============================================================================= 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 24.546 -8.068 92.898 -99.200 -91.000 TRP6 6 1.020 23.451 -7.821 94.952 -99.200 -91.000 TRP 42 1.040 18.591 17.426 63.127 -99.200 -91.000 TRP6 42 1.020 17.529 19.114 64.404 -99.200 -91.000 PHE 53 1.000 8.915 17.503 79.961 -99.200 -91.000 TYR 59 0.840 19.933 12.451 64.177 -99.200 -91.000 HIS 69 0.900 22.418 -10.224 70.988 -99.200 -91.000 PHE 99 1.000 10.523 -9.937 89.493 -99.200 -91.000