============================================================================= 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. HIS 5 0.900 82.159 0.334 0.215 -99.200 -91.000 PHE 11 1.000 81.258 12.022 7.305 -99.200 -91.000 PHE 26 1.000 74.880 10.691 6.408 -99.200 -91.000 TRP 27 1.040 74.142 2.263 3.798 -99.200 -91.000 TRP6 27 1.020 73.838 -0.069 3.586 -99.200 -91.000 TRP 30 1.040 67.309 -1.151 9.895 -99.200 -91.000 TRP6 30 1.020 66.015 0.807 9.544 -99.200 -91.000 TYR 48 0.840 76.342 12.692 -12.388 -99.200 -91.000 TYR 69 0.840 77.554 16.002 8.945 -99.200 -91.000 PHE 80 1.000 78.929 16.051 3.177 -99.200 -91.000 PHE 101 1.000 70.335 16.293 -4.298 -99.200 -91.000