============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. TYR 33 0.840 44.216 83.660 9.027 -99.200 -91.000 PHE 39 1.000 36.862 81.446 3.404 -99.200 -91.000 TYR 78 0.840 27.137 94.404 -12.213 -99.200 -91.000 HIS 85 0.900 25.800 93.326 -27.385 -99.200 -91.000 TYR 102 0.840 33.563 95.239 -19.239 -99.200 -91.000 PHE 124 1.000 38.066 73.254 -17.053 -99.200 -91.000 PHE 133 1.000 34.370 75.238 -9.213 -99.200 -91.000 HIS 170 0.900 52.125 73.320 -19.397 -99.200 -91.000 TRP 183 1.040 39.055 87.166 -22.546 -99.200 -91.000 TRP6 183 1.020 38.306 84.955 -22.960 -99.200 -91.000 TRP 202 1.040 55.419 94.069 -7.716 -99.200 -91.000 TRP6 202 1.020 54.959 92.541 -5.964 -99.200 -91.000 TYR 213 0.840 24.776 85.491 5.568 -99.200 -91.000 TRP 223 1.040 53.307 87.318 -14.762 -99.200 -91.000 TRP6 223 1.020 50.962 87.340 -15.066 -99.200 -91.000 TYR 235 0.840 37.724 82.582 -2.382 -99.200 -91.000 PHE 236 1.000 36.102 89.989 5.486 -99.200 -91.000