============================================================================= 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. TYR 5 0.840 37.215 30.982 18.984 -99.200 -91.000 TYR 14 0.840 26.139 30.864 26.345 -99.200 -91.000 TYR 22 0.840 32.074 9.602 33.245 -99.200 -91.000 HIS 23 0.900 32.415 17.442 29.490 -99.200 -91.000 PHE 24 1.000 26.994 13.206 31.424 -99.200 -91.000 TRP 34 1.040 14.030 24.998 35.320 -99.200 -91.000 TRP6 34 1.020 13.338 22.765 35.099 -99.200 -91.000 HIS 40 0.900 23.256 12.952 22.136 -99.200 -91.000 TYR 42 0.840 17.979 9.892 31.885 -99.200 -91.000 PHE 64 1.000 32.551 21.621 40.778 -99.200 -91.000 HIS 73 0.900 9.880 17.042 22.952 -99.200 -91.000 TYR 76 0.840 16.040 11.147 22.622 -99.200 -91.000 TRP 121 1.040 35.379 22.147 28.837 -99.200 -91.000 TRP6 121 1.020 33.342 23.022 29.590 -99.200 -91.000 TYR 131 0.840 37.634 13.458 24.541 -99.200 -91.000 TYR 152 0.840 24.490 14.347 8.100 -99.200 -91.000 PHE 161 1.000 20.514 24.724 13.823 -99.200 -91.000 TYR 164 0.840 33.049 26.459 8.711 -99.200 -91.000 TRP 193 1.040 21.689 13.891 14.274 -99.200 -91.000 TRP6 193 1.020 21.969 13.062 12.085 -99.200 -91.000 TYR 206 0.840 25.217 21.801 15.478 -99.200 -91.000 TYR 212 0.840 12.217 20.800 20.252 -99.200 -91.000 TRP 215 1.040 8.591 19.973 26.519 -99.200 -91.000 TRP6 215 1.020 10.907 19.793 26.774 -99.200 -91.000