============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. PHE 6 1.000 -18.414 -6.137 21.054 -99.200 -91.000 HIS 7 0.900 -22.959 -11.627 18.844 -99.200 -91.000 TYR 14 0.840 -13.487 -10.737 18.453 -99.200 -91.000 HIS 44 0.900 -2.676 -14.261 39.479 -99.200 -91.000 HIS 47 0.900 -3.437 -12.902 35.788 -99.200 -91.000 PHE 67 1.000 1.574 -14.720 22.314 -99.200 -91.000 PHE 92 1.000 -5.179 -10.741 20.147 -99.200 -91.000 TYR 100 0.840 6.363 -13.097 18.446 -99.200 -91.000 HIS 125 0.900 11.047 -11.682 31.677 -99.200 -91.000 PHE 126 1.000 12.336 -6.996 32.866 -99.200 -91.000 PHE 146 1.000 -6.713 -0.325 33.339 -99.200 -91.000 PHE 147 1.000 1.202 -3.712 31.399 -99.200 -91.000 TYR 152 0.840 7.804 -0.097 40.882 -99.200 -91.000 PHE 165 1.000 10.232 2.245 20.962 -99.200 -91.000 TYR 191 0.840 3.735 -24.991 40.619 -99.200 -91.000 HIS 212 0.900 4.274 0.531 58.325 -99.200 -91.000 TYR 239 0.840 16.176 -8.258 42.783 -99.200 -91.000