============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. PHE 8 1.000 17.462 -27.233 30.221 -99.200 -91.000 TYR 52 0.840 9.872 -17.646 29.284 -99.200 -91.000 TRP 62 1.040 9.390 -5.637 24.545 -99.200 -91.000 TRP6 62 1.020 10.310 -7.559 23.510 -99.200 -91.000 HIS 66 0.900 18.778 -1.910 18.536 -99.200 -91.000 PHE 68 1.000 20.509 -7.003 13.688 -99.200 -91.000 TRP 69 1.040 14.180 -13.566 11.623 -99.200 -91.000 TRP6 69 1.020 13.368 -11.408 12.177 -99.200 -91.000 TYR 74 0.840 14.356 -14.645 -2.145 -99.200 -91.000 HIS 94 0.900 0.946 -11.243 19.746 -99.200 -91.000 HIS 103 0.900 17.526 -3.699 11.449 -99.200 -91.000 PHE 112 1.000 16.343 -6.888 -2.221 -99.200 -91.000 TYR 123 0.840 19.505 -9.608 7.183 -99.200 -91.000 PHE 140 1.000 24.737 -10.309 14.684 -99.200 -91.000 HIS 143 0.900 22.810 -16.468 15.050 -99.200 -91.000 HIS 152 0.900 19.894 -27.595 8.708 -99.200 -91.000 PHE 157 1.000 20.868 -27.543 4.793 -99.200 -91.000 HIS 159 0.900 30.925 -32.776 3.441 -99.200 -91.000 TRP 198 1.040 22.493 -18.342 24.390 -99.200 -91.000 TRP6 198 1.020 20.638 -17.573 25.647 -99.200 -91.000 TRP 235 1.040 26.767 -27.217 22.241 -99.200 -91.000 TRP6 235 1.020 25.949 -28.008 20.160 -99.200 -91.000