============================================================================= 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 20.289-177.933 -13.456 -99.200 -91.000 PHE 46 1.000 30.934-166.565 -1.119 -99.200 -91.000 PHE 56 1.000 27.938-171.179 5.554 -99.200 -91.000 TYR 59 0.840 30.557-177.401 6.406 -99.200 -91.000 TYR 67 0.840 21.521-185.623 -0.825 -99.200 -91.000 TYR 73 0.840 16.924-186.674 -7.439 -99.200 -91.000 PHE 83 1.000 23.746-179.109 4.366 -99.200 -91.000 TYR 98 0.840 31.190-171.287 9.366 -99.200 -91.000 TYR 107 0.840 14.655-173.781 -14.230 -99.200 -91.000 TYR 115 0.840 14.748-170.972 -1.460 -99.200 -91.000 TYR 119 0.840 24.860-162.471 11.728 -99.200 -91.000 TYR 128 0.840 12.183-157.333 -5.579 -99.200 -91.000 HIS 131 0.900 21.913-161.505 2.945 -99.200 -91.000 TYR 133 0.840 24.674-150.091 5.663 -99.200 -91.000 PHE 136 1.000 18.625-150.028 4.765 -99.200 -91.000 TYR 137 0.840 22.777-147.239 -0.914 -99.200 -91.000 PHE 139 1.000 15.441-155.005 -0.886 -99.200 -91.000 HIS 144 0.900 8.206-147.501 -10.559 -99.200 -91.000 HIS 145 0.900 11.574-149.351 -12.813 -99.200 -91.000 TYR 146 0.840 9.861-159.296 -9.784 -99.200 -91.000 PHE 174 1.000 29.260-151.414 -6.403 -99.200 -91.000 PHE 193 1.000 25.308-155.705 -15.370 -99.200 -91.000