============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. TYR 11 0.840 -17.644 -1.298 17.196 -99.200 -91.000 HIS 14 0.900 -26.144 4.333 11.357 -99.200 -91.000 PHE 23 1.000 -19.569 9.252 13.937 -99.200 -91.000 TYR 27 0.840 -12.994 -1.617 22.956 -99.200 -91.000 PHE 31 1.000 -3.483 -1.094 23.643 -99.200 -91.000 HIS 32 0.900 1.708 -3.539 30.299 -99.200 -91.000 HIS 52 0.900 -14.909 11.878 17.713 -99.200 -91.000 PHE 57 1.000 -4.746 4.331 33.605 -99.200 -91.000 PHE 63 1.000 -2.404 2.176 28.948 -99.200 -91.000 TYR 64 0.840 -9.283 -2.188 28.282 -99.200 -91.000 TYR 67 0.840 -7.589 5.783 14.929 -99.200 -91.000 TYR 68 0.840 -15.281 7.419 18.230 -99.200 -91.000 PHE 71 1.000 -17.993 3.902 7.657 -99.200 -91.000 TYR 79 0.840 -14.653 2.164 4.226 -99.200 -91.000 HIS 85 0.900 1.084 -4.314 21.763 -99.200 -91.000 TRP 96 1.040 -17.276 -2.383 8.750 -99.200 -91.000 TRP6 96 1.020 -18.380 -1.379 6.931 -99.200 -91.000