============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. TYR 5 0.840 7.604 -12.429 21.914 -99.200 -91.000 TYR 7 0.840 1.884 -2.610 15.801 -99.200 -91.000 HIS 34 0.900 -5.183 -14.894 1.380 -99.200 -91.000 TYR 48 0.840 -1.680 -34.453 8.255 -99.200 -91.000 PHE 51 1.000 -1.784 -24.311 4.786 -99.200 -91.000 TYR 60 0.840 7.425 -19.225 -0.185 -99.200 -91.000 PHE 62 1.000 3.707 -23.326 4.560 -99.200 -91.000 TYR 66 0.840 -10.273 -29.603 8.096 -99.200 -91.000 PHE 102 1.000 -3.257 -10.072 3.349 -99.200 -91.000 TYR 104 0.840 1.040 -5.778 9.779 -99.200 -91.000 PHE 116 1.000 5.489 -18.612 19.463 -99.200 -91.000 PHE 126 1.000 9.122 -5.703 11.967 -99.200 -91.000