============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 4 rings ring int. center anis. iso. PHE 6 1.000 16.141 10.980 14.537 -99.200 -91.000 TYR 7 0.840 15.970 7.197 25.088 -99.200 -91.000 PHE 21 1.000 7.116 13.309 22.964 -99.200 -91.000 PHE 29 1.000 3.448 19.563 16.529 -99.200 -91.000