============================================================================= 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 8 0.840 61.968 18.640 -13.264 -99.200 -91.000 TYR 11 0.840 59.341 14.060 -18.912 -99.200 -91.000 PHE 28 1.000 71.012 30.367 -35.000 -99.200 -91.000 PHE 40 1.000 81.260 32.315 -30.655 -99.200 -91.000 PHE 85 1.000 66.724 25.091 -24.361 -99.200 -91.000 TYR 99 0.840 81.500 37.444 -22.714 -99.200 -91.000 PHE 100 1.000 74.195 38.511 -24.396 -99.200 -91.000 HIS 120 0.900 68.769 45.799 -32.304 -99.200 -91.000 PHE 121 1.000 68.732 41.659 -24.968 -99.200 -91.000 HIS 125 0.900 60.008 44.543 -23.769 -99.200 -91.000 HIS 130 0.900 56.160 42.912 -30.511 -99.200 -91.000 PHE 143 1.000 70.563 39.563 -38.927 -99.200 -91.000 HIS 146 0.900 74.493 47.546 -35.251 -99.200 -91.000