============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. TRP 8 1.040 2.013 12.246 18.444 -99.200 -91.000 TRP6 8 1.020 3.483 10.911 17.138 -99.200 -91.000 TRP 11 1.040 2.708 -2.015 18.293 -99.200 -91.000 TRP6 11 1.020 4.063 -3.854 18.900 -99.200 -91.000 HIS 20 0.900 19.815 4.562 16.205 -99.200 -91.000 HIS 53 0.900 3.164 13.627 14.814 -99.200 -91.000 TYR 64 0.840 8.076 6.064 5.551 -99.200 -91.000 TYR 73 0.840 10.576 9.668 20.937 -99.200 -91.000 TYR 78 0.840 11.477 16.924 18.579 -99.200 -91.000 TYR 85 0.840 15.826 19.122 18.253 -99.200 -91.000