============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 1 0.840 0.831 45.703 57.196 -99.200 -91.000 TYR 18 0.840 -2.730 43.449 37.705 -99.200 -91.000 TYR 28 0.840 -15.629 58.864 34.250 -99.200 -91.000 PHE 30 1.000 -17.543 63.681 41.350 -99.200 -91.000 HIS 32 0.900 -14.324 52.499 45.661 -99.200 -91.000 TYR 34 0.840 -14.010 52.030 50.167 -99.200 -91.000 HIS 36 0.900 -20.154 61.540 47.168 -99.200 -91.000 PHE 38 1.000 -17.095 61.995 53.438 -99.200 -91.000 TYR 43 0.840 -11.408 54.868 53.974 -99.200 -91.000 PHE 53 1.000 -4.540 57.742 52.375 -99.200 -91.000 TYR 59 0.840 -10.448 67.319 52.302 -99.200 -91.000 TRP 65 1.040 -10.769 59.837 41.730 -99.200 -91.000 TRP6 65 1.020 -10.553 61.754 40.375 -99.200 -91.000 PHE 68 1.000 -8.644 59.156 52.838 -99.200 -91.000 HIS 80 0.900 7.534 57.266 44.149 -99.200 -91.000 PHE 83 1.000 7.674 66.584 36.390 -99.200 -91.000 TYR 85 0.840 -0.439 68.710 27.747 -99.200 -91.000 HIS 94 0.900 7.745 51.470 53.309 -99.200 -91.000 HIS 99 0.900 -1.354 55.352 40.907 -99.200 -91.000 HIS 102 0.900 -1.758 61.047 40.662 -99.200 -91.000 PHE 104 1.000 -4.031 66.589 42.907 -99.200 -91.000 TYR 116 0.840 -1.326 62.729 51.233 -99.200 -91.000 PHE 125 1.000 -14.689 52.462 56.460 -99.200 -91.000 TYR 135 0.840 -5.902 46.497 59.851 -99.200 -91.000