============================================================================= 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 13.623 48.679 24.195 -99.200 -91.000 TRP6 35 1.020 14.132 50.019 22.318 -99.200 -91.000 TYR 36 0.840 10.386 41.381 22.034 -99.200 -91.000 TYR 49 0.840 9.846 41.643 31.942 -99.200 -91.000 PHE 62 1.000 22.056 43.644 25.030 -99.200 -91.000 PHE 71 1.000 8.496 53.652 26.416 -99.200 -91.000 PHE 83 1.000 28.579 45.581 16.237 -99.200 -91.000 TYR 86 0.840 19.605 45.331 19.257 -99.200 -91.000 TYR 87 0.840 12.477 44.114 14.348 -99.200 -91.000 TYR 91 0.840 4.059 44.844 27.586 -99.200 -91.000 TRP 94 1.040 -8.066 44.429 27.891 -99.200 -91.000 TRP6 94 1.020 -6.828 42.456 27.504 -99.200 -91.000 TYR 97 0.840 -0.819 43.728 23.688 -99.200 -91.000 PHE 99 1.000 6.273 42.870 17.695 -99.200 -91.000 PHE 117 1.000 36.294 42.167 -9.819 -99.200 -91.000 PHE 119 1.000 31.814 38.530 -13.167 -99.200 -91.000 PHE 140 1.000 30.103 47.947 -1.322 -99.200 -91.000 TYR 141 0.840 31.365 50.731 7.055 -99.200 -91.000 TRP 149 1.040 23.338 47.933 -14.532 -99.200 -91.000 TRP6 149 1.020 24.771 46.323 -15.500 -99.200 -91.000 TYR 174 0.840 27.417 46.517 4.801 -99.200 -91.000 TYR 187 0.840 24.074 41.006 -24.933 -99.200 -91.000 HIS 190 0.900 21.456 48.816 -27.553 -99.200 -91.000 TYR 193 0.840 25.239 45.432 -23.651 -99.200 -91.000 HIS 199 0.900 32.030 53.180 -1.149 -99.200 -91.000 PHE 210 1.000 30.087 43.016 -22.264 -99.200 -91.000