============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. HIS 1 0.900 -26.276 24.030 24.241 -99.200 -91.000 PHE 25 1.000 0.717 16.547 18.716 -99.200 -91.000 PHE 41 1.000 -1.984 30.243 17.694 -99.200 -91.000 TYR 52 0.840 0.909 27.556 12.895 -99.200 -91.000 PHE 72 1.000 4.199 30.640 23.716 -99.200 -91.000 TYR 76 0.840 6.217 35.511 27.083 -99.200 -91.000 PHE 81 1.000 3.978 23.184 35.312 -99.200 -91.000 PHE 96 1.000 0.219 34.525 31.061 -99.200 -91.000 PHE 104 1.000 -3.044 37.007 27.812 -99.200 -91.000 PHE 133 1.000 -12.182 32.056 22.345 -99.200 -91.000 TYR 143 0.840 -16.069 16.134 23.832 -99.200 -91.000