============================================================================= 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 6 1.000 -2.315 29.886 46.210 -99.200 -91.000 HIS 17 0.900 10.170 11.291 43.410 -99.200 -91.000 PHE 28 1.000 -3.903 22.491 33.402 -99.200 -91.000 PHE 34 1.000 -15.342 27.846 38.442 -99.200 -91.000 HIS 43 0.900 -17.735 32.924 47.506 -99.200 -91.000 PHE 75 1.000 -10.711 20.573 39.308 -99.200 -91.000 PHE 103 1.000 -20.169 18.115 39.020 -99.200 -91.000 PHE 105 1.000 -22.994 21.209 43.415 -99.200 -91.000 TYR 138 0.840 -6.014 27.031 27.286 -99.200 -91.000 HIS 139 0.900 -3.108 22.649 20.369 -99.200 -91.000 TYR 148 0.840 -8.948 11.103 25.426 -99.200 -91.000 PHE 150 1.000 -2.779 10.622 24.769 -99.200 -91.000 PHE 151 1.000 3.380 19.213 23.861 -99.200 -91.000