============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. TYR 5 0.840 -7.857 6.996 20.784 -99.200 -91.000 TYR 6 0.840 -0.944 7.802 28.951 -99.200 -91.000 PHE 12 1.000 5.222 12.861 18.090 -99.200 -91.000 HIS 13 0.900 4.575 13.932 24.528 -99.200 -91.000 PHE 16 1.000 9.585 11.703 16.267 -99.200 -91.000 HIS 17 0.900 15.367 12.974 21.849 -99.200 -91.000 HIS 18 0.900 7.754 16.586 21.343 -99.200 -91.000 TRP 38 1.040 1.807 24.177 20.945 -99.200 -91.000 TRP6 38 1.020 3.327 22.972 22.305 -99.200 -91.000 PHE 47 1.000 -14.884 22.215 15.211 -99.200 -91.000 HIS 49 0.900 -9.813 28.820 7.528 -99.200 -91.000 PHE 58 1.000 -11.718 32.027 11.137 -99.200 -91.000 PHE 65 1.000 -12.698 30.181 21.860 -99.200 -91.000 TYR 81 0.840 -6.308 31.682 41.367 -99.200 -91.000 TYR 101 0.840 -18.074 12.535 28.169 -99.200 -91.000 PHE 102 1.000 -17.671 19.675 27.067 -99.200 -91.000 PHE 106 1.000 -12.930 12.942 16.392 -99.200 -91.000 PHE 117 1.000 -4.176 8.631 18.327 -99.200 -91.000 PHE 135 1.000 15.110 16.255 17.978 -99.200 -91.000 TRP 147 1.040 6.339 12.654 7.229 -99.200 -91.000 TRP6 147 1.020 4.793 14.443 7.235 -99.200 -91.000