============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. PHE 16 1.000 -3.160 -5.437 6.047 -99.200 -91.000 HIS 17 0.900 1.650 0.008 9.024 -99.200 -91.000 TYR 19 0.840 5.424 -7.317 2.891 -99.200 -91.000 PHE 27 1.000 -6.175 1.448 8.375 -99.200 -91.000 HIS 39 0.900 7.280 -15.728 -4.004 -99.200 -91.000 PHE 45 1.000 3.907 -20.642 0.160 -99.200 -91.000 PHE 72 1.000 -5.544 -8.338 10.042 -99.200 -91.000 TYR 75 0.840 -2.239 -10.385 6.375 -99.200 -91.000 PHE 78 1.000 -5.945 -14.557 -0.901 -99.200 -91.000 PHE 89 1.000 -4.594 -29.828 13.487 -99.200 -91.000 PHE 90 1.000 -4.933 -27.234 9.399 -99.200 -91.000