============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. TYR 9 0.840 18.149 -11.185 33.157 -99.200 -91.000 TYR 10 0.840 11.303 -10.504 27.901 -99.200 -91.000 HIS 18 0.900 6.565 -8.209 22.257 -99.200 -91.000 TRP 25 1.040 5.692 -7.185 25.815 -99.200 -91.000 TRP6 25 1.020 7.595 -8.578 25.654 -99.200 -91.000 HIS 29 0.900 11.971 4.059 37.509 -99.200 -91.000 TYR 33 0.840 6.651 -2.881 34.846 -99.200 -91.000 PHE 38 1.000 -2.943 0.063 33.426 -99.200 -91.000 HIS 42 0.900 -2.555 5.092 31.849 -99.200 -91.000 PHE 61 1.000 5.295 5.235 36.275 -99.200 -91.000 HIS 66 0.900 2.032 7.428 36.449 -99.200 -91.000 TYR 77 0.840 -1.051 -4.681 34.302 -99.200 -91.000 TYR 78 0.840 9.152 -7.845 37.356 -99.200 -91.000 HIS 83 0.900 21.876 -8.379 28.094 -99.200 -91.000