============================================================================= 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 37.111 30.606 18.391 -99.200 -91.000 TYR 14 0.840 25.902 30.693 25.632 -99.200 -91.000 TYR 22 0.840 32.104 10.205 34.085 -99.200 -91.000 HIS 23 0.900 32.237 17.626 29.549 -99.200 -91.000 PHE 24 1.000 26.933 13.387 31.757 -99.200 -91.000 TRP 34 1.040 13.768 25.104 35.021 -99.200 -91.000 TRP6 34 1.020 13.076 22.860 34.796 -99.200 -91.000 HIS 40 0.900 23.279 12.595 22.479 -99.200 -91.000 TYR 42 0.840 17.985 9.688 32.206 -99.200 -91.000 PHE 64 1.000 32.268 22.478 40.713 -99.200 -91.000 HIS 73 0.900 9.843 16.437 23.051 -99.200 -91.000 TYR 76 0.840 16.109 10.557 23.032 -99.200 -91.000 TRP 121 1.040 35.183 22.199 28.660 -99.200 -91.000 TRP6 121 1.020 33.131 23.137 29.360 -99.200 -91.000 TYR 131 0.840 37.487 13.286 24.746 -99.200 -91.000 TYR 152 0.840 24.644 13.176 8.339 -99.200 -91.000 PHE 161 1.000 20.376 23.761 13.524 -99.200 -91.000 TYR 165 0.840 32.808 25.708 8.338 -99.200 -91.000 TRP 192 1.040 21.867 12.984 14.567 -99.200 -91.000 TRP6 192 1.020 22.244 12.105 12.414 -99.200 -91.000 TYR 205 0.840 25.116 21.076 15.367 -99.200 -91.000 TYR 211 0.840 12.124 20.069 20.130 -99.200 -91.000 TRP 214 1.040 8.451 19.702 26.331 -99.200 -91.000 TRP6 214 1.020 10.782 19.515 26.600 -99.200 -91.000