============================================================================= 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 9.211 -2.665 34.124 -99.200 -91.000 TRP6 6 1.020 11.561 -2.802 33.950 -99.200 -91.000 TRP 42 1.040 -15.563 -0.394 3.811 -99.200 -91.000 TRP6 42 1.020 -14.061 -1.080 2.114 -99.200 -91.000 PHE 53 1.000 4.032 0.279 2.206 -99.200 -91.000 TYR 59 0.840 -15.015 1.280 8.722 -99.200 -91.000 HIS 69 0.900 -8.574 8.974 30.192 -99.200 -91.000 PHE 99 1.000 13.246 10.147 28.201 -99.200 -91.000