============================================================================= 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 -52.177 5.591 20.927 -99.200 -91.000 TYR 25 0.840 -39.689 -5.033 6.031 -99.200 -91.000 PHE 26 1.000 -43.961 -7.313 -3.273 -99.200 -91.000 HIS 28 0.900 -35.864 -1.542 1.248 -99.200 -91.000 PHE 32 1.000 -32.343 -6.298 -0.540 -99.200 -91.000 TRP 35 1.040 -29.584 -4.492 -7.484 -99.200 -91.000 TRP6 35 1.020 -29.750 -3.278 -5.454 -99.200 -91.000 TYR 45 0.840 -43.105 -12.651 -1.179 -99.200 -91.000 HIS 46 0.900 -41.291 -16.019 2.777 -99.200 -91.000 HIS 54 0.900 -47.279 -7.750 12.163 -99.200 -91.000 TYR 58 0.840 -52.261 -2.935 14.013 -99.200 -91.000 PHE 64 1.000 -65.485 -6.712 18.309 -99.200 -91.000 TYR 107 0.840 -55.573 5.481 25.591 -99.200 -91.000 HIS 112 0.900 -59.824 -0.913 33.036 -99.200 -91.000 TYR 114 0.840 -57.311 -4.964 30.716 -99.200 -91.000 HIS 130 0.900 -40.956 -8.209 11.103 -99.200 -91.000 TRP 133 1.040 -32.953 -11.346 8.947 -99.200 -91.000 TRP6 133 1.020 -33.167 -9.886 7.103 -99.200 -91.000 TYR 149 0.840 -25.044 -9.193 3.961 -99.200 -91.000