============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. TYR 8 0.840 5.982 14.567 79.269 -99.200 -91.000 HIS 49 0.900 15.671 -0.295 89.191 -99.200 -91.000 TYR 60 0.840 18.320 15.812 103.119 -99.200 -91.000 HIS 69 0.900 20.696 0.316 88.575 -99.200 -91.000 HIS 75 0.900 20.892 -2.336 84.504 -99.200 -91.000 TYR 76 0.840 24.663 5.085 82.361 -99.200 -91.000 TRP 79 1.040 18.280 12.112 85.960 -99.200 -91.000 TRP6 79 1.020 17.809 11.502 83.725 -99.200 -91.000 TYR 89 0.840 20.285 22.419 94.487 -99.200 -91.000 PHE 92 1.000 22.604 15.608 84.016 -99.200 -91.000 PHE 103 1.000 21.745 15.777 95.070 -99.200 -91.000 TYR 115 0.840 15.382 7.599 82.904 -99.200 -91.000 HIS 119 0.900 15.543 -2.450 85.079 -99.200 -91.000 HIS 121 0.900 11.616 10.294 86.935 -99.200 -91.000 TRP 122 1.040 12.729 3.263 89.328 -99.200 -91.000 TRP6 122 1.020 11.343 1.572 90.216 -99.200 -91.000