============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. TRP 7 1.040 53.630 25.639 15.204 -99.200 -91.000 TRP6 7 1.020 52.735 25.327 13.072 -99.200 -91.000 TRP 14 1.040 56.922 28.806 3.684 -99.200 -91.000 TRP6 14 1.020 56.309 26.794 2.574 -99.200 -91.000 HIS 24 0.900 61.615 26.875 -3.049 -99.200 -91.000 PHE 33 1.000 49.579 20.128 -12.388 -99.200 -91.000 HIS 36 0.900 50.176 11.714 -6.858 -99.200 -91.000 PHE 43 1.000 45.531 23.323 -11.068 -99.200 -91.000 PHE 46 1.000 47.909 25.807 -14.926 -99.200 -91.000 HIS 48 0.900 47.933 24.909 -22.174 -99.200 -91.000 HIS 64 0.900 47.349 27.844 -9.051 -99.200 -91.000 HIS 81 0.900 46.635 29.863 18.001 -99.200 -91.000 HIS 82 0.900 45.753 26.514 10.577 -99.200 -91.000 HIS 93 0.900 41.590 25.500 -2.926 -99.200 -91.000 HIS 97 0.900 39.407 26.651 -7.058 -99.200 -91.000 TYR 103 0.840 42.812 14.876 -6.987 -99.200 -91.000 PHE 106 1.000 47.152 11.888 -4.814 -99.200 -91.000 HIS 119 0.900 65.667 24.733 -0.161 -99.200 -91.000 PHE 123 1.000 62.173 18.907 4.498 -99.200 -91.000 PHE 138 1.000 46.639 23.194 3.795 -99.200 -91.000 TYR 146 0.840 37.748 20.451 1.550 -99.200 -91.000 PHE 151 1.000 34.452 18.885 -1.796 -99.200 -91.000