============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. PHE 7 1.000 38.181 28.843 50.941 -99.200 -91.000 HIS 18 0.900 20.460 41.317 34.985 -99.200 -91.000 HIS 19 0.900 27.695 41.163 30.845 -99.200 -91.000 PHE 20 1.000 27.946 36.897 38.406 -99.200 -91.000 PHE 31 1.000 44.363 16.703 55.882 -99.200 -91.000 PHE 49 1.000 22.687 36.525 39.526 -99.200 -91.000 PHE 51 1.000 26.467 34.132 46.787 -99.200 -91.000