============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. HIS 10 0.900 47.844 66.149 50.400 -99.200 -91.000 TYR 14 0.840 36.097 65.615 46.099 -99.200 -91.000 TRP 35 1.040 32.375 49.274 46.515 -99.200 -91.000 TRP6 35 1.020 32.094 48.021 44.527 -99.200 -91.000 HIS 41 0.900 36.890 57.353 28.547 -99.200 -91.000 HIS 55 0.900 48.757 68.959 45.214 -99.200 -91.000 PHE 73 1.000 31.928 44.671 40.337 -99.200 -91.000 TYR 75 0.840 25.060 51.851 32.854 -99.200 -91.000 TYR 78 0.840 31.379 52.650 27.500 -99.200 -91.000 TYR 101 0.840 45.859 64.723 55.673 -99.200 -91.000 HIS 106 0.900 28.418 62.053 52.050 -99.200 -91.000 TRP 125 1.040 47.101 64.602 39.701 -99.200 -91.000 TRP6 125 1.020 45.216 63.591 40.710 -99.200 -91.000 HIS 129 0.900 46.474 77.529 26.104 -99.200 -91.000 TRP 134 1.040 51.784 62.866 32.169 -99.200 -91.000 TRP6 134 1.020 52.753 62.364 34.267 -99.200 -91.000 HIS 156 0.900 27.806 75.255 21.471 -99.200 -91.000 TYR 157 0.840 30.331 68.257 21.664 -99.200 -91.000 PHE 159 1.000 20.492 67.521 17.552 -99.200 -91.000 PHE 193 1.000 30.063 61.909 41.800 -99.200 -91.000 PHE 199 1.000 31.508 62.883 24.662 -99.200 -91.000 TYR 214 0.840 32.058 67.249 32.765 -99.200 -91.000 HIS 221 0.900 23.835 56.777 33.989 -99.200 -91.000 TRP 224 1.040 25.668 49.556 37.427 -99.200 -91.000 TRP6 224 1.020 27.666 50.802 37.278 -99.200 -91.000