============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. HIS 1 0.900 9.278 -4.934 15.241 -99.200 -91.000 HIS 2 0.900 12.968 -8.173 5.956 -99.200 -91.000 TYR 6 0.840 12.387 -0.373 -3.723 -99.200 -91.000 TYR 40 0.840 3.196 -19.987 -22.771 -99.200 -91.000 TRP 43 1.040 6.385 -19.673 -12.685 -99.200 -91.000 TRP6 43 1.020 7.930 -17.914 -13.073 -99.200 -91.000 PHE 47 1.000 1.660 -16.401 -19.615 -99.200 -91.000 TYR 65 0.840 6.499 -18.042 -8.014 -99.200 -91.000 HIS 69 0.900 0.112 -13.363 -16.151 -99.200 -91.000 PHE 75 1.000 5.283 4.841 -22.838 -99.200 -91.000 TYR 78 0.840 -1.793 3.176 -24.448 -99.200 -91.000 TYR 91 0.840 6.101 -0.157 -12.653 -99.200 -91.000 TYR 116 0.840 3.853 -3.909 -24.767 -99.200 -91.000 HIS 129 0.900 5.419 6.463 -13.659 -99.200 -91.000 PHE 131 1.000 13.194 3.118 -7.006 -99.200 -91.000 TYR 144 0.840 14.984 -11.016 -10.770 -99.200 -91.000 TRP 150 1.040 19.027 0.144 -19.417 -99.200 -91.000 TRP6 150 1.020 16.680 0.081 -19.564 -99.200 -91.000