============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. TYR 25 0.840 11.793 15.175 -15.223 -99.200 -91.000 TYR 28 0.840 19.954 12.853 -17.311 -99.200 -91.000 TYR 29 0.840 19.763 15.864 -6.536 -99.200 -91.000 PHE 38 1.000 29.642 7.904 -4.768 -99.200 -91.000 HIS 57 0.900 34.289 3.844 -13.839 -99.200 -91.000 TYR 70 0.840 18.473 3.350 -0.865 -99.200 -91.000 HIS 73 0.900 19.417 -0.830 -3.213 -99.200 -91.000 TYR 78 0.840 15.320 4.993 -14.052 -99.200 -91.000 HIS 84 0.900 19.964 14.662 -22.285 -99.200 -91.000 PHE 92 1.000 25.403 15.334 -14.404 -99.200 -91.000 HIS 93 0.900 24.616 21.532 -15.547 -99.200 -91.000 HIS 99 0.900 22.147 24.751 1.045 -99.200 -91.000 TRP 101 1.040 23.644 13.298 1.840 -99.200 -91.000 TRP6 101 1.020 22.811 12.195 -0.075 -99.200 -91.000