============================================================================= 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 24.956 11.323 19.296 -99.200 -91.000 TRP6 6 1.020 27.270 11.460 18.853 -99.200 -91.000 TRP 42 1.040 -0.833 40.920 13.741 -99.200 -91.000 TRP6 42 1.020 0.573 42.158 12.310 -99.200 -91.000 PHE 53 1.000 18.357 42.254 11.764 -99.200 -91.000 TYR 59 0.840 0.029 36.571 15.908 -99.200 -91.000 HIS 69 0.900 7.340 18.922 30.105 -99.200 -91.000 PHE 99 1.000 29.022 21.943 29.244 -99.200 -91.000