============================================================================= 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 24.538 11.413 19.609 -99.200 -91.000 TRP6 6 1.020 26.856 11.615 19.289 -99.200 -91.000 TRP 42 1.040 -0.397 41.507 13.337 -99.200 -91.000 TRP6 42 1.020 1.096 42.739 11.989 -99.200 -91.000 PHE 53 1.000 18.636 42.585 11.821 -99.200 -91.000 TYR 59 0.840 0.367 37.216 15.944 -99.200 -91.000 HIS 69 0.900 7.472 19.589 30.211 -99.200 -91.000 PHE 99 1.000 29.252 22.388 29.157 -99.200 -91.000