============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. HIS 12 0.900 10.651 18.924 11.813 -99.200 -91.000 PHE 14 1.000 12.179 17.101 15.828 -99.200 -91.000 PHE 25 1.000 22.786 2.643 15.914 -99.200 -91.000 TYR 29 0.840 31.001 0.852 31.556 -99.200 -91.000 TYR 36 0.840 27.151 -5.455 22.450 -99.200 -91.000 PHE 54 1.000 26.901 -1.749 32.346 -99.200 -91.000 TYR 70 0.840 10.954 19.487 20.827 -99.200 -91.000 TYR 79 0.840 15.828 2.192 25.287 -99.200 -91.000 TYR 93 0.840 23.121 -0.252 36.377 -99.200 -91.000 PHE 99 1.000 18.161 9.699 20.025 -99.200 -91.000 PHE 119 1.000 21.664 11.189 33.102 -99.200 -91.000 PHE 120 1.000 23.928 5.314 26.832 -99.200 -91.000 TRP 122 1.040 23.156 9.126 17.528 -99.200 -91.000 TRP6 122 1.020 22.488 6.871 17.561 -99.200 -91.000 HIS 123 0.900 25.686 16.285 20.135 -99.200 -91.000