============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. TYR 10 0.840 45.758 28.133 7.844 -99.200 -91.000 HIS 13 0.900 51.032 28.510 18.709 -99.200 -91.000 TYR 26 0.840 44.753 33.119 3.110 -99.200 -91.000 PHE 30 1.000 37.010 35.063 -2.445 -99.200 -91.000 HIS 31 0.900 36.842 38.873 -9.541 -99.200 -91.000 HIS 34 0.900 27.533 38.136 -1.657 -99.200 -91.000 PHE 56 1.000 42.605 43.784 -4.733 -99.200 -91.000 TRP 60 1.040 43.610 42.240 -11.589 -99.200 -91.000 TRP6 60 1.020 44.117 44.152 -10.288 -99.200 -91.000 PHE 62 1.000 38.105 40.506 -4.641 -99.200 -91.000 TYR 63 0.840 44.980 34.902 -2.625 -99.200 -91.000 HIS 67 0.900 41.877 35.954 12.960 -99.200 -91.000 PHE 70 1.000 41.190 25.675 17.805 -99.200 -91.000 TYR 78 0.840 36.809 23.740 16.714 -99.200 -91.000 HIS 84 0.900 32.647 32.662 -5.377 -99.200 -91.000 TYR 94 0.840 33.560 18.473 8.878 -99.200 -91.000 TRP 95 1.040 42.122 21.760 12.417 -99.200 -91.000 TRP6 95 1.020 42.008 21.322 14.733 -99.200 -91.000