============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. TRP 6 1.040 -0.610 17.851 11.207 -99.200 -91.000 TRP6 6 1.020 1.689 17.859 11.566 -99.200 -91.000 TRP 40 1.040 -25.935 -11.259 17.635 -99.200 -91.000 TRP6 40 1.020 -24.528 -12.559 19.016 -99.200 -91.000 PHE 50 1.000 -7.155 -13.079 18.802 -99.200 -91.000 TYR 56 0.840 -25.224 -7.200 14.844 -99.200 -91.000 HIS 65 0.900 -17.389 9.885 -0.028 -99.200 -91.000 PHE 94 1.000 4.171 7.040 2.001 -99.200 -91.000