============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. HIS 34 0.900 3.513 -2.809 -6.929 -99.200 -91.000 HIS 38 0.900 -1.263 -7.146 -21.229 -99.200 -91.000 PHE 45 1.000 12.362 2.350 -7.038 -99.200 -91.000 HIS 46 0.900 8.492 7.931 1.010 -99.200 -91.000 HIS 74 0.900 13.060 2.936 -17.411 -99.200 -91.000 HIS 82 0.900 30.332 5.126 -8.707 -99.200 -91.000 TYR 83 0.840 22.609 1.281 -12.235 -99.200 -91.000 TYR 84 0.840 28.806 -2.627 -8.974 -99.200 -91.000 TYR 94 0.840 32.397 -3.975 0.056 -99.200 -91.000 HIS 96 0.900 33.836 -3.076 -10.614 -99.200 -91.000 PHE 108 1.000 32.702 1.129 0.142 -99.200 -91.000 TYR 110 0.840 24.602 -3.718 1.416 -99.200 -91.000 PHE 140 1.000 24.418 -12.690 13.370 -99.200 -91.000 TRP 143 1.040 20.722 2.695 13.947 -99.200 -91.000 TRP6 143 1.020 19.908 4.031 12.140 -99.200 -91.000 TYR 175 0.840 17.312 19.086 -3.659 -99.200 -91.000