============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 9 rings ring int. center anis. iso. TRP 21 1.040 4.243 39.538 5.912 -99.200 -91.000 TRP6 21 1.020 3.343 41.691 5.561 -99.200 -91.000 HIS 31 0.900 -8.643 42.355 -0.237 -99.200 -91.000 HIS 32 0.900 -2.331 40.874 1.746 -99.200 -91.000 HIS 34 0.900 -0.359 36.806 -0.960 -99.200 -91.000 TYR 37 0.840 1.188 33.064 -0.189 -99.200 -91.000 TYR 65 0.840 0.022 27.859 5.672 -99.200 -91.000 HIS 73 0.900 -4.600 36.534 2.620 -99.200 -91.000 PHE 85 1.000 2.437 35.728 8.391 -99.200 -91.000