============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. HIS 10 0.900 27.356 32.455 65.677 -99.200 -91.000 TYR 17 0.840 18.337 34.954 56.426 -99.200 -91.000 TYR 58 0.840 4.757 40.092 62.161 -99.200 -91.000 HIS 77 0.900 19.390 53.330 73.383 -99.200 -91.000 TYR 88 0.840 16.532 40.903 75.473 -99.200 -91.000 TYR 89 0.840 22.036 43.258 66.468 -99.200 -91.000 TYR 102 0.840 11.758 50.531 66.301 -99.200 -91.000