============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. HIS 1 0.900 -30.094 8.284 -25.225 -99.200 -91.000 HIS 2 0.900 -25.322 11.024 -33.768 -99.200 -91.000 TYR 9 0.840 -22.169 3.544 -22.451 -99.200 -91.000 PHE 11 1.000 -23.273 -0.708 -28.341 -99.200 -91.000 TYR 14 0.840 -21.858 -7.430 -38.508 -99.200 -91.000 TYR 34 0.840 -19.756 -16.348 -34.389 -99.200 -91.000 TYR 38 0.840 -29.512 -7.000 -32.008 -99.200 -91.000 TYR 48 0.840 -34.467 -4.203 -30.169 -99.200 -91.000 TYR 61 0.840 -36.676 -12.422 -36.292 -99.200 -91.000 TYR 62 0.840 -34.093 -7.746 -35.923 -99.200 -91.000 HIS 80 0.900 -38.157 -5.745 -44.984 -99.200 -91.000 PHE 91 1.000 -29.427 -4.664 -37.478 -99.200 -91.000 TYR 92 0.840 -23.160 2.106 -35.065 -99.200 -91.000 PHE 97 1.000 -15.668 -10.151 -23.738 -99.200 -91.000 PHE 118 1.000 -24.982 -1.282 -23.136 -99.200 -91.000 PHE 122 1.000 -27.452 3.678 -24.096 -99.200 -91.000 TRP 126 1.040 -38.003 0.905 -32.987 -99.200 -91.000 TRP6 126 1.020 -37.089 -0.162 -34.883 -99.200 -91.000