============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. HIS 19 0.900 1.966 116.633 21.441 -99.200 -91.000 HIS 23 0.900 3.561 113.295 17.355 -99.200 -91.000 HIS 26 0.900 0.865 113.244 12.296 -99.200 -91.000 TRP 27 1.040 3.948 109.446 14.594 -99.200 -91.000 TRP6 27 1.020 4.832 109.454 16.774 -99.200 -91.000 TYR 28 0.840 1.246 103.121 16.193 -99.200 -91.000 PHE 34 1.000 -1.951 108.595 6.554 -99.200 -91.000 TRP 37 1.040 -10.114 112.864 9.029 -99.200 -91.000 TRP6 37 1.020 -10.931 114.531 10.495 -99.200 -91.000 HIS 38 0.900 0.181 111.921 8.797 -99.200 -91.000 TYR 44 0.840 -8.176 118.274 15.420 -99.200 -91.000 TYR 51 0.840 -6.380 125.650 23.607 -99.200 -91.000 PHE 67 1.000 1.075 118.237 38.236 -99.200 -91.000 PHE 73 1.000 3.961 116.805 31.643 -99.200 -91.000 TYR 86 0.840 1.282 100.778 12.372 -99.200 -91.000 PHE 101 1.000 -9.975 117.341 20.217 -99.200 -91.000 TYR 103 0.840 -10.307 114.729 31.228 -99.200 -91.000 PHE 108 1.000 -9.423 122.934 28.218 -99.200 -91.000 PHE 112 1.000 -16.600 130.442 32.676 -99.200 -91.000 PHE 127 1.000 -8.886 126.533 32.974 -99.200 -91.000 HIS 137 0.900 -10.934 122.089 16.672 -99.200 -91.000 TRP 139 1.040 -20.477 121.139 13.766 -99.200 -91.000 TRP6 139 1.020 -19.357 123.001 12.806 -99.200 -91.000