============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. TRP 35 1.040 13.765 48.493 24.281 -99.200 -91.000 TRP6 35 1.020 14.286 49.627 22.273 -99.200 -91.000 TYR 36 0.840 10.583 41.156 22.037 -99.200 -91.000 TYR 49 0.840 10.133 41.556 31.992 -99.200 -91.000 PHE 62 1.000 22.247 43.814 25.279 -99.200 -91.000 PHE 71 1.000 8.469 53.467 26.153 -99.200 -91.000 PHE 83 1.000 28.864 45.518 16.535 -99.200 -91.000 TYR 86 0.840 19.917 45.255 19.482 -99.200 -91.000 TYR 87 0.840 12.747 43.880 14.476 -99.200 -91.000 TYR 91 0.840 4.360 44.581 27.359 -99.200 -91.000 TRP 94 1.040 -7.885 43.814 27.741 -99.200 -91.000 TRP6 94 1.020 -6.561 41.895 27.317 -99.200 -91.000 TYR 97 0.840 -0.604 43.262 23.609 -99.200 -91.000 PHE 99 1.000 6.578 42.639 17.722 -99.200 -91.000 PHE 117 1.000 36.590 42.269 -9.463 -99.200 -91.000 PHE 119 1.000 31.904 38.300 -12.864 -99.200 -91.000 PHE 140 1.000 29.900 48.035 -0.962 -99.200 -91.000 TYR 141 0.840 31.487 50.751 7.259 -99.200 -91.000 TRP 149 1.040 23.177 47.460 -14.424 -99.200 -91.000 TRP6 149 1.020 24.924 46.102 -15.261 -99.200 -91.000 TYR 174 0.840 27.481 46.397 5.040 -99.200 -91.000 TYR 187 0.840 24.116 40.530 -24.503 -99.200 -91.000 HIS 190 0.900 20.869 47.847 -27.050 -99.200 -91.000 TYR 193 0.840 25.084 45.165 -23.283 -99.200 -91.000 HIS 199 0.900 31.822 53.170 -0.964 -99.200 -91.000 PHE 210 1.000 29.823 42.993 -21.491 -99.200 -91.000