============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. PHE 3 1.000 27.563 33.366 29.301 -99.200 -91.000 TRP 13 1.040 32.129 15.794 41.279 -99.200 -91.000 TRP6 13 1.020 33.050 15.603 39.111 -99.200 -91.000 HIS 15 0.900 36.424 7.097 40.857 -99.200 -91.000 PHE 40 1.000 45.722 4.483 35.052 -99.200 -91.000 TYR 43 0.840 46.751 11.632 38.053 -99.200 -91.000 PHE 71 1.000 48.274 17.708 49.026 -99.200 -91.000 PHE 94 1.000 49.092 8.486 33.825 -99.200 -91.000 PHE 109 1.000 37.881 27.676 40.899 -99.200 -91.000 HIS 116 0.900 48.382 16.454 56.154 -99.200 -91.000 PHE 132 1.000 47.099 32.483 47.888 -99.200 -91.000 PHE 141 1.000 56.468 21.198 49.147 -99.200 -91.000 PHE 143 1.000 58.804 19.182 43.397 -99.200 -91.000 PHE 145 1.000 57.391 13.562 39.045 -99.200 -91.000 TYR 158 0.840 55.517 27.094 32.472 -99.200 -91.000 HIS 168 0.900 67.695 26.862 45.704 -99.200 -91.000 HIS 217 0.900 40.379 37.957 45.691 -99.200 -91.000 TYR 250 0.840 38.190 51.762 40.036 -99.200 -91.000 PHE 253 1.000 39.116 51.921 47.431 -99.200 -91.000 HIS 254 0.900 35.491 57.508 45.071 -99.200 -91.000 PHE 257 1.000 39.415 56.643 50.923 -99.200 -91.000 TRP 265 1.040 35.349 43.425 48.624 -99.200 -91.000 TRP6 265 1.020 36.131 45.364 47.526 -99.200 -91.000