============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. TYR 15 0.840 30.943 22.660 3.174 -99.200 -91.000 TYR 16 0.840 35.096 19.470 3.310 -99.200 -91.000 PHE 19 1.000 29.176 15.130 4.263 -99.200 -91.000 TRP 24 1.040 21.845 17.337 6.787 -99.200 -91.000 TRP6 24 1.020 23.859 16.246 6.140 -99.200 -91.000 PHE 29 1.000 29.987 26.852 9.089 -99.200 -91.000 HIS 36 0.900 27.244 21.590 -4.646 -99.200 -91.000 PHE 50 1.000 25.921 23.215 -0.876 -99.200 -91.000 PHE 53 1.000 24.587 17.774 -3.497 -99.200 -91.000 TYR 60 0.840 24.336 8.279 -2.978 -99.200 -91.000 TYR 82 0.840 36.501 15.151 0.408 -99.200 -91.000 HIS 85 0.900 36.630 5.570 5.031 -99.200 -91.000 TYR 88 0.840 23.105 3.479 -4.455 -99.200 -91.000 HIS 89 0.900 20.757 5.320 2.742 -99.200 -91.000 TYR 103 0.840 30.062 5.507 -1.383 -99.200 -91.000 PHE 110 1.000 40.922 22.773 -6.198 -99.200 -91.000 PHE 111 1.000 35.254 24.152 -0.180 -99.200 -91.000 TYR 124 0.840 37.034 19.235 -9.803 -99.200 -91.000 TYR 125 0.840 32.471 11.758 -6.828 -99.200 -91.000 TRP 130 1.040 30.434 6.358 -5.532 -99.200 -91.000 TRP6 130 1.020 28.284 6.510 -6.451 -99.200 -91.000