============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. HIS 18 0.900 76.438 62.755 28.046 -99.200 -91.000 TRP 21 1.040 66.997 58.934 22.768 -99.200 -91.000 TRP6 21 1.020 64.766 58.163 22.581 -99.200 -91.000 HIS 41 0.900 87.406 58.195 44.728 -99.200 -91.000 TRP 57 1.040 72.500 50.703 18.188 -99.200 -91.000 TRP6 57 1.020 72.096 48.397 18.536 -99.200 -91.000 TYR 72 0.840 90.138 58.225 27.282 -99.200 -91.000 HIS 88 0.900 64.222 50.537 20.917 -99.200 -91.000 PHE 89 1.000 63.428 48.482 29.374 -99.200 -91.000 TYR 91 0.840 63.396 41.597 21.877 -99.200 -91.000 HIS 98 0.900 77.099 40.402 24.041 -99.200 -91.000 TYR 126 0.840 64.387 57.183 45.176 -99.200 -91.000 HIS 134 0.900 73.765 56.782 46.475 -99.200 -91.000 HIS 136 0.900 71.931 54.340 42.167 -99.200 -91.000 TRP 140 1.040 77.183 54.100 38.259 -99.200 -91.000 TRP6 140 1.020 75.523 55.195 36.969 -99.200 -91.000