============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 9 rings ring int. center anis. iso. PHE 6 1.000 -12.019 23.669 43.673 -99.200 -91.000 PHE 20 1.000 6.662 21.016 40.545 -99.200 -91.000 TYR 22 0.840 2.646 26.078 41.911 -99.200 -91.000 TYR 44 0.840 -2.288 23.594 46.074 -99.200 -91.000 PHE 56 1.000 -0.365 16.938 43.417 -99.200 -91.000 PHE 61 1.000 2.667 21.551 55.219 -99.200 -91.000 PHE 65 1.000 5.058 17.560 64.103 -99.200 -91.000 PHE 95 1.000 1.939 24.482 50.343 -99.200 -91.000 PHE 97 1.000 1.877 21.387 45.695 -99.200 -91.000