============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. HIS 22 0.900 12.552 20.084 5.276 -99.200 -91.000 PHE 24 1.000 17.491 22.801 7.987 -99.200 -91.000 TRP 32 1.040 21.800 24.369 12.405 -99.200 -91.000 TRP6 32 1.020 23.579 23.151 11.456 -99.200 -91.000 PHE 35 1.000 23.588 22.365 0.421 -99.200 -91.000 HIS 47 0.900 19.352 8.093 -5.156 -99.200 -91.000 PHE 55 1.000 27.956 17.782 0.556 -99.200 -91.000 TYR 60 0.840 26.987 20.742 3.992 -99.200 -91.000 TYR 69 0.840 7.662 6.137 7.921 -99.200 -91.000 TRP 70 1.040 8.016 6.451 13.418 -99.200 -91.000 TRP6 70 1.020 7.957 4.186 12.752 -99.200 -91.000 PHE 78 1.000 11.607 10.161 23.122 -99.200 -91.000 HIS 79 0.900 13.759 9.685 18.829 -99.200 -91.000 HIS 81 0.900 14.058 17.327 14.221 -99.200 -91.000 PHE 86 1.000 27.117 15.311 6.846 -99.200 -91.000 TYR 96 0.840 30.579 13.192 2.534 -99.200 -91.000 TYR 105 0.840 8.449 5.616 22.522 -99.200 -91.000 TYR 107 0.840 17.409 8.992 15.569 -99.200 -91.000