============================================================================= 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. HIS 2 0.900 -7.811 -0.650 -5.292 -99.200 -91.000 TYR 10 0.840 9.954 0.874 2.200 -99.200 -91.000 PHE 12 1.000 13.492 -3.389 3.219 -99.200 -91.000 TYR 27 0.840 17.875 -1.701 12.938 -99.200 -91.000 PHE 30 1.000 21.449 -5.187 8.610 -99.200 -91.000 TYR 44 0.840 24.043 1.530 -10.816 -99.200 -91.000 TYR 53 0.840 26.423 -7.161 -8.185 -99.200 -91.000 TYR 72 0.840 26.684 -5.551 10.196 -99.200 -91.000 PHE 73 1.000 22.709 -9.266 4.107 -99.200 -91.000 HIS 79 0.900 23.917 -19.766 7.878 -99.200 -91.000 PHE 91 1.000 34.402 -12.074 2.994 -99.200 -91.000 TYR 94 0.840 30.098 -16.596 0.496 -99.200 -91.000 HIS 99 0.900 22.388 -17.813 -7.036 -99.200 -91.000 TYR 121 0.840 26.480 -14.455 -18.333 -99.200 -91.000 PHE 125 1.000 23.859 -21.168 -11.430 -99.200 -91.000 PHE 131 1.000 34.588 -20.580 -2.897 -99.200 -91.000 TYR 133 0.840 35.181 -24.822 0.731 -99.200 -91.000