============================================================================= 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. TYR 5 0.840 -9.919 -1.556 18.406 -99.200 -91.000 TYR 14 0.840 1.312 -1.599 25.678 -99.200 -91.000 TYR 22 0.840 -4.810 18.940 33.983 -99.200 -91.000 HIS 23 0.900 -4.991 11.466 29.529 -99.200 -91.000 PHE 24 1.000 0.338 15.672 31.801 -99.200 -91.000 TRP 34 1.040 13.397 3.977 35.040 -99.200 -91.000 TRP6 34 1.020 14.132 6.218 34.811 -99.200 -91.000 HIS 40 0.900 3.950 16.664 22.443 -99.200 -91.000 TYR 42 0.840 9.255 19.313 32.241 -99.200 -91.000 PHE 64 1.000 -5.104 6.695 40.690 -99.200 -91.000 HIS 73 0.900 17.380 12.581 22.955 -99.200 -91.000 TYR 76 0.840 11.149 18.472 23.002 -99.200 -91.000 TRP 121 1.040 -7.965 6.850 28.694 -99.200 -91.000 TRP6 121 1.020 -5.893 5.951 29.417 -99.200 -91.000 TYR 131 0.840 -10.223 15.588 24.927 -99.200 -91.000 TYR 152 0.840 2.508 15.849 8.303 -99.200 -91.000 PHE 161 1.000 6.823 5.256 13.532 -99.200 -91.000 TYR 165 0.840 -5.589 3.273 8.202 -99.200 -91.000 TRP 193 1.040 5.342 16.039 14.572 -99.200 -91.000 TRP6 193 1.020 4.950 16.912 12.402 -99.200 -91.000 TYR 206 0.840 2.037 7.979 15.385 -99.200 -91.000 TYR 212 0.840 15.068 8.920 20.096 -99.200 -91.000 TRP 215 1.040 18.744 9.369 26.312 -99.200 -91.000 TRP6 215 1.020 16.395 9.564 26.581 -99.200 -91.000