============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. HIS 7 0.900 18.495 2.754 -7.072 -99.200 -91.000 PHE 24 1.000 22.152 -7.786 -5.635 -99.200 -91.000 TYR 28 0.840 17.920 -11.687 -5.198 -99.200 -91.000 HIS 32 0.900 17.157 -15.656 -6.046 -99.200 -91.000 PHE 54 1.000 11.039 12.344 12.638 -99.200 -91.000 PHE 59 1.000 13.273 10.793 19.676 -99.200 -91.000 HIS 60 0.900 3.070 11.926 22.758 -99.200 -91.000 PHE 85 1.000 9.295 -3.856 11.301 -99.200 -91.000 TYR 97 0.840 26.932 13.693 -4.183 -99.200 -91.000 PHE 99 1.000 36.567 14.070 1.887 -99.200 -91.000 TRP 108 1.040 15.340 5.728 3.533 -99.200 -91.000 TRP6 108 1.020 16.619 3.916 4.275 -99.200 -91.000 PHE 119 1.000 15.993 4.257 18.578 -99.200 -91.000 PHE 121 1.000 14.374 5.027 26.158 -99.200 -91.000 TYR 124 0.840 20.213 4.549 23.234 -99.200 -91.000 HIS 142 0.900 43.840 6.957 -4.793 -99.200 -91.000 PHE 144 1.000 38.081 8.527 -0.260 -99.200 -91.000 HIS 155 0.900 34.127 10.229 8.838 -99.200 -91.000 TRP 159 1.040 26.406 7.681 9.458 -99.200 -91.000 TRP6 159 1.020 24.790 7.867 7.784 -99.200 -91.000 PHE 166 1.000 20.736 3.136 17.824 -99.200 -91.000