============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. HIS 6 0.900 4.660 -33.453 -6.350 -99.200 -91.000 HIS 25 0.900 -6.248 -23.282 -15.539 -99.200 -91.000 PHE 38 1.000 -14.303 -26.885 0.338 -99.200 -91.000 PHE 43 1.000 -5.424 -19.867 -11.056 -99.200 -91.000 HIS 54 0.900 -11.076 -11.506 -12.594 -99.200 -91.000 PHE 55 1.000 -16.811 -5.713 -11.141 -99.200 -91.000 HIS 56 0.900 -14.132 -13.232 -9.072 -99.200 -91.000 TRP 58 1.040 -16.609 -16.334 -8.965 -99.200 -91.000 TRP6 58 1.020 -14.393 -17.145 -9.214 -99.200 -91.000 HIS 60 0.900 -10.433 -15.213 -6.734 -99.200 -91.000 TYR 63 0.840 0.027 -20.417 2.263 -99.200 -91.000 PHE 89 1.000 -12.632 -12.982 2.317 -99.200 -91.000 HIS 96 0.900 -10.099 -10.310 -7.961 -99.200 -91.000 PHE 98 1.000 -4.019 -12.489 -8.687 -99.200 -91.000 PHE 108 1.000 -1.749 -16.866 -7.798 -99.200 -91.000 PHE 123 1.000 -8.662 -0.663 -15.978 -99.200 -91.000 TYR 129 0.840 -3.703 -10.455 -25.016 -99.200 -91.000 TYR 131 0.840 -4.923 -6.371 -18.915 -99.200 -91.000 TYR 137 0.840 -2.846 -3.003 -15.752 -99.200 -91.000