============================================================================= 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 47.101-112.106 -7.912 -99.200 -91.000 PHE 46 1.000 36.620-125.321 2.599 -99.200 -91.000 PHE 56 1.000 40.181-122.027 9.998 -99.200 -91.000 TYR 59 0.840 37.799-116.093 11.775 -99.200 -91.000 TYR 67 0.840 46.480-106.678 5.971 -99.200 -91.000 TYR 73 0.840 50.797-104.602 -0.384 -99.200 -91.000 PHE 83 1.000 44.041-114.138 10.064 -99.200 -91.000 TYR 98 0.840 36.789-122.694 13.690 -99.200 -91.000 TYR 107 0.840 52.876-115.747 -9.370 -99.200 -91.000 TYR 115 0.840 52.928-121.020 2.676 -99.200 -91.000 TYR 119 0.840 43.360-131.646 14.460 -99.200 -91.000 TYR 128 0.840 55.613-133.682 -3.957 -99.200 -91.000 HIS 131 0.900 45.942-131.132 5.358 -99.200 -91.000 TYR 133 0.840 42.736-142.434 5.917 -99.200 -91.000 PHE 136 1.000 48.886-142.891 5.036 -99.200 -91.000 TYR 137 0.840 45.579-144.793 -1.372 -99.200 -91.000 PHE 139 1.000 52.312-136.529 0.775 -99.200 -91.000 HIS 144 0.900 59.154-142.811 -10.039 -99.200 -91.000 HIS 145 0.900 55.661-140.734 -12.005 -99.200 -91.000 TYR 146 0.840 57.485-131.232 -7.789 -99.200 -91.000 PHE 174 1.000 38.314-139.459 -5.738 -99.200 -91.000 PHE 193 1.000 42.178-133.261 -13.705 -99.200 -91.000