============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. TYR 6 0.840 39.181 27.417 0.662 -99.200 -91.000 TYR 12 0.840 38.932 16.162 4.969 -99.200 -91.000 TYR 13 0.840 44.218 19.321 -1.637 -99.200 -91.000 HIS 19 0.900 31.843 22.308 -4.426 -99.200 -91.000 PHE 55 1.000 26.714 30.227 -0.802 -99.200 -91.000 TYR 76 0.840 14.068 22.717 6.869 -99.200 -91.000 PHE 92 1.000 27.585 25.217 2.389 -99.200 -91.000 PHE 102 1.000 25.831 17.437 16.156 -99.200 -91.000 TRP 114 1.040 13.700 27.629 21.599 -99.200 -91.000 TRP6 114 1.020 13.660 26.277 19.646 -99.200 -91.000 TRP 126 1.040 29.613 22.314 14.496 -99.200 -91.000 TRP6 126 1.020 27.680 23.117 15.586 -99.200 -91.000 TYR 127 0.840 31.333 25.287 21.683 -99.200 -91.000 PHE 141 1.000 19.955 25.004 15.467 -99.200 -91.000 TRP 146 1.040 18.468 36.315 10.468 -99.200 -91.000 TRP6 146 1.020 19.387 34.339 9.605 -99.200 -91.000 TYR 149 0.840 25.459 34.097 11.597 -99.200 -91.000 PHE 155 1.000 21.077 30.877 -1.091 -99.200 -91.000