============================================================================= 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 8 0.840 46.151 89.452 13.037 -99.200 -91.000 PHE 17 1.000 29.388 84.896 11.510 -99.200 -91.000 PHE 30 1.000 16.194 96.761 4.544 -99.200 -91.000 PHE 38 1.000 28.465 95.937 -0.204 -99.200 -91.000 HIS 42 0.900 38.076 100.994 2.993 -99.200 -91.000 PHE 45 1.000 41.885 94.474 4.061 -99.200 -91.000 TYR 61 0.840 47.928 102.513 15.307 -99.200 -91.000 PHE 70 1.000 28.567 106.842 8.163 -99.200 -91.000 TYR 78 0.840 20.257 103.618 10.386 -99.200 -91.000 PHE 88 1.000 15.364 94.952 29.469 -99.200 -91.000 HIS 101 0.900 19.291 91.916 17.145 -99.200 -91.000 TYR 113 0.840 39.222 87.029 22.017 -99.200 -91.000 TYR 130 0.840 34.513 100.810 12.956 -99.200 -91.000 TYR 137 0.840 25.490 100.590 11.600 -99.200 -91.000 PHE 138 1.000 27.233 95.291 12.973 -99.200 -91.000 PHE 139 1.000 19.185 96.982 20.363 -99.200 -91.000 TYR 156 0.840 12.283 88.282 29.347 -99.200 -91.000