============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. PHE 2 1.000 2.164 59.363 104.902 -99.200 -91.000 PHE 5 1.000 3.948 63.651 106.293 -99.200 -91.000 PHE 17 1.000 3.228 56.301 97.015 -99.200 -91.000 HIS 25 0.900 7.831 57.977 85.501 -99.200 -91.000 HIS 32 0.900 7.266 60.208 90.009 -99.200 -91.000 PHE 54 1.000 7.746 74.839 88.427 -99.200 -91.000 TYR 58 0.840 7.329 73.465 83.117 -99.200 -91.000 PHE 91 1.000 13.512 72.183 106.160 -99.200 -91.000 TYR 99 0.840 -1.074 69.126 113.792 -99.200 -91.000 HIS 104 0.900 6.041 72.178 107.906 -99.200 -91.000 TYR 123 0.840 18.389 71.543 83.601 -99.200 -91.000