============================================================================= 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 1 0.900 -11.553 -1.907 22.204 -99.200 -91.000 PHE 9 1.000 -12.396 -7.719 24.322 -99.200 -91.000 HIS 35 0.900 14.792 14.744 11.408 -99.200 -91.000 PHE 36 1.000 11.906 8.360 6.224 -99.200 -91.000 HIS 53 0.900 -2.795 -2.065 25.836 -99.200 -91.000 HIS 54 0.900 -4.649 -2.034 20.127 -99.200 -91.000 TRP 59 1.040 -3.109 -15.019 26.637 -99.200 -91.000 TRP6 59 1.020 -1.693 -14.565 28.486 -99.200 -91.000 TYR 62 0.840 -13.086 -12.809 22.683 -99.200 -91.000 PHE 63 1.000 -8.715 -15.401 22.152 -99.200 -91.000 HIS 67 0.900 -13.064 -18.214 24.265 -99.200 -91.000 PHE 68 1.000 -6.812 -18.639 27.363 -99.200 -91.000 TYR 71 0.840 -9.615 -22.472 19.180 -99.200 -91.000 HIS 75 0.900 -2.864 -19.852 27.987 -99.200 -91.000 TYR 103 0.840 4.215 -16.188 15.163 -99.200 -91.000 PHE 111 1.000 -12.277 -11.616 18.294 -99.200 -91.000 TRP 112 1.040 -13.010 -12.245 13.250 -99.200 -91.000 TRP6 112 1.020 -14.843 -10.980 14.078 -99.200 -91.000