============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. PHE 2 1.000 8.266 -10.910 3.304 -99.200 -91.000 TYR 12 0.840 6.502 1.202 16.061 -99.200 -91.000 PHE 36 1.000 10.027 -0.140 20.118 -99.200 -91.000 TYR 41 0.840 3.998 -11.544 14.154 -99.200 -91.000 PHE 48 1.000 6.891 -5.546 4.869 -99.200 -91.000 TYR 52 0.840 7.632 -5.914 0.097 -99.200 -91.000 PHE 68 1.000 -3.881 2.811 -0.445 -99.200 -91.000