============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. HIS 20 0.900 80.115 46.716 18.554 -99.200 -91.000 PHE 25 1.000 65.830 33.877 10.881 -99.200 -91.000 PHE 27 1.000 62.550 33.387 19.822 -99.200 -91.000 PHE 34 1.000 66.720 42.835 12.801 -99.200 -91.000 TYR 38 0.840 80.976 43.383 25.342 -99.200 -91.000 TYR 45 0.840 68.302 46.199 17.771 -99.200 -91.000 HIS 73 0.900 49.778 55.692 15.319 -99.200 -91.000 TYR 81 0.840 52.220 36.630 19.361 -99.200 -91.000 HIS 82 0.900 53.791 33.902 22.120 -99.200 -91.000 HIS 87 0.900 60.030 47.442 30.683 -99.200 -91.000 TRP 88 1.040 60.004 43.591 24.653 -99.200 -91.000 TRP6 88 1.020 61.413 43.530 22.759 -99.200 -91.000 TYR 110 0.840 71.718 50.190 18.632 -99.200 -91.000 PHE 118 1.000 74.887 45.646 26.167 -99.200 -91.000 HIS 137 0.900 69.066 67.815 9.044 -99.200 -91.000 HIS 138 0.900 61.522 66.182 10.332 -99.200 -91.000