============================================================================= 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 20.555-177.842 -13.649 -99.200 -91.000 PHE 46 1.000 31.240-166.314 -1.132 -99.200 -91.000 PHE 56 1.000 27.888-171.292 5.542 -99.200 -91.000 TYR 59 0.840 30.462-177.459 6.206 -99.200 -91.000 TYR 67 0.840 21.576-185.617 -0.999 -99.200 -91.000 TYR 73 0.840 17.081-186.465 -7.639 -99.200 -91.000 PHE 83 1.000 23.896-179.008 4.252 -99.200 -91.000 TYR 98 0.840 31.446-171.277 9.254 -99.200 -91.000 TYR 107 0.840 14.768-173.872 -14.338 -99.200 -91.000 TYR 115 0.840 14.862-170.989 -1.644 -99.200 -91.000 TYR 119 0.840 24.596-162.435 11.782 -99.200 -91.000 TYR 128 0.840 12.087-157.323 -5.634 -99.200 -91.000 HIS 131 0.900 21.940-161.641 2.766 -99.200 -91.000 TYR 133 0.840 24.338-150.236 5.627 -99.200 -91.000 PHE 136 1.000 18.610-149.853 4.541 -99.200 -91.000 TYR 137 0.840 22.555-147.058 -1.140 -99.200 -91.000 PHE 139 1.000 15.485-154.780 -0.910 -99.200 -91.000 HIS 144 0.900 7.667-147.776 -10.512 -99.200 -91.000 HIS 145 0.900 10.904-149.240 -12.848 -99.200 -91.000 TYR 146 0.840 9.999-159.395 -9.712 -99.200 -91.000 PHE 174 1.000 29.206-151.117 -6.683 -99.200 -91.000 PHE 193 1.000 25.068-155.722 -15.610 -99.200 -91.000