============================================================================= 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 24.998 17.466 11.164 -99.200 -91.000 TRP6 6 1.020 27.336 17.380 11.442 -99.200 -91.000 TRP 42 1.040 -0.736 -11.574 18.728 -99.200 -91.000 TRP6 42 1.020 0.703 -12.885 20.069 -99.200 -91.000 PHE 53 1.000 18.501 -12.914 19.432 -99.200 -91.000 TYR 59 0.840 0.213 -7.459 16.016 -99.200 -91.000 HIS 69 0.900 7.076 9.666 1.054 -99.200 -91.000 PHE 99 1.000 29.002 6.828 1.470 -99.200 -91.000