============================================================================= 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 12 1.000 2.307 21.532 0.603 -99.200 -91.000 PHE 16 1.000 -7.680 19.251 4.672 -99.200 -91.000 PHE 19 1.000 -5.186 25.408 8.408 -99.200 -91.000 PHE 65 1.000 -4.407 16.889 0.823 -99.200 -91.000 PHE 68 1.000 -4.015 22.939 3.135 -99.200 -91.000 PHE 89 1.000 12.800 32.698 12.192 -99.200 -91.000 PHE 92 1.000 6.788 27.953 13.526 -99.200 -91.000 PHE 99 1.000 19.462 33.995 16.869 -99.200 -91.000 HIS 107 0.900 2.121 30.952 23.051 -99.200 -91.000 TYR 138 0.840 14.548 32.945 6.936 -99.200 -91.000 PHE 141 1.000 10.523 28.322 9.744 -99.200 -91.000