============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. TYR 21 0.840 -14.944 25.988 62.880 -99.200 -91.000 TYR 44 0.840 -2.491 29.871 46.459 -99.200 -91.000 PHE 49 1.000 -12.797 36.205 53.477 -99.200 -91.000 PHE 52 1.000 -24.870 31.914 49.785 -99.200 -91.000 HIS 59 0.900 -11.880 33.479 46.111 -99.200 -91.000 TYR 60 0.840 -5.860 35.691 54.415 -99.200 -91.000 TRP 64 1.040 -0.453 21.043 53.834 -99.200 -91.000 TRP6 64 1.020 -2.636 20.439 53.135 -99.200 -91.000 TYR 69 0.840 -10.072 18.130 61.274 -99.200 -91.000 TYR 76 0.840 -8.082 21.921 57.169 -99.200 -91.000 TYR 90 0.840 -6.538 42.603 40.660 -99.200 -91.000 TRP 96 1.040 -2.808 46.921 42.473 -99.200 -91.000 TRP6 96 1.020 -4.251 46.981 44.335 -99.200 -91.000