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@@ -129,9 +129,13 @@ function createScoreMapFromCif(modelData: Model, residueData: Table<typeof Alpha
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return 'Very low';
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};
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+ const entityMap = new Map<string, string>();
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for (let i = 0; i < _rowCount; i++) {
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const confidenceScore = metric_value.value(i);
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- const idx = modelData.atomicHierarchy.index.findResidue('1', label_asym_id.value(i), label_seq_id.value(i));
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+ const labelAsymId = label_asym_id.value(i);
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+ if (!entityMap.has(labelAsymId)) entityMap.set(labelAsymId, (modelData.atomicHierarchy.index.findEntity(labelAsymId) + 1).toString());
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+ const entityId = entityMap.get(labelAsymId)!;
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+ const idx = modelData.atomicHierarchy.index.findResidue(entityId, labelAsymId, label_seq_id.value(i));
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const confidenceCategory = toCategory(confidenceScore);
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ret.set(idx, [confidenceScore, confidenceCategory]);
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