============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. TYR 23 0.840 20.629 13.840 11.319 -99.200 -91.000 PHE 24 1.000 27.199 18.043 5.847 -99.200 -91.000 PHE 28 1.000 27.493 27.605 9.138 -99.200 -91.000 TRP 31 1.040 22.672 20.977 5.793 -99.200 -91.000 TRP6 31 1.020 21.620 22.422 4.243 -99.200 -91.000 HIS 39 0.900 6.747 26.132 -1.747 -99.200 -91.000 TRP 47 1.040 17.798 13.843 4.647 -99.200 -91.000 TRP6 47 1.020 17.864 12.557 2.661 -99.200 -91.000 TRP 57 1.040 16.602 4.595 3.394 -99.200 -91.000 TRP6 57 1.020 15.722 5.112 5.525 -99.200 -91.000 PHE 62 1.000 2.138 9.464 4.336 -99.200 -91.000 TYR 84 0.840 19.558 20.660 -9.549 -99.200 -91.000 PHE 88 1.000 11.470 11.460 -6.772 -99.200 -91.000 HIS 97 0.900 9.713 -4.185 11.159 -99.200 -91.000 TRP 99 1.040 10.722 -0.606 4.131 -99.200 -91.000 TRP6 99 1.020 9.711 1.522 4.219 -99.200 -91.000 PHE 102 1.000 4.294 4.107 -7.985 -99.200 -91.000 PHE 103 1.000 8.115 -3.055 -9.733 -99.200 -91.000 PHE 111 1.000 8.081 8.322 -9.251 -99.200 -91.000 PHE 118 1.000 14.870 28.774 -9.043 -99.200 -91.000 TYR 133 0.840 6.165 2.992 8.432 -99.200 -91.000 HIS 137 0.900 14.567 4.260 -1.577 -99.200 -91.000 TRP 141 1.040 24.141 13.651 -5.981 -99.200 -91.000 TRP6 141 1.020 24.021 11.275 -5.884 -99.200 -91.000 HIS 143 0.900 26.619 21.969 -8.044 -99.200 -91.000