============================================================================= 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. TYR 3 0.840 10.999 30.235 14.358 -99.200 -91.000 TRP 21 1.040 -3.635 16.071 22.816 -99.200 -91.000 TRP6 21 1.020 -3.320 14.436 21.123 -99.200 -91.000 PHE 40 1.000 -2.468 2.578 6.460 -99.200 -91.000 TYR 49 0.840 4.762 7.176 0.589 -99.200 -91.000 PHE 50 1.000 2.492 4.420 6.653 -99.200 -91.000 HIS 68 0.900 3.297 4.844 12.230 -99.200 -91.000 TYR 74 0.840 2.555 8.810 23.994 -99.200 -91.000 PHE 79 1.000 4.142 18.019 16.080 -99.200 -91.000 TYR 96 0.840 8.169 14.433 16.479 -99.200 -91.000 HIS 100 0.900 7.158 12.048 8.957 -99.200 -91.000 PHE 110 1.000 2.954 15.341 7.735 -99.200 -91.000 PHE 126 1.000 -13.904 17.665 20.225 -99.200 -91.000 TYR 130 0.840 -13.513 22.194 18.415 -99.200 -91.000 TRP 134 1.040 -6.801 19.109 15.718 -99.200 -91.000 TRP6 134 1.020 -4.901 17.973 16.563 -99.200 -91.000