============================================================================= 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. TYR 4 0.840 8.105 7.587 18.834 -99.200 -91.000 TYR 11 0.840 9.121 14.815 22.194 -99.200 -91.000 TYR 24 0.840 2.287 15.147 3.844 -99.200 -91.000 HIS 27 0.900 7.080 17.961 1.355 -99.200 -91.000 TYR 38 0.840 14.039 23.020 11.118 -99.200 -91.000 HIS 40 0.900 16.229 20.649 6.820 -99.200 -91.000 TYR 42 0.840 17.519 12.637 8.569 -99.200 -91.000 TYR 45 0.840 24.263 14.259 4.961 -99.200 -91.000 PHE 48 1.000 19.422 7.608 12.518 -99.200 -91.000 PHE 50 1.000 14.781 6.966 9.231 -99.200 -91.000 TYR 56 0.840 13.742 8.509 4.602 -99.200 -91.000 TYR 57 0.840 10.493 15.965 2.154 -99.200 -91.000 TRP 59 1.040 7.309 20.036 12.104 -99.200 -91.000 TRP6 59 1.020 7.241 22.236 11.251 -99.200 -91.000 TYR 68 0.840 10.364 25.573 14.523 -99.200 -91.000 PHE 80 1.000 7.257 15.378 7.136 -99.200 -91.000 HIS 92 0.900 20.921 17.900 15.794 -99.200 -91.000 PHE 100 1.000 19.363 15.174 13.471 -99.200 -91.000