============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. HIS 6 0.900 8.554 -52.839 -12.551 -99.200 -91.000 PHE 12 1.000 12.700 -53.255 0.484 -99.200 -91.000 PHE 27 1.000 8.993 -46.946 -0.336 -99.200 -91.000 TRP 28 1.040 4.141 -47.652 -7.855 -99.200 -91.000 TRP6 28 1.020 2.486 -47.775 -9.531 -99.200 -91.000 TRP 31 1.040 -4.169 -44.965 -3.807 -99.200 -91.000 TRP6 31 1.020 -3.161 -43.312 -2.427 -99.200 -91.000 TYR 49 0.840 21.972 -39.622 -12.014 -99.200 -91.000 TYR 70 0.840 12.849 -49.669 5.174 -99.200 -91.000 PHE 81 1.000 16.431 -48.865 1.031 -99.200 -91.000 PHE 102 1.000 18.065 -37.802 -2.911 -99.200 -91.000