============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 30 rings ring int. center anis. iso. PHE 29 1.000 -6.373 8.561 10.940 -99.200 -91.000 TYR 32 0.840 -3.884 6.548 18.940 -99.200 -91.000 TRP 33 1.040 -7.231 14.146 20.703 -99.200 -91.000 TRP6 33 1.020 -6.462 15.289 22.607 -99.200 -91.000 TRP 36 1.040 -1.274 17.911 8.797 -99.200 -91.000 TRP6 36 1.020 0.049 16.624 7.327 -99.200 -91.000 TRP 47 1.040 -0.167 22.105 16.951 -99.200 -91.000 TRP6 47 1.020 -1.679 23.896 17.202 -99.200 -91.000 TYR 58 0.840 -14.620 13.441 12.452 -99.200 -91.000 TYR 61 0.840 -9.097 22.678 18.973 -99.200 -91.000 TYR 62 0.840 -7.136 25.130 11.280 -99.200 -91.000 PHE 70 1.000 -1.214 26.001 6.163 -99.200 -91.000 TYR 82 0.840 -7.262 13.448 3.157 -99.200 -91.000 TYR 95 0.840 4.036 22.208 5.772 -99.200 -91.000 TYR 96 0.840 8.874 16.122 10.330 -99.200 -91.000 PHE 98 1.000 3.533 15.637 17.967 -99.200 -91.000 TYR 103 0.840 2.741 6.451 18.314 -99.200 -91.000 TRP 104 1.040 7.392 13.502 16.339 -99.200 -91.000 TRP6 104 1.020 7.309 15.748 15.610 -99.200 -91.000 TYR 123 0.840 27.235 15.625 -14.424 -99.200 -91.000 TYR 140 0.840 19.122 18.967 -6.177 -99.200 -91.000 PHE 141 1.000 13.870 25.675 -6.615 -99.200 -91.000 TRP 149 1.040 26.377 5.917 -2.549 -99.200 -91.000 TRP6 149 1.020 27.651 6.092 -4.477 -99.200 -91.000 HIS 159 0.900 30.733 11.242 4.108 -99.200 -91.000 PHE 161 1.000 30.235 15.369 1.741 -99.200 -91.000 TYR 170 0.840 18.445 23.853 -3.248 -99.200 -91.000 TRP 183 1.040 34.274 0.601 -8.425 -99.200 -91.000 TRP6 183 1.020 36.064 1.991 -9.053 -99.200 -91.000 HIS 194 0.900 14.262 17.176 -8.200 -99.200 -91.000