============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TRP 15 1.040 -39.031 24.797 -15.511 -99.200 -91.000 TRP6 15 1.020 -38.472 26.764 -16.705 -99.200 -91.000 PHE 21 1.000 -25.626 16.908 -15.915 -99.200 -91.000 TYR 22 0.840 -21.977 19.648 -7.653 -99.200 -91.000 TRP 29 1.040 -22.156 22.070 -17.564 -99.200 -91.000 TRP6 29 1.020 -20.162 22.023 -16.297 -99.200 -91.000 PHE 32 1.000 -32.386 24.883 -17.503 -99.200 -91.000 PHE 41 1.000 -47.018 29.907 -28.566 -99.200 -91.000 TRP 42 1.040 -49.240 25.932 -25.706 -99.200 -91.000 TRP6 42 1.020 -50.628 26.609 -27.499 -99.200 -91.000 HIS 44 0.900 -44.973 35.007 -21.696 -99.200 -91.000 TYR 72 0.840 -43.585 38.826 -12.196 -99.200 -91.000 PHE 74 1.000 -39.497 37.115 -7.198 -99.200 -91.000 TYR 100 0.840 -44.817 25.879 -6.736 -99.200 -91.000 PHE 125 1.000 -47.320 7.944 -1.175 -99.200 -91.000 TYR 126 0.840 -44.028 10.024 2.514 -99.200 -91.000 PHE 134 1.000 -51.566 10.806 -14.696 -99.200 -91.000 PHE 144 1.000 -43.581 25.792 -17.052 -99.200 -91.000 PHE 147 1.000 -48.883 23.035 -13.217 -99.200 -91.000 PHE 159 1.000 -50.840 22.031 -33.632 -99.200 -91.000