============================================================================= 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. PHE 4 1.000 2.102 5.897 26.685 -99.200 -91.000 TYR 18 0.840 7.089 -8.798 37.872 -99.200 -91.000 TYR 24 0.840 14.346 -13.971 30.423 -99.200 -91.000 TYR 25 0.840 15.928 -11.915 39.026 -99.200 -91.000 HIS 31 0.900 13.309 -1.013 32.885 -99.200 -91.000 PHE 67 1.000 3.729 1.995 30.367 -99.200 -91.000 TYR 88 0.840 5.397 3.939 13.921 -99.200 -91.000 PHE 104 1.000 7.066 -1.811 27.179 -99.200 -91.000 PHE 114 1.000 8.157 -11.929 15.385 -99.200 -91.000 TRP 126 1.040 -5.785 -5.971 7.772 -99.200 -91.000 TRP6 126 1.020 -3.760 -4.792 8.154 -99.200 -91.000 TRP 138 1.040 5.101 -12.380 20.897 -99.200 -91.000 TRP6 138 1.020 3.325 -11.782 19.440 -99.200 -91.000 TYR 139 0.840 -0.376 -18.064 19.481 -99.200 -91.000 PHE 153 1.000 0.208 -6.395 14.659 -99.200 -91.000 TRP 158 1.040 -8.113 0.465 20.701 -99.200 -91.000 TRP6 158 1.020 -5.868 -0.199 21.119 -99.200 -91.000 TYR 161 0.840 -5.066 -5.327 24.443 -99.200 -91.000