============================================================================= 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 20 0.900 -24.083 140.115 2.878 -99.200 -91.000 HIS 24 0.900 -23.791 142.878 -2.032 -99.200 -91.000 HIS 27 0.900 -20.377 147.434 -2.465 -99.200 -91.000 TRP 28 1.040 -24.573 146.028 -5.378 -99.200 -91.000 TRP6 28 1.020 -26.111 144.246 -5.112 -99.200 -91.000 TYR 29 0.840 -30.265 150.244 -5.725 -99.200 -91.000 PHE 35 1.000 -19.511 154.824 -5.261 -99.200 -91.000 TRP 38 1.040 -18.576 156.901 3.931 -99.200 -91.000 TRP6 38 1.020 -18.396 155.834 6.043 -99.200 -91.000 HIS 39 0.900 -18.943 150.423 -4.119 -99.200 -91.000 TYR 45 0.840 -19.129 149.419 8.210 -99.200 -91.000 TYR 52 0.840 -19.484 140.171 14.396 -99.200 -91.000 PHE 68 1.000 -34.784 130.801 12.198 -99.200 -91.000 PHE 74 1.000 -31.153 133.142 6.237 -99.200 -91.000 TYR 87 0.840 -29.278 153.310 -8.787 -99.200 -91.000 PHE 102 1.000 -23.116 148.444 11.305 -99.200 -91.000 TYR 104 0.840 -32.687 144.290 15.452 -99.200 -91.000 PHE 109 1.000 -24.621 141.151 17.348 -99.200 -91.000 PHE 113 1.000 -22.633 139.904 28.377 -99.200 -91.000 PHE 128 1.000 -25.256 136.514 21.061 -99.200 -91.000 HIS 138 0.900 -17.296 148.720 12.595 -99.200 -91.000 TRP 140 1.040 -16.205 157.251 17.796 -99.200 -91.000 TRP6 140 1.020 -14.106 156.185 17.589 -99.200 -91.000