============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. PHE 3 1.000 35.883 6.938 146.097 -99.200 -91.000 HIS 6 0.900 30.765 11.099 138.427 -99.200 -91.000 TYR 27 0.840 21.685 -2.585 136.350 -99.200 -91.000 TYR 45 0.840 35.483 -3.700 136.044 -99.200 -91.000 PHE 77 1.000 28.158 -3.608 142.568 -99.200 -91.000 HIS 82 0.900 32.412 -11.176 138.612 -99.200 -91.000 PHE 85 1.000 29.201 -13.122 132.865 -99.200 -91.000 PHE 117 1.000 47.223 -21.914 141.643 -99.200 -91.000 PHE 133 1.000 52.790 -24.176 139.547 -99.200 -91.000 PHE 136 1.000 46.133 -24.068 138.475 -99.200 -91.000 TYR 141 0.840 42.513 -25.799 135.964 -99.200 -91.000 TYR 161 0.840 42.703 -5.018 146.869 -99.200 -91.000 TYR 176 0.840 20.892 -12.028 140.519 -99.200 -91.000