============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. HIS 14 0.900 66.606 17.374 6.133 -99.200 -91.000 TRP 17 1.040 64.457 15.506 17.277 -99.200 -91.000 TRP6 17 1.020 63.175 15.461 19.269 -99.200 -91.000 HIS 37 0.900 64.101 32.608 -7.355 -99.200 -91.000 TRP 53 1.040 73.410 21.058 20.252 -99.200 -91.000 TRP6 53 1.020 73.502 23.024 21.571 -99.200 -91.000 TYR 68 0.840 77.861 23.963 -0.208 -99.200 -91.000 HIS 84 0.900 65.775 20.584 24.497 -99.200 -91.000 PHE 85 1.000 59.942 26.525 21.816 -99.200 -91.000 TYR 87 0.840 66.680 28.097 29.405 -99.200 -91.000 HIS 94 0.900 75.141 33.666 19.538 -99.200 -91.000 TYR 122 0.840 48.007 28.217 8.504 -99.200 -91.000 HIS 130 0.900 53.743 31.406 1.730 -99.200 -91.000 HIS 132 0.900 55.953 30.636 6.515 -99.200 -91.000 TRP 136 1.040 62.325 30.021 5.056 -99.200 -91.000 TRP6 136 1.020 61.724 28.068 6.247 -99.200 -91.000 TYR 149 0.840 77.383 36.902 -10.108 -99.200 -91.000