============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. HIS 21 0.900 -5.127 -21.318 -5.489 -99.200 -91.000 PHE 23 1.000 0.312 -23.155 -8.016 -99.200 -91.000 TRP 31 1.040 4.819 -24.044 -12.358 -99.200 -91.000 TRP6 31 1.020 6.289 -22.471 -11.416 -99.200 -91.000 PHE 34 1.000 6.020 -21.486 -0.366 -99.200 -91.000 HIS 46 0.900 -0.598 -8.118 5.193 -99.200 -91.000 PHE 54 1.000 9.336 -16.290 -0.214 -99.200 -91.000 TYR 59 0.840 9.140 -19.423 -3.881 -99.200 -91.000 TYR 68 0.840 -12.202 -8.643 -8.215 -99.200 -91.000 TRP 69 1.040 -12.014 -8.797 -13.546 -99.200 -91.000 TRP6 69 1.020 -12.649 -6.647 -12.865 -99.200 -91.000 PHE 77 1.000 -8.173 -11.289 -23.776 -99.200 -91.000 HIS 78 0.900 -5.825 -10.527 -19.398 -99.200 -91.000 HIS 80 0.900 -4.307 -18.401 -14.732 -99.200 -91.000 PHE 85 1.000 8.404 -13.837 -7.013 -99.200 -91.000 TYR 95 0.840 11.146 -11.463 -2.935 -99.200 -91.000 TYR 104 0.840 -12.112 -7.434 -22.661 -99.200 -91.000 TYR 106 0.840 -2.377 -9.405 -15.966 -99.200 -91.000