============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 29 0.840 41.690 -0.820 28.702 -99.200 -91.000 TYR 37 0.840 16.678 6.707 38.599 -99.200 -91.000 PHE 51 1.000 30.616 9.976 34.311 -99.200 -91.000 PHE 55 1.000 35.300 10.457 31.454 -99.200 -91.000 PHE 63 1.000 18.014 7.910 34.843 -99.200 -91.000 PHE 80 1.000 15.549 9.973 25.699 -99.200 -91.000 HIS 90 0.900 11.832 -2.672 35.168 -99.200 -91.000 PHE 92 1.000 5.429 -7.914 35.516 -99.200 -91.000 PHE 113 1.000 19.901 -0.048 24.675 -99.200 -91.000 HIS 120 0.900 16.308 -9.446 40.164 -99.200 -91.000 PHE 126 1.000 5.611 -11.868 41.392 -99.200 -91.000 TYR 146 0.840 14.026 -5.748 22.034 -99.200 -91.000 PHE 168 1.000 23.859 -2.867 20.493 -99.200 -91.000 PHE 187 1.000 22.888 -17.445 22.758 -99.200 -91.000 TYR 198 0.840 30.855 -0.212 40.677 -99.200 -91.000