============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. TYR 11 0.840 18.020 1.364 15.409 -99.200 -91.000 HIS 14 0.900 26.394 -5.478 9.045 -99.200 -91.000 PHE 23 1.000 19.901 -9.070 12.334 -99.200 -91.000 TYR 27 0.840 13.763 1.766 21.150 -99.200 -91.000 PHE 31 1.000 4.146 1.793 21.728 -99.200 -91.000 HIS 32 0.900 1.817 5.413 28.720 -99.200 -91.000 HIS 52 0.900 15.154 -12.001 14.635 -99.200 -91.000 PHE 57 1.000 3.687 -2.838 28.927 -99.200 -91.000 PHE 63 1.000 4.667 -2.585 24.158 -99.200 -91.000 TYR 64 0.840 10.077 2.485 26.457 -99.200 -91.000 TYR 67 0.840 8.026 -5.304 12.973 -99.200 -91.000 TYR 68 0.840 15.738 -7.364 16.355 -99.200 -91.000 PHE 71 1.000 18.472 -3.770 5.776 -99.200 -91.000 TYR 79 0.840 15.020 -1.800 2.587 -99.200 -91.000 HIS 84 0.900 -0.315 5.040 19.879 -99.200 -91.000 TRP 95 1.040 18.053 2.596 7.120 -99.200 -91.000 TRP6 95 1.020 19.079 1.415 5.352 -99.200 -91.000