============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. HIS 8 0.900 58.756 22.514 30.871 -99.200 -91.000 PHE 10 1.000 63.870 22.427 21.328 -99.200 -91.000 TYR 23 0.840 47.369 24.967 11.359 -99.200 -91.000 PHE 25 1.000 53.070 24.296 22.073 -99.200 -91.000 PHE 26 1.000 54.519 24.897 17.081 -99.200 -91.000 PHE 42 1.000 59.819 23.116 6.052 -99.200 -91.000 TYR 53 0.840 69.161 34.484 -3.299 -99.200 -91.000 TYR 76 0.840 78.586 28.918 5.196 -99.200 -91.000 TYR 81 0.840 65.768 25.093 6.923 -99.200 -91.000 PHE 84 1.000 63.726 20.784 3.052 -99.200 -91.000