============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. TYR 53 0.840 53.077 0.226 22.205 -99.200 -91.000 PHE 105 1.000 -0.169 -17.473 7.018 -99.200 -91.000 TYR 107 0.840 1.087 -20.563 11.852 -99.200 -91.000 TRP 112 1.040 3.541 -18.034 20.558 -99.200 -91.000 TRP6 112 1.020 3.303 -17.595 18.264 -99.200 -91.000 HIS 137 0.900 11.049 -7.085 -3.949 -99.200 -91.000 TRP 151 1.040 18.134 -27.246 24.350 -99.200 -91.000 TRP6 151 1.020 19.566 -29.089 24.136 -99.200 -91.000 PHE 164 1.000 17.137 -13.299 -4.170 -99.200 -91.000 PHE 171 1.000 22.545 -10.730 2.247 -99.200 -91.000 HIS 172 0.900 20.478 -4.062 0.358 -99.200 -91.000 PHE 182 1.000 20.839 -5.174 19.509 -99.200 -91.000 HIS 188 0.900 22.277 -19.676 8.173 -99.200 -91.000