune": 5120,
         | 
| 252 | 
            +
                        "predict": 1024,
         | 
| 253 | 
            +
                        "train": 1024
         | 
| 254 | 
            +
                      },
         | 
| 255 | 
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                      "max_msa_clusters": {
         | 
| 256 | 
            +
                        "eval": 128,
         | 
| 257 | 
            +
                        "finetune": 512,
         | 
| 258 | 
            +
                        "predict": 512,
         | 
| 259 | 
            +
                        "train": 128
         | 
| 260 | 
            +
                      },
         | 
| 261 | 
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| 262 | 
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| 263 | 
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| 264 | 
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| 265 | 
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| 266 | 
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| 267 | 
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| 269 | 
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| 270 | 
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| 271 | 
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| 272 | 
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| 273 | 
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| 274 | 
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| 275 | 
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| 276 | 
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| 277 | 
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         | 
| 278 | 
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         | 
| 279 | 
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         | 
| 280 | 
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         | 
| 281 | 
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| 282 | 
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         | 
| 283 | 
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         | 
| 284 | 
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         | 
| 285 | 
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         | 
| 286 | 
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| 287 | 
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         | 
| 288 | 
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         | 
| 289 | 
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| 290 | 
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| 291 | 
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| 292 | 
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| 293 | 
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| 294 | 
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| 295 | 
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| 296 | 
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| 297 | 
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| 298 | 
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| 299 | 
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         | 
| 300 | 
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| 301 | 
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         | 
| 302 | 
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         | 
| 303 | 
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         | 
| 304 | 
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| 305 | 
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| 306 | 
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| 307 | 
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| 308 | 
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| 313 | 
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| 315 | 
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| 317 | 
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| 318 | 
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| 324 | 
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| 325 | 
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| 326 | 
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| 327 | 
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| 328 | 
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| 329 | 
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| 330 | 
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| 331 | 
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| 332 | 
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| 333 | 
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| 347 | 
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| 358 | 
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| 359 | 
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| 361 | 
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| 362 | 
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| 363 | 
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| 364 | 
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| 400 | 
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| 480 | 
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| 481 | 
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| 579 | 
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| 593 | 
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    | @@ -0,0 +1,3 @@ | |
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