============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 28 rings ring int. center anis. iso. TYR 27 0.840 -4.169 -25.034 14.999 -99.200 -91.000 PHE 29 1.000 -9.223 -27.198 10.643 -99.200 -91.000 TYR 32 0.840 -6.501 -23.720 19.481 -99.200 -91.000 TRP 33 1.040 -14.650 -20.773 18.046 -99.200 -91.000 TRP6 33 1.020 -15.553 -18.919 19.203 -99.200 -91.000 HIS 35 0.900 -11.896 -15.519 14.983 -99.200 -91.000 TRP 36 1.040 -11.868 -17.677 6.907 -99.200 -91.000 TRP6 36 1.020 -10.361 -17.979 5.122 -99.200 -91.000 TRP 47 1.040 -14.160 -11.668 12.974 -99.200 -91.000 TRP6 47 1.020 -16.435 -12.159 13.345 -99.200 -91.000 PHE 60 1.000 -20.686 -16.235 8.011 -99.200 -91.000 PHE 64 1.000 -17.356 -8.928 4.914 -99.200 -91.000 TYR 80 0.840 -11.632 -25.460 1.510 -99.200 -91.000 TYR 93 0.840 -10.912 -11.133 0.969 -99.200 -91.000 TYR 94 0.840 -3.950 -10.760 6.363 -99.200 -91.000 TYR 100 0.840 0.540 -19.142 16.567 -99.200 -91.000 TRP 101 1.040 -3.434 -12.341 12.952 -99.200 -91.000 TRP6 101 1.020 -5.011 -10.988 11.824 -99.200 -91.000 PHE 120 1.000 3.617 5.225 -23.572 -99.200 -91.000 TYR 143 0.840 1.339 -2.499 -14.921 -99.200 -91.000 PHE 144 1.000 -5.807 -7.007 -14.349 -99.200 -91.000 TRP 152 1.040 15.775 2.801 -13.917 -99.200 -91.000 TRP6 152 1.020 15.344 4.289 -15.696 -99.200 -91.000 HIS 162 0.900 13.156 7.329 -4.767 -99.200 -91.000 PHE 164 1.000 7.292 7.464 -7.491 -99.200 -91.000 TYR 174 0.840 -3.270 -2.763 -11.284 -99.200 -91.000 TYR 192 0.840 21.537 7.658 -16.905 -99.200 -91.000 HIS 198 0.900 2.404 -7.252 -17.289 -99.200 -91.000