============================================================================= 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. PHE 12 1.000 -3.780 25.380 27.459 -99.200 -91.000 PHE 16 1.000 -6.034 19.968 26.131 -99.200 -91.000 HIS 18 0.900 -1.051 20.463 15.818 -99.200 -91.000 PHE 20 1.000 -4.887 15.795 23.263 -99.200 -91.000 TYR 38 0.840 -12.183 34.177 20.970 -99.200 -91.000 TYR 49 0.840 0.363 35.752 22.201 -99.200 -91.000 TYR 67 0.840 15.988 27.553 32.511 -99.200 -91.000 TRP 71 1.040 7.362 13.299 35.761 -99.200 -91.000 TRP6 71 1.020 7.636 11.028 35.159 -99.200 -91.000 TYR 89 0.840 4.924 34.327 20.995 -99.200 -91.000 PHE 93 1.000 10.370 35.180 20.229 -99.200 -91.000 TYR 113 0.840 -8.683 25.054 30.527 -99.200 -91.000 PHE 121 1.000 6.192 21.210 36.080 -99.200 -91.000 HIS 133 0.900 17.517 31.844 28.194 -99.200 -91.000 PHE 139 1.000 14.146 40.942 33.936 -99.200 -91.000