============================================================================= 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. TYR 8 0.840 55.755 9.863 -19.357 -99.200 -91.000 TYR 11 0.840 58.362 13.602 -14.347 -99.200 -91.000 PHE 28 1.000 44.857 -0.371 2.287 -99.200 -91.000 PHE 40 1.000 45.785 -11.233 -1.569 -99.200 -91.000 PHE 85 1.000 48.892 4.245 -8.679 -99.200 -91.000 TYR 99 0.840 41.762 -13.669 -9.320 -99.200 -91.000 PHE 100 1.000 37.806 -6.800 -8.292 -99.200 -91.000 HIS 120 0.900 29.636 -3.501 -0.466 -99.200 -91.000 PHE 121 1.000 33.451 -3.047 -7.861 -99.200 -91.000 HIS 125 0.900 27.879 3.840 -9.710 -99.200 -91.000 HIS 130 0.900 28.326 9.016 -3.506 -99.200 -91.000 PHE 143 1.000 36.100 -2.644 6.028 -99.200 -91.000 HIS 146 0.900 29.995 -8.897 3.615 -99.200 -91.000