============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. TRP 9 1.040 41.678 15.205 7.366 -99.200 -91.000 TRP6 9 1.020 42.389 13.262 8.450 -99.200 -91.000 TYR 10 0.840 45.404 17.063 -0.267 -99.200 -91.000 PHE 17 1.000 37.160 15.862 5.045 -99.200 -91.000 TYR 31 0.840 35.657 15.909 -0.895 -99.200 -91.000 TYR 42 0.840 31.663 21.455 -5.938 -99.200 -91.000 TYR 48 0.840 33.474 15.898 16.130 -99.200 -91.000 TRP 63 1.040 32.426 14.769 4.205 -99.200 -91.000 TRP6 63 1.020 33.912 13.204 5.125 -99.200 -91.000 TRP 67 1.040 28.955 16.096 -5.517 -99.200 -91.000 TRP6 67 1.020 31.137 16.654 -4.882 -99.200 -91.000 TYR 71 0.840 33.133 29.534 -9.781 -99.200 -91.000 HIS 75 0.900 21.301 19.803 -11.802 -99.200 -91.000 TRP 80 1.040 33.075 10.838 1.220 -99.200 -91.000 TRP6 80 1.020 32.298 12.812 0.224 -99.200 -91.000 TYR 84 0.840 40.839 11.262 13.887 -99.200 -91.000 TRP 96 1.040 32.700 7.125 -2.076 -99.200 -91.000 TRP6 96 1.020 31.626 6.848 -4.130 -99.200 -91.000 TRP 108 1.040 16.540 1.630 -12.930 -99.200 -91.000 TRP6 108 1.020 18.473 0.401 -13.423 -99.200 -91.000 HIS 115 0.900 36.443 1.112 -1.429 -99.200 -91.000 PHE 118 1.000 38.639 11.460 2.383 -99.200 -91.000