============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. PHE 1 1.000 -24.901 65.141 42.291 -99.200 -91.000 TYR 6 0.840 -14.442 63.947 33.944 -99.200 -91.000 HIS 10 0.900 -12.730 58.430 17.325 -99.200 -91.000 TRP 15 1.040 -5.002 55.659 7.550 -99.200 -91.000 TRP6 15 1.020 -3.204 55.532 6.002 -99.200 -91.000 PHE 23 1.000 -20.446 48.519 15.746 -99.200 -91.000 PHE 32 1.000 -5.324 49.679 20.364 -99.200 -91.000 TYR 47 0.840 -9.203 66.217 35.450 -99.200 -91.000 TRP 67 1.040 -9.810 57.367 29.380 -99.200 -91.000 TRP6 67 1.020 -10.243 59.332 30.629 -99.200 -91.000 PHE 71 1.000 -8.974 57.056 36.155 -99.200 -91.000 TYR 76 0.840 -18.386 49.763 26.363 -99.200 -91.000 TYR 80 0.840 -20.992 54.103 13.938 -99.200 -91.000 TYR 87 0.840 -22.461 61.966 21.528 -99.200 -91.000 HIS 104 0.900 -17.947 57.666 17.094 -99.200 -91.000 HIS 120 0.900 -14.325 78.460 16.239 -99.200 -91.000 PHE 127 1.000 -13.624 67.284 22.178 -99.200 -91.000 TRP 139 1.040 -23.056 72.348 31.458 -99.200 -91.000 TRP6 139 1.020 -22.511 70.653 33.026 -99.200 -91.000 PHE 144 1.000 -10.315 69.808 25.091 -99.200 -91.000