============================================================================= 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. PHE 10 1.000 5.488 12.450 -10.451 -99.200 -91.000 HIS 18 0.900 -1.499 11.628 -9.574 -99.200 -91.000 HIS 26 0.900 -5.146 12.231 -1.112 -99.200 -91.000 HIS 33 0.900 4.829 6.664 0.912 -99.200 -91.000 PHE 36 1.000 5.678 0.649 -8.380 -99.200 -91.000 PHE 46 1.000 -8.413 11.662 -5.492 -99.200 -91.000 TYR 48 0.840 -8.599 6.717 -5.492 -99.200 -91.000 TRP 59 1.040 -2.567 1.274 -9.151 -99.200 -91.000 TRP6 59 1.020 -2.830 1.361 -11.501 -99.200 -91.000 TYR 67 0.840 -3.866 4.553 -15.177 -99.200 -91.000 TYR 74 0.840 -5.119 -1.362 -16.638 -99.200 -91.000 PHE 82 1.000 -0.401 11.515 -19.296 -99.200 -91.000 TYR 97 0.840 10.605 10.100 -9.827 -99.200 -91.000