============================================================================= 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 0.862 17.884 19.819 -99.200 -91.000 TRP6 6 1.020 -1.483 17.813 19.510 -99.200 -91.000 TRP 42 1.040 26.053 -11.951 13.404 -99.200 -91.000 TRP6 42 1.020 24.683 -13.286 12.016 -99.200 -91.000 PHE 53 1.000 6.905 -12.979 11.409 -99.200 -91.000 TYR 59 0.840 25.293 -7.746 16.063 -99.200 -91.000 HIS 68 0.900 18.192 9.838 30.626 -99.200 -91.000 PHE 97 1.000 -3.685 7.013 29.264 -99.200 -91.000