============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. HIS 8 0.900 -54.135 35.071 35.400 -99.200 -91.000 TYR 27 0.840 -52.000 47.217 29.472 -99.200 -91.000 PHE 65 1.000 -54.963 43.750 33.183 -99.200 -91.000 PHE 73 1.000 -66.822 43.434 21.202 -99.200 -91.000 HIS 79 0.900 -68.482 42.020 25.117 -99.200 -91.000 HIS 101 0.900 -78.304 40.146 29.587 -99.200 -91.000 HIS 118 0.900 -77.303 23.195 42.648 -99.200 -91.000 PHE 129 1.000 -77.757 31.209 42.437 -99.200 -91.000 PHE 131 1.000 -80.429 38.723 36.215 -99.200 -91.000 PHE 143 1.000 -70.081 42.757 30.751 -99.200 -91.000 TYR 149 0.840 -66.468 46.070 16.708 -99.200 -91.000 TYR 210 0.840 -57.574 21.718 43.378 -99.200 -91.000 PHE 227 1.000 -53.331 26.455 30.062 -99.200 -91.000 TYR 234 0.840 -56.550 17.316 41.344 -99.200 -91.000 TYR 242 0.840 -52.535 12.419 44.587 -99.200 -91.000 HIS 273 0.900 -48.172 22.633 52.285 -99.200 -91.000 PHE 281 1.000 -43.982 34.681 32.038 -99.200 -91.000 TYR 287 0.840 -50.947 42.204 29.960 -99.200 -91.000 TRP 290 1.040 -44.246 38.136 42.756 -99.200 -91.000 TRP6 290 1.020 -42.912 37.799 44.666 -99.200 -91.000 TYR 292 0.840 -43.880 36.015 50.143 -99.200 -91.000 TYR 302 0.840 -43.060 44.165 28.012 -99.200 -91.000