============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 3 0.840 31.554 -20.414 22.198 -99.200 -91.000 TRP 21 1.040 31.726 0.095 32.787 -99.200 -91.000 TRP6 21 1.020 33.605 0.697 31.482 -99.200 -91.000 PHE 40 1.000 49.806 4.626 22.677 -99.200 -91.000 TYR 49 0.840 51.615 -3.939 16.668 -99.200 -91.000 PHE 50 1.000 47.755 1.509 19.269 -99.200 -91.000 HIS 68 0.900 42.269 3.724 19.766 -99.200 -91.000 TYR 74 0.840 30.677 5.145 24.560 -99.200 -91.000 PHE 79 1.000 34.584 -6.620 25.090 -99.200 -91.000 HIS 100 0.900 42.033 -5.208 18.808 -99.200 -91.000 PHE 110 1.000 43.091 -7.535 23.380 -99.200 -91.000 PHE 126 1.000 37.210 0.588 42.232 -99.200 -91.000 TYR 130 0.840 37.363 -4.183 42.965 -99.200 -91.000 TRP 134 1.040 38.155 -4.473 35.157 -99.200 -91.000 TRP6 134 1.020 36.985 -3.703 33.250 -99.200 -91.000