============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. PHE 6 1.000 28.583 33.555 19.942 -99.200 -91.000 TYR 21 0.840 18.042 30.548 7.705 -99.200 -91.000 PHE 27 1.000 23.222 19.362 20.830 -99.200 -91.000 TYR 44 0.840 16.511 18.441 6.868 -99.200 -91.000 PHE 65 1.000 27.336 27.258 23.343 -99.200 -91.000 HIS 69 0.900 27.932 30.178 7.315 -99.200 -91.000 TYR 72 0.840 19.704 27.150 -0.649 -99.200 -91.000 PHE 78 1.000 16.311 27.644 9.635 -99.200 -91.000 PHE 81 1.000 18.869 22.290 10.848 -99.200 -91.000 HIS 96 0.900 17.122 37.153 9.609 -99.200 -91.000