============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. TYR 5 0.840 46.332 14.904 -5.935 -99.200 -91.000 TYR 8 0.840 53.319 15.083 -6.350 -99.200 -91.000 PHE 25 1.000 51.044 21.321 -30.940 -99.200 -91.000 PHE 37 1.000 42.056 28.061 -31.713 -99.200 -91.000 PHE 82 1.000 47.970 17.574 -19.238 -99.200 -91.000 TYR 96 0.840 33.736 24.375 -30.426 -99.200 -91.000 PHE 97 1.000 37.689 17.824 -31.095 -99.200 -91.000 HIS 117 0.900 42.939 12.341 -40.328 -99.200 -91.000 PHE 118 1.000 39.169 12.274 -32.904 -99.200 -91.000 HIS 122 0.900 40.911 3.348 -32.928 -99.200 -91.000 HIS 127 0.900 48.373 2.292 -34.639 -99.200 -91.000 PHE 140 1.000 49.858 18.353 -39.997 -99.200 -91.000 HIS 143 0.900 41.971 17.423 -44.934 -99.200 -91.000