============================================================================= 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. TRP 24 1.040 29.812 36.683 15.835 -99.200 -91.000 TRP6 24 1.020 27.722 35.878 16.561 -99.200 -91.000 PHE 31 1.000 32.612 47.678 19.158 -99.200 -91.000 TYR 33 0.840 23.708 48.275 12.577 -99.200 -91.000 PHE 34 1.000 26.169 47.625 20.883 -99.200 -91.000 TRP 57 1.040 29.563 45.374 34.298 -99.200 -91.000 TRP6 57 1.020 29.595 47.600 33.486 -99.200 -91.000 PHE 58 1.000 30.871 41.563 36.529 -99.200 -91.000 HIS 87 0.900 27.505 55.523 33.616 -99.200 -91.000 PHE 88 1.000 21.919 55.937 36.970 -99.200 -91.000 TRP 113 1.040 19.663 52.328 21.440 -99.200 -91.000 TRP6 113 1.020 19.270 51.257 19.372 -99.200 -91.000 TYR 121 0.840 19.009 40.631 23.317 -99.200 -91.000 HIS 127 0.900 8.095 47.789 28.772 -99.200 -91.000 HIS 130 0.900 7.994 51.997 17.748 -99.200 -91.000 PHE 134 1.000 17.277 49.333 15.069 -99.200 -91.000 PHE 142 1.000 30.284 31.539 13.403 -99.200 -91.000 PHE 147 1.000 21.557 28.307 21.701 -99.200 -91.000 PHE 148 1.000 16.821 37.728 19.586 -99.200 -91.000 TYR 156 0.840 8.596 42.450 18.167 -99.200 -91.000 TYR 162 0.840 14.232 52.347 10.921 -99.200 -91.000 TYR 177 0.840 27.910 41.694 9.055 -99.200 -91.000 PHE 179 1.000 24.380 45.839 9.570 -99.200 -91.000 TYR 182 0.840 12.638 40.929 12.459 -99.200 -91.000