Start reading THETA_PDB End reading THETA_PDB j 2 k 3 j 2 k 4 j 2 k 5 j 2 k 6 j 2 k 7 j 2 k 8 j 2 k 9 j 2 k 10 j 3 k 4 j 3 k 5 j 3 k 6 j 3 k 7 j 3 k 8 j 3 k 9 j 3 k 10 j 4 k 5 j 4 k 6 j 4 k 7 j 4 k 8 j 4 k 9 j 4 k 10 j 5 k 6 j 5 k 7 j 5 k 8 j 5 k 9 j 5 k 10 j 6 k 7 j 6 k 8 j 6 k 9 j 6 k 10 j 7 k 8 j 7 k 9 j 7 k 10 j 8 k 9 j 8 k 10 j 9 k 10 acceleration/energy drift too large 6.22700722506562 44.5137346493434 split increased to 2 itime 234715 itsplit 1 acceleration/energy drift too large 6.86814035347406 12.4746903563092 split increased to 2 itime 514594 itsplit 1 acceleration/energy drift too large 6.55925793931436 15.8656739496644 split increased to 2 itime 653285 itsplit 1 acceleration/energy drift too large 21.9080212609904 313.864278107703 split increased to 2 itime 716644 itsplit 1 acceleration/energy drift too large 7.05820437593023 65.2498780261722 split increased to 2 itime 766874 itsplit 1 acceleration/energy drift too large 3.27399071955341 11.2118420753555 split increased to 2 itime 766875 itsplit 1 acceleration/energy drift too large 1.65659624160402 12.8042137151367 split increased to 4 itime 766875 itsplit 1 acceleration/energy drift too large 3.73456721524056 16.0028892511076 split increased to 2 itime 774313 itsplit 1 acceleration/energy drift too large 31.2190662301148 1043.16119124700 split increased to 2 itime 997277 itsplit 1 acceleration/energy drift too large 4.45187640165009 25.3192539827523 split increased to 2 itime 805374 itsplit 1 acceleration/energy drift too large 2.68717091115819 36.2762846456559 split increased to 4 itime 805374 itsplit 1 acceleration/energy drift too large 8.91951026538456 111.515595256629 split increased to 2 itime 821660 itsplit 1 acceleration/energy drift too large 7.49222623976741 75.0988053069829 split increased to 2 itime 821661 itsplit 1 acceleration/energy drift too large 1.99475931907040 18.8634159986581 split increased to 4 itime 821661 itsplit 1 acceleration/energy drift too large 5.16826042460590 14.6364245545982 split increased to 2 itime 956637 itsplit 1 acceleration/energy drift too large 25.6524452006942 1551.25820320037 split increased to 4 itime 956637 itsplit 1 acceleration/energy drift too large 2.16828666529408 44.6707268674785 split increased to 8 itime 956637 itsplit 2 acceleration/energy drift too large 21.2081722872122 297.396114249498 split increased to 2 itime 986672 itsplit 1 acceleration/energy drift too large 8.48518344407397 89.2680392034545 split increased to 2 itime 940478 itsplit 1 acceleration/energy drift too large 11.7573043539954 165.806730390708 split increased to 2 itime 965074 itsplit 1 acceleration/energy drift too large 14.1428555082260 113.618783892170 split increased to 2 itime 986882 itsplit 1 acceleration/energy drift too large 4.24716564125084 11.8604415785879 split increased to 2 itime 948935 itsplit 1 acceleration/energy drift too large 8.54598969321150 41.5549594389274 split increased to 2 itime 958178 itsplit 1 acceleration/energy drift too large 4.65997608591955 13.4883010927308 split increased to 2 itime 882204 itsplit 1