============================================================================= 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 -7.963 7.031 11.510 -99.200 -91.000 HIS 18 0.900 -9.570 9.808 35.863 -99.200 -91.000 HIS 19 0.900 -6.214 3.490 37.167 -99.200 -91.000 PHE 20 1.000 -6.666 7.884 29.601 -99.200 -91.000 PHE 31 1.000 -1.039 6.276 -1.369 -99.200 -91.000 PHE 49 1.000 -6.014 13.046 31.294 -99.200 -91.000 PHE 51 1.000 -8.465 13.922 23.239 -99.200 -91.000