============================================================================= 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. HIS 25 0.900 15.306 18.093 -45.262 -99.200 -91.000 PHE 29 1.000 19.510 21.016 -49.907 -99.200 -91.000 TYR 33 0.840 23.855 19.548 -59.718 -99.200 -91.000 HIS 58 0.900 26.991 28.833 -55.213 -99.200 -91.000 PHE 59 1.000 22.402 22.538 -53.830 -99.200 -91.000 TRP 71 1.040 17.857 30.017 -38.885 -99.200 -91.000 TRP6 71 1.020 17.392 32.018 -40.043 -99.200 -91.000 PHE 86 1.000 21.231 28.583 -54.391 -99.200 -91.000 PHE 112 1.000 16.049 28.473 -61.061 -99.200 -91.000 TRP 129 1.040 10.648 42.253 -60.739 -99.200 -91.000 TRP6 129 1.020 9.286 43.183 -62.431 -99.200 -91.000 HIS 141 0.900 6.300 43.055 -48.785 -99.200 -91.000 TYR 145 0.840 8.964 40.119 -44.666 -99.200 -91.000 PHE 166 1.000 12.483 44.774 -46.700 -99.200 -91.000 HIS 215 0.900 34.291 36.234 -40.524 -99.200 -91.000 TYR 229 0.840 18.030 56.281 -42.206 -99.200 -91.000 HIS 239 0.900 25.531 60.262 -51.836 -99.200 -91.000