Directory : cesg-master.biochem.wisc.edu:/u/lytle/at5g39720/7candid/2 Cycle : 1 2 3 4 5 6 7 Peaks: selected : 4468 4468 4468 4468 4468 4468 4468 with assignment : 1257 1285 1161 1152 1097 1051 1009 without assignment : 3211 3183 3307 3316 3371 3417 3459 with diagonal assignment : 242 253 253 253 253 253 253 Cross peaks: with off-diagonal assignment : 1015 1032 908 899 844 798 756 with unique assignment : 232 903 811 804 775 739 705 with short-range assignment |i-j|<=1: 558 633 627 622 611 600 590 with medium-range assignment 1<|i-j|<5 : 129 123 111 106 99 89 81 with long-range assignment |i-j|>=5: 328 276 170 171 134 109 85 Comparison with reference assignment: Cross peaks with reference assignment : 3 3 3 3 3 3 3 with identical reference assignment : 2 1 1 2 2 2 2 with compatible reference assignment : 3 3 3 3 3 3 3 with incompatible reference assignment : 0 0 0 0 0 0 0 with additional reference assignment : 3 3 3 3 3 3 3 with additional assignment : 1012 1029 905 896 841 795 753 Upper distance limits: total : 826 744 627 612 563 515 482 469 short-range, |i-j|<=1 : 376 381 368 358 348 333 330 321 medium-range, 1<|i-j|<5 : 215 199 104 99 94 85 79 79 long-range, |i-j|>=5 : 235 164 155 155 121 97 73 69 Average assignments/constraint : 4.51 1.68 1.12 1.11 1.09 1.07 1.00 1.00 Average target function value : 740.48 242.93 199.94 102.44 59.22 33.42 13.66 10.95 RMSD (residues 18..164): Average backbone RMSD to mean : 8.75 8.50 7.26 6.36 6.72 7.72 9.10 9.04 Average heavy atom RMSD to mean : 9.45 9.15 7.92 6.97 7.30 8.42 9.80 9.69