============================================================================= 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. PHE 19 1.000 17.452 -13.771 -15.884 -99.200 -91.000 PHE 27 1.000 20.976 -7.286 -14.433 -99.200 -91.000 PHE 30 1.000 34.256 -12.110 -12.302 -99.200 -91.000 PHE 33 1.000 36.812 -9.149 -10.691 -99.200 -91.000 TYR 49 0.840 22.665 -17.864 -1.282 -99.200 -91.000 PHE 55 1.000 29.512 -13.374 -11.042 -99.200 -91.000 TYR 72 0.840 12.541 -9.566 -14.024 -99.200 -91.000 TYR 75 0.840 15.260 -5.308 -19.146 -99.200 -91.000 PHE 78 1.000 20.176 -2.186 -13.149 -99.200 -91.000 TYR 87 0.840 20.860 -17.324 -12.201 -99.200 -91.000 TYR 101 0.840 29.993 -3.861 -0.476 -99.200 -91.000 PHE 103 1.000 35.743 -12.589 -5.833 -99.200 -91.000 TYR 104 0.840 33.013 -7.135 -8.316 -99.200 -91.000 PHE 118 1.000 15.033 -5.506 -12.128 -99.200 -91.000 PHE 124 1.000 19.887 -4.579 -6.306 -99.200 -91.000 TYR 142 0.840 13.027 -12.752 13.138 -99.200 -91.000 PHE 158 1.000 15.041 10.306 26.622 -99.200 -91.000 TYR 169 0.840 20.006 17.226 31.180 -99.200 -91.000