============================================================================= 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. HIS 18 0.900 76.448 62.428 27.933 -99.200 -91.000 TRP 21 1.040 67.134 58.810 22.670 -99.200 -91.000 TRP6 21 1.020 64.873 58.221 22.358 -99.200 -91.000 HIS 41 0.900 87.379 57.674 44.729 -99.200 -91.000 TRP 57 1.040 72.494 50.467 18.012 -99.200 -91.000 TRP6 57 1.020 72.049 48.149 18.238 -99.200 -91.000 TYR 72 0.840 90.138 57.831 27.155 -99.200 -91.000 HIS 88 0.900 63.493 50.489 19.965 -99.200 -91.000 PHE 89 1.000 63.399 48.355 29.012 -99.200 -91.000 TYR 91 0.840 63.571 41.689 21.321 -99.200 -91.000 HIS 98 0.900 74.263 39.740 26.395 -99.200 -91.000 TYR 126 0.840 64.367 56.703 44.946 -99.200 -91.000 HIS 134 0.900 73.691 56.593 46.351 -99.200 -91.000 HIS 136 0.900 71.606 54.198 41.927 -99.200 -91.000 TRP 140 1.040 77.141 53.778 38.136 -99.200 -91.000 TRP6 140 1.020 75.515 54.878 36.809 -99.200 -91.000