============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. HIS 3 0.900 22.761 5.452 -12.290 -99.200 -91.000 PHE 19 1.000 10.976 1.770 -4.138 -99.200 -91.000 PHE 23 1.000 23.230 -2.828 -5.692 -99.200 -91.000 PHE 34 1.000 14.488 6.393 -5.507 -99.200 -91.000 HIS 41 0.900 3.596 1.769 -5.872 -99.200 -91.000 TRP 50 1.040 19.369 8.855 4.910 -99.200 -91.000 TRP6 50 1.020 18.790 8.072 2.772 -99.200 -91.000 PHE 61 1.000 2.323 8.385 0.314 -99.200 -91.000 PHE 67 1.000 20.716 9.220 -2.319 -99.200 -91.000 TYR 75 0.840 23.312 7.121 1.016 -99.200 -91.000 HIS 82 0.900 2.151 -0.251 -1.967 -99.200 -91.000 TYR 83 0.840 10.421 -1.081 5.031 -99.200 -91.000 TYR 105 0.840 16.268 -2.022 9.049 -99.200 -91.000