============================================================================= 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. PHE 31 1.000 -54.345 -34.056 -9.545 -99.200 -91.000 HIS 39 0.900 -37.341 -29.328 -0.226 -99.200 -91.000 TYR 53 0.840 -48.066 -36.831 2.823 -99.200 -91.000 PHE 58 1.000 -48.105 -29.684 1.838 -99.200 -91.000 TYR 96 0.840 -39.597 -11.135 21.259 -99.200 -91.000 PHE 98 1.000 -38.896 -7.177 27.041 -99.200 -91.000 HIS 123 0.900 -33.734 -4.559 24.217 -99.200 -91.000 PHE 157 1.000 -40.580 -1.108 46.745 -99.200 -91.000 HIS 171 0.900 -47.796 -5.416 27.287 -99.200 -91.000 TYR 182 0.840 -41.365 -3.584 62.092 -99.200 -91.000 TRP 195 1.040 -54.063 -4.788 82.471 -99.200 -91.000 TRP6 195 1.020 -55.540 -5.356 80.722 -99.200 -91.000 TRP 197 1.040 -58.153 -7.352 85.609 -99.200 -91.000 TRP6 197 1.020 -55.859 -7.868 85.456 -99.200 -91.000 TRP 210 1.040 -47.630 -4.551 67.565 -99.200 -91.000 TRP6 210 1.020 -48.750 -2.572 66.945 -99.200 -91.000 PHE 225 1.000 -45.683 -10.930 91.989 -99.200 -91.000 TYR 243 0.840 -47.146 -6.472 87.457 -99.200 -91.000