============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. HIS 1 0.900 54.472 27.287 23.047 -99.200 -91.000 HIS 15 0.900 26.354 50.368 22.490 -99.200 -91.000 TYR 24 0.840 27.239 50.416 29.288 -99.200 -91.000 TYR 34 0.840 34.604 38.278 24.007 -99.200 -91.000 PHE 37 1.000 47.663 38.762 27.216 -99.200 -91.000 HIS 53 0.900 53.827 35.741 15.691 -99.200 -91.000 HIS 60 0.900 50.811 42.086 9.689 -99.200 -91.000 PHE 64 1.000 36.542 38.587 11.783 -99.200 -91.000 HIS 66 0.900 32.703 42.889 9.755 -99.200 -91.000 PHE 67 1.000 37.138 43.915 8.596 -99.200 -91.000 PHE 106 1.000 38.673 30.131 35.650 -99.200 -91.000 HIS 107 0.900 44.631 24.854 38.811 -99.200 -91.000 TYR 119 0.840 43.655 44.586 28.432 -99.200 -91.000 PHE 122 1.000 46.783 42.259 21.860 -99.200 -91.000 HIS 124 0.900 52.227 51.639 23.252 -99.200 -91.000 PHE 125 1.000 53.978 46.313 21.649 -99.200 -91.000 TRP 155 1.040 25.514 52.401 12.095 -99.200 -91.000 TRP6 155 1.020 26.606 54.049 10.796 -99.200 -91.000 TYR 158 0.840 33.726 52.694 8.775 -99.200 -91.000 PHE 167 1.000 44.121 42.740 33.596 -99.200 -91.000 PHE 175 1.000 29.494 41.541 18.955 -99.200 -91.000 PHE 181 1.000 33.797 33.917 8.810 -99.200 -91.000 HIS 183 0.900 37.507 33.280 11.778 -99.200 -91.000 PHE 185 1.000 42.752 33.043 14.101 -99.200 -91.000