============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TYR 38 0.840 -3.017 7.611 65.596 -99.200 -91.000 TRP 41 1.040 3.487 11.912 53.775 -99.200 -91.000 TRP6 41 1.020 2.545 13.203 52.001 -99.200 -91.000 TYR 42 0.840 0.981 3.930 52.716 -99.200 -91.000 TYR 55 0.840 6.101 4.365 60.966 -99.200 -91.000 TRP 56 1.040 3.074 6.634 64.698 -99.200 -91.000 TRP6 56 1.020 4.809 5.339 65.664 -99.200 -91.000 PHE 68 1.000 11.806 9.409 49.007 -99.200 -91.000 PHE 77 1.000 -0.634 15.801 58.847 -99.200 -91.000 TYR 92 0.840 6.342 10.201 45.830 -99.200 -91.000 TYR 93 0.840 -2.024 7.315 45.614 -99.200 -91.000 TYR 98 0.840 -8.134 11.241 65.082 -99.200 -91.000 PHE 103 1.000 -4.713 4.598 51.025 -99.200 -91.000 PHE 123 1.000 9.799 -3.508 14.719 -99.200 -91.000 PHE 140 1.000 7.781 -1.452 19.328 -99.200 -91.000 PHE 144 1.000 8.874 10.117 22.849 -99.200 -91.000 TYR 145 0.840 11.697 15.423 29.174 -99.200 -91.000 TRP 153 1.040 0.909 4.895 11.363 -99.200 -91.000 TRP6 153 1.020 2.512 3.174 10.970 -99.200 -91.000 TRP 166 1.040 2.880 9.048 24.348 -99.200 -91.000 TRP6 166 1.020 1.072 9.197 22.836 -99.200 -91.000 TYR 176 0.840 7.555 11.058 29.400 -99.200 -91.000 TYR 189 0.840 0.901 -5.241 4.180 -99.200 -91.000 HIS 192 0.900 -2.723 1.488 -1.135 -99.200 -91.000 TYR 195 0.840 1.866 -0.380 3.819 -99.200 -91.000 HIS 201 0.900 10.693 14.844 20.849 -99.200 -91.000 PHE 212 1.000 6.594 -2.245 5.823 -99.200 -91.000