============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. PHE 3 1.000 -13.952 9.316 21.195 -99.200 -91.000 PHE 21 1.000 -14.079 15.082 17.402 -99.200 -91.000 PHE 55 1.000 -19.436 9.927 7.903 -99.200 -91.000 HIS 86 0.900 -10.752 18.049 3.192 -99.200 -91.000 HIS 102 0.900 -6.549 15.267 -1.626 -99.200 -91.000 PHE 104 1.000 -11.563 13.523 -5.666 -99.200 -91.000 HIS 121 0.900 -3.651 7.504 2.452 -99.200 -91.000 TYR 138 0.840 -9.685 10.981 -15.711 -99.200 -91.000 PHE 147 1.000 -20.652 3.394 -1.951 -99.200 -91.000 PHE 161 1.000 -27.045 13.544 -6.167 -99.200 -91.000 TRP 167 1.040 -22.712 3.192 -13.572 -99.200 -91.000 TRP6 167 1.020 -20.444 3.636 -13.124 -99.200 -91.000 TYR 169 0.840 -23.795 -2.318 -3.906 -99.200 -91.000 TYR 185 0.840 -34.431 2.491 7.937 -99.200 -91.000 PHE 188 1.000 -36.646 8.510 1.068 -99.200 -91.000 TYR 196 0.840 -27.241 0.938 -2.438 -99.200 -91.000 PHE 202 1.000 -31.745 -1.586 10.462 -99.200 -91.000