============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. PHE 25 1.000 117.609 31.705 90.091 -99.200 -91.000 HIS 28 0.900 109.062 33.402 87.553 -99.200 -91.000 PHE 35 1.000 95.456 29.136 89.197 -99.200 -91.000 TYR 40 0.840 77.655 29.504 94.010 -99.200 -91.000 TYR 58 0.840 89.591 18.063 81.909 -99.200 -91.000 TYR 66 0.840 78.321 18.062 85.765 -99.200 -91.000 TYR 92 0.840 101.648 1.947 88.316 -99.200 -91.000 TYR 95 0.840 97.694 15.191 84.874 -99.200 -91.000 HIS 109 0.900 80.843 19.459 100.549 -99.200 -91.000 PHE 111 1.000 85.533 16.449 98.732 -99.200 -91.000 TYR 124 0.840 92.141 21.845 110.359 -99.200 -91.000 PHE 133 1.000 107.300 24.840 108.989 -99.200 -91.000 TYR 135 0.840 97.505 19.760 107.987 -99.200 -91.000 TYR 142 0.840 88.604 24.895 112.006 -99.200 -91.000 TYR 184 0.840 87.691 31.854 93.937 -99.200 -91.000