============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. HIS 2 0.900 20.270 -32.054 48.508 -99.200 -91.000 HIS 15 0.900 23.248 -19.025 43.789 -99.200 -91.000 TYR 16 0.840 21.442 -12.319 43.055 -99.200 -91.000 PHE 27 1.000 12.392 -15.142 36.439 -99.200 -91.000 PHE 28 1.000 15.704 -11.455 42.836 -99.200 -91.000 HIS 36 0.900 10.083 -6.207 38.371 -99.200 -91.000 TYR 38 0.840 8.533 -10.826 34.057 -99.200 -91.000 TYR 61 0.840 10.272 -9.990 40.536 -99.200 -91.000