============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 32 rings ring int. center anis. iso. TYR 7 0.840 -37.576 73.440 -32.100 -99.200 -91.000 PHE 11 1.000 -37.877 70.741 -36.806 -99.200 -91.000 PHE 18 1.000 -30.706 68.173 -31.725 -99.200 -91.000 TYR 25 0.840 -18.092 55.033 -16.709 -99.200 -91.000 HIS 30 0.900 -23.251 44.354 -8.731 -99.200 -91.000 PHE 33 1.000 -24.334 36.539 2.795 -99.200 -91.000 PHE 47 1.000 -30.806 59.898 -29.213 -99.200 -91.000 HIS 55 0.900 -31.893 57.944 -42.008 -99.200 -91.000 PHE 57 1.000 -26.298 58.220 -38.902 -99.200 -91.000 HIS 62 0.900 -18.320 44.622 -25.086 -99.200 -91.000 TRP 66 1.040 -16.287 52.026 -20.472 -99.200 -91.000 TRP6 66 1.020 -15.997 54.117 -21.547 -99.200 -91.000 TRP 78 1.040 -11.246 64.244 -24.621 -99.200 -91.000 TRP6 78 1.020 -10.348 65.581 -26.357 -99.200 -91.000 HIS 113 0.900 -11.628 63.182 -31.271 -99.200 -91.000 PHE 116 1.000 -14.288 66.134 -41.528 -99.200 -91.000 PHE 130 1.000 -32.441 64.357 -28.370 -99.200 -91.000 PHE 151 1.000 -31.980 50.762 -33.525 -99.200 -91.000 TYR 154 0.840 -38.240 61.709 -36.376 -99.200 -91.000 TRP 157 1.040 -43.994 57.707 -36.096 -99.200 -91.000 TRP6 157 1.020 -42.866 58.726 -34.278 -99.200 -91.000 TYR 164 0.840 -43.226 71.502 -35.016 -99.200 -91.000 PHE 167 1.000 -36.477 67.250 -32.247 -99.200 -91.000 TYR 198 0.840 -39.701 46.630 -39.931 -99.200 -91.000 HIS 199 0.900 -42.329 50.445 -37.625 -99.200 -91.000 TRP 201 1.040 -41.145 55.460 -31.297 -99.200 -91.000 TRP6 201 1.020 -40.852 55.967 -29.002 -99.200 -91.000 PHE 204 1.000 -50.362 53.851 -30.671 -99.200 -91.000 TRP 209 1.040 -48.702 57.740 -33.873 -99.200 -91.000 TRP6 209 1.020 -47.373 57.408 -31.934 -99.200 -91.000 TYR 223 0.840 -45.598 71.999 -13.111 -99.200 -91.000 TYR 227 0.840 -42.688 71.558 -9.030 -99.200 -91.000