============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. HIS 21 0.900 87.451 -3.150 -29.882 -99.200 -91.000 TYR 29 0.840 82.990 -8.202 -20.236 -99.200 -91.000 TYR 31 0.840 78.079 -7.155 -24.667 -99.200 -91.000 TRP 32 1.040 81.031 -8.123 -33.081 -99.200 -91.000 TRP6 32 1.020 81.282 -6.989 -35.140 -99.200 -91.000 TYR 33 0.840 72.887 -7.256 -29.049 -99.200 -91.000 HIS 37 0.900 64.735 -6.944 -45.004 -99.200 -91.000 TYR 43 0.840 74.445 -12.480 -27.662 -99.200 -91.000 HIS 46 0.900 78.938 -11.936 -24.183 -99.200 -91.000 HIS 74 0.900 80.536 -22.949 -44.395 -99.200 -91.000 TYR 83 0.840 75.793 -8.967 -39.765 -99.200 -91.000 TYR 84 0.840 73.202 -1.792 -35.784 -99.200 -91.000 PHE 98 1.000 71.434 -1.300 -31.080 -99.200 -91.000 TYR 118 0.840 62.158 -11.213 -70.450 -99.200 -91.000 PHE 133 1.000 68.597 -4.962 -66.361 -99.200 -91.000 PHE 136 1.000 70.012 -7.137 -62.781 -99.200 -91.000 TYR 151 0.840 56.607 6.918 -60.041 -99.200 -91.000 PHE 165 1.000 67.116 -19.021 -61.762 -99.200 -91.000 TRP 173 1.040 55.233 2.278 -61.603 -99.200 -91.000 TRP6 173 1.020 56.644 1.484 -59.878 -99.200 -91.000 PHE 179 1.000 58.604 3.588 -68.805 -99.200 -91.000 PHE 185 1.000 65.054 -1.133 -66.299 -99.200 -91.000 PHE 195 1.000 65.252 -11.670 -75.790 -99.200 -91.000 PHE 196 1.000 66.727 -3.857 -74.276 -99.200 -91.000