============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. TYR 7 0.840 13.591 15.479 0.295 -99.200 -91.000 TRP 8 1.040 11.831 16.745 -4.013 -99.200 -91.000 TRP6 8 1.020 11.096 15.231 -5.675 -99.200 -91.000 HIS 10 0.900 10.216 12.256 2.834 -99.200 -91.000 PHE 16 1.000 5.885 6.333 13.449 -99.200 -91.000 HIS 43 0.900 6.283 20.839 -9.047 -99.200 -91.000 HIS 46 0.900 15.511 21.462 -5.612 -99.200 -91.000 TYR 51 0.840 11.397 13.712 -10.982 -99.200 -91.000 TYR 55 0.840 4.596 7.997 -1.542 -99.200 -91.000 HIS 56 0.900 8.405 -0.441 -2.347 -99.200 -91.000 TYR 79 0.840 -13.029 5.483 -4.193 -99.200 -91.000 PHE 81 1.000 -5.711 -1.491 -0.901 -99.200 -91.000 PHE 82 1.000 -1.998 -1.849 -5.491 -99.200 -91.000 HIS 84 0.900 -6.635 4.426 1.466 -99.200 -91.000 TRP 89 1.040 0.171 0.563 0.895 -99.200 -91.000 TRP6 89 1.020 -0.611 -1.104 -0.564 -99.200 -91.000 PHE 98 1.000 4.571 2.045 9.471 -99.200 -91.000 HIS 99 0.900 11.324 0.271 12.586 -99.200 -91.000