============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 9 0.840 17.717 20.632 13.410 -99.200 -91.000 PHE 21 1.000 29.836 25.546 13.953 -99.200 -91.000 PHE 31 1.000 22.102 18.552 14.607 -99.200 -91.000 HIS 36 0.900 15.373 29.570 18.804 -99.200 -91.000 PHE 54 1.000 16.712 19.575 19.644 -99.200 -91.000 PHE 59 1.000 14.429 30.121 24.026 -99.200 -91.000 TRP 66 1.040 24.565 17.507 23.680 -99.200 -91.000 TRP6 66 1.020 25.171 15.364 22.965 -99.200 -91.000 PHE 84 1.000 30.477 20.847 0.748 -99.200 -91.000 TYR 108 0.840 29.124 31.269 3.791 -99.200 -91.000 TYR 122 0.840 15.328 35.810 21.350 -99.200 -91.000 TRP 146 1.040 25.882 33.461 13.253 -99.200 -91.000 TRP6 146 1.020 26.055 35.729 12.605 -99.200 -91.000 PHE 180 1.000 28.050 35.017 16.832 -99.200 -91.000 TYR 190 0.840 24.912 21.095 26.783 -99.200 -91.000