============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 10 0.840 -106.562 -52.311 21.117 -99.200 -91.000 TYR 25 0.840 -96.100 -39.729 6.088 -99.200 -91.000 PHE 26 1.000 -93.912 -44.074 -3.193 -99.200 -91.000 HIS 28 0.900 -99.661 -35.917 1.300 -99.200 -91.000 PHE 32 1.000 -94.816 -32.459 -0.510 -99.200 -91.000 TRP 35 1.040 -96.616 -29.615 -7.420 -99.200 -91.000 TRP6 35 1.020 -97.830 -29.836 -5.405 -99.200 -91.000 TYR 45 0.840 -88.546 -43.208 -1.101 -99.200 -91.000 HIS 46 0.900 -85.103 -41.156 2.790 -99.200 -91.000 HIS 54 0.900 -93.398 -47.323 12.257 -99.200 -91.000 TYR 58 0.840 -98.138 -52.280 14.061 -99.200 -91.000 PHE 64 1.000 -94.316 -65.519 18.301 -99.200 -91.000 TYR 107 0.840 -106.418 -55.609 25.731 -99.200 -91.000 HIS 112 0.900 -99.844 -59.864 33.102 -99.200 -91.000 TYR 114 0.840 -95.908 -57.395 30.710 -99.200 -91.000 HIS 130 0.900 -92.952 -41.064 11.209 -99.200 -91.000 TRP 133 1.040 -89.577 -33.009 9.112 -99.200 -91.000 TRP6 133 1.020 -91.063 -33.189 7.292 -99.200 -91.000 TYR 149 0.840 -91.875 -25.072 3.947 -99.200 -91.000