============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. PHE 2 1.000 -28.834 -5.221 6.105 -99.200 -91.000 TYR 30 0.840 -21.464 -10.430 25.147 -99.200 -91.000 HIS 31 0.900 -24.297 -9.927 21.044 -99.200 -91.000 HIS 53 0.900 -45.215 -17.940 11.348 -99.200 -91.000 HIS 56 0.900 -40.086 -15.712 14.024 -99.200 -91.000 PHE 92 1.000 -41.307 -9.890 12.376 -99.200 -91.000 TYR 106 0.840 -38.871 -24.944 6.944 -99.200 -91.000 TYR 107 0.840 -41.111 -32.721 5.140 -99.200 -91.000 TYR 116 0.840 -37.238 -15.488 -10.226 -99.200 -91.000 HIS 118 0.900 -40.444 -19.165 -0.134 -99.200 -91.000 PHE 119 1.000 -35.695 -17.198 -0.844 -99.200 -91.000 HIS 125 0.900 -47.008 -10.160 -1.304 -99.200 -91.000 TYR 133 0.840 -29.946 -19.399 7.232 -99.200 -91.000 PHE 180 1.000 -26.850 -10.532 -3.356 -99.200 -91.000 PHE 193 1.000 -18.869 -16.259 2.722 -99.200 -91.000 HIS 199 0.900 -19.428 -7.933 0.778 -99.200 -91.000 HIS 224 0.900 -4.483 -4.530 8.639 -99.200 -91.000 PHE 225 1.000 -8.061 -10.767 4.301 -99.200 -91.000 HIS 239 0.900 -15.116 -19.720 15.031 -99.200 -91.000 PHE 243 1.000 -22.863 -25.162 14.964 -99.200 -91.000 TRP 253 1.040 -23.570 -25.635 29.992 -99.200 -91.000 TRP6 253 1.020 -21.236 -25.261 29.902 -99.200 -91.000 HIS 287 0.900 -7.807 -22.947 21.948 -99.200 -91.000