============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 27 0.840 29.956 23.248 45.569 -99.200 -91.000 TYR 35 0.840 33.926 49.906 37.420 -99.200 -91.000 PHE 49 1.000 25.081 38.781 42.146 -99.200 -91.000 PHE 53 1.000 22.824 34.898 44.665 -99.200 -91.000 PHE 61 1.000 32.976 48.994 41.361 -99.200 -91.000 PHE 78 1.000 33.869 51.172 50.768 -99.200 -91.000 HIS 88 0.900 45.114 49.124 38.902 -99.200 -91.000 PHE 90 1.000 52.429 51.942 37.847 -99.200 -91.000 PHE 111 1.000 40.482 42.403 49.844 -99.200 -91.000 HIS 118 0.900 47.610 42.431 32.485 -99.200 -91.000 PHE 124 1.000 54.912 50.575 30.824 -99.200 -91.000 TYR 144 0.840 48.886 44.189 51.113 -99.200 -91.000 PHE 166 1.000 41.572 37.392 52.887 -99.200 -91.000 PHE 185 1.000 54.001 30.766 47.375 -99.200 -91.000 TYR 196 0.840 32.432 34.224 34.032 -99.200 -91.000