============================================================================= 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 7 0.900 135.611 22.555 -11.746 -99.200 -91.000 PHE 14 1.000 135.263 13.849 6.978 -99.200 -91.000 PHE 19 1.000 137.031 3.648 10.002 -99.200 -91.000 TYR 21 0.840 141.647 2.324 11.764 -99.200 -91.000 PHE 35 1.000 135.769 17.609 9.122 -99.200 -91.000 TYR 64 0.840 140.757 1.644 6.663 -99.200 -91.000 TYR 81 0.840 132.807 11.471 -6.886 -99.200 -91.000 HIS 83 0.900 139.867 2.026 -9.264 -99.200 -91.000 TYR 85 0.840 136.627 11.897 -11.598 -99.200 -91.000 HIS 87 0.900 145.524 7.475 -6.314 -99.200 -91.000 PHE 100 1.000 156.219 5.275 -7.297 -99.200 -91.000 TYR 110 0.840 153.602 5.346 -9.937 -99.200 -91.000 HIS 131 0.900 164.011 23.621 -9.874 -99.200 -91.000 PHE 133 1.000 165.926 16.871 -3.620 -99.200 -91.000 TYR 141 0.840 163.633 18.338 -11.830 -99.200 -91.000 TYR 195 0.840 147.650 29.143 4.889 -99.200 -91.000 TYR 201 0.840 141.668 32.224 -4.512 -99.200 -91.000 HIS 211 0.900 156.254 22.273 10.343 -99.200 -91.000 HIS 220 0.900 136.590 27.559 8.657 -99.200 -91.000 PHE 223 1.000 142.728 19.776 20.939 -99.200 -91.000 HIS 235 0.900 146.218 31.591 16.705 -99.200 -91.000 TYR 245 0.840 144.981 26.809 18.398 -99.200 -91.000 TRP 246 1.040 145.300 30.051 26.064 -99.200 -91.000 TRP6 246 1.020 145.747 29.182 28.220 -99.200 -91.000