============================================================================= 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. TYR 4 0.840 0.295 38.247 42.460 -99.200 -91.000 HIS 7 0.900 -8.231 33.405 43.605 -99.200 -91.000 PHE 21 1.000 -2.689 27.173 57.426 -99.200 -91.000 PHE 28 1.000 3.663 34.850 46.726 -99.200 -91.000 HIS 33 0.900 -11.166 29.596 45.344 -99.200 -91.000 PHE 39 1.000 -10.340 29.389 40.551 -99.200 -91.000 PHE 42 1.000 -14.537 34.113 43.962 -99.200 -91.000 HIS 84 0.900 9.991 12.430 42.554 -99.200 -91.000 PHE 101 1.000 6.662 20.753 34.565 -99.200 -91.000 PHE 106 1.000 5.573 22.299 45.621 -99.200 -91.000 HIS 121 0.900 2.163 34.521 31.223 -99.200 -91.000