============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 28 rings ring int. center anis. iso. TYR 30 0.840 16.693 -10.501 -19.288 -99.200 -91.000 TYR 36 0.840 16.597 -6.450 -15.435 -99.200 -91.000 TRP 39 1.040 20.298 -2.739 -2.577 -99.200 -91.000 TRP6 39 1.020 20.526 -4.039 -0.613 -99.200 -91.000 PHE 40 1.000 11.533 -2.148 -3.167 -99.200 -91.000 TYR 53 0.840 15.650 2.100 -11.549 -99.200 -91.000 PHE 66 1.000 20.045 6.029 1.124 -99.200 -91.000 PHE 75 1.000 23.089 -8.810 -6.321 -99.200 -91.000 TYR 90 0.840 18.161 0.786 4.637 -99.200 -91.000 TYR 91 0.840 12.139 -5.636 4.104 -99.200 -91.000 PHE 95 1.000 10.492 -6.694 -11.596 -99.200 -91.000 TYR 98 0.840 7.047 -14.000 -14.133 -99.200 -91.000 PHE 100 1.000 9.270 -10.440 -11.134 -99.200 -91.000 PHE 102 1.000 9.590 -7.597 -2.068 -99.200 -91.000 PHE 122 1.000 -0.683 10.365 31.681 -99.200 -91.000 PHE 139 1.000 1.573 7.247 27.581 -99.200 -91.000 PHE 143 1.000 13.254 4.345 26.504 -99.200 -91.000 TYR 144 0.840 20.545 4.974 21.701 -99.200 -91.000 TRP 152 1.040 3.388 -0.860 36.422 -99.200 -91.000 TRP6 152 1.020 2.067 1.099 36.452 -99.200 -91.000 TRP 167 1.040 9.523 -2.231 25.103 -99.200 -91.000 TRP6 167 1.020 8.373 -4.266 25.475 -99.200 -91.000 TYR 177 0.840 15.293 2.550 20.361 -99.200 -91.000 TYR 190 0.840 -7.698 3.178 40.859 -99.200 -91.000 HIS 193 0.900 -4.217 -2.173 47.112 -99.200 -91.000 TYR 196 0.840 -3.146 2.357 42.427 -99.200 -91.000 HIS 202 0.900 17.803 4.576 29.702 -99.200 -91.000 PHE 213 1.000 -2.503 7.255 40.298 -99.200 -91.000