============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. PHE 1 1.000 7.907 -4.185 21.739 -99.200 -91.000 PHE 13 1.000 5.861 -1.908 6.259 -99.200 -91.000 PHE 27 1.000 4.607 1.400 14.045 -99.200 -91.000 PHE 32 1.000 13.798 -5.277 8.455 -99.200 -91.000 TYR 38 0.840 18.966 -9.222 13.597 -99.200 -91.000 PHE 50 1.000 19.461 -4.139 12.848 -99.200 -91.000 TYR 81 0.840 27.272 -9.128 5.825 -99.200 -91.000 PHE 88 1.000 19.496 -9.116 3.199 -99.200 -91.000 TRP 89 1.040 24.136 -8.287 -3.982 -99.200 -91.000 TRP6 89 1.020 25.100 -6.151 -4.261 -99.200 -91.000 PHE 92 1.000 17.019 1.804 2.177 -99.200 -91.000 HIS 93 0.900 12.222 4.902 -2.848 -99.200 -91.000 TYR 106 0.840 5.937 8.597 12.074 -99.200 -91.000 PHE 107 1.000 13.815 10.357 6.921 -99.200 -91.000 HIS 117 0.900 24.493 -3.825 -8.744 -99.200 -91.000