============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. HIS 41 0.900 20.382-177.842 -13.670 -99.200 -91.000 PHE 46 1.000 31.025-166.469 -1.083 -99.200 -91.000 PHE 56 1.000 28.053-171.161 5.564 -99.200 -91.000 TYR 59 0.840 30.591-177.418 6.268 -99.200 -91.000 TYR 67 0.840 21.513-185.573 -0.973 -99.200 -91.000 TYR 73 0.840 16.922-186.645 -7.559 -99.200 -91.000 PHE 83 1.000 23.718-179.073 4.291 -99.200 -91.000 TYR 98 0.840 31.299-171.280 9.335 -99.200 -91.000 TYR 107 0.840 14.655-173.780 -14.373 -99.200 -91.000 TYR 115 0.840 14.737-170.923 -1.518 -99.200 -91.000 TYR 119 0.840 24.902-162.440 11.646 -99.200 -91.000 TYR 128 0.840 12.201-157.342 -5.648 -99.200 -91.000 HIS 131 0.900 21.926-161.488 2.818 -99.200 -91.000 TYR 133 0.840 24.625-150.089 5.534 -99.200 -91.000 PHE 136 1.000 18.686-150.044 4.672 -99.200 -91.000 TYR 137 0.840 22.655-147.206 -1.011 -99.200 -91.000 PHE 139 1.000 15.378-154.895 -1.054 -99.200 -91.000 HIS 144 0.900 8.223-147.409 -10.493 -99.200 -91.000 HIS 145 0.900 11.511-149.228 -12.794 -99.200 -91.000 TYR 146 0.840 9.856-159.209 -9.755 -99.200 -91.000 PHE 174 1.000 29.318-151.362 -6.436 -99.200 -91.000 PHE 193 1.000 25.259-155.635 -15.514 -99.200 -91.000