============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 5 rings ring int. center anis. iso. TRP 18 1.040 -8.287 -15.100 41.325 -99.200 -91.000 TRP6 18 1.020 -9.446 -14.181 39.477 -99.200 -91.000 TYR 34 0.840 -5.251 0.807 35.331 -99.200 -91.000 TYR 35 0.840 -11.898 1.182 41.163 -99.200 -91.000 HIS 38 0.900 -4.257 4.339 37.118 -99.200 -91.000