============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 28 0.840 31.877 61.006 0.440 -99.200 -91.000 HIS 37 0.900 28.643 65.389 0.491 -99.200 -91.000 PHE 42 1.000 23.139 72.830 5.863 -99.200 -91.000 TYR 46 0.840 20.669 76.445 3.468 -99.200 -91.000 TRP 50 1.040 26.866 76.477 7.505 -99.200 -91.000 TRP6 50 1.020 25.001 76.093 8.923 -99.200 -91.000 HIS 51 0.900 33.190 75.464 12.088 -99.200 -91.000 PHE 58 1.000 32.834 64.540 18.022 -99.200 -91.000 TYR 61 0.840 35.663 74.069 15.743 -99.200 -91.000 HIS 64 0.900 36.215 82.115 18.831 -99.200 -91.000 PHE 69 1.000 22.237 74.121 18.218 -99.200 -91.000 TYR 71 0.840 22.546 66.083 19.464 -99.200 -91.000 PHE 72 1.000 20.598 65.839 11.321 -99.200 -91.000 TYR 73 0.840 21.506 60.930 17.862 -99.200 -91.000 PHE 82 1.000 29.667 73.394 15.401 -99.200 -91.000