============================================================================= 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 20.800 52.310 13.955 -99.200 -91.000 TYR 14 0.840 8.522 53.801 19.288 -99.200 -91.000 TYR 22 0.840 7.121 72.604 6.254 -99.200 -91.000 HIS 23 0.900 9.487 65.353 9.744 -99.200 -91.000 PHE 24 1.000 5.150 70.638 12.300 -99.200 -91.000 TRP 34 1.040 -5.662 60.886 22.995 -99.200 -91.000 TRP6 34 1.020 -5.730 63.226 23.310 -99.200 -91.000 HIS 40 0.900 10.313 72.439 20.266 -99.200 -91.000 TYR 42 0.840 -0.673 75.222 18.414 -99.200 -91.000 PHE 64 1.000 -0.035 60.550 4.360 -99.200 -91.000 HIS 73 0.900 2.482 70.939 31.586 -99.200 -91.000 TYR 76 0.840 6.448 75.650 25.415 -99.200 -91.000 TRP 121 1.040 11.553 60.335 8.541 -99.200 -91.000 TRP6 121 1.020 9.766 59.768 9.980 -99.200 -91.000 TYR 131 0.840 16.750 68.899 7.052 -99.200 -91.000 TYR 152 0.840 23.145 72.207 26.766 -99.200 -91.000 PHE 161 1.000 15.919 62.486 29.108 -99.200 -91.000 TYR 165 0.840 27.321 58.012 22.598 -99.200 -91.000 TRP 193 1.040 16.437 72.651 25.429 -99.200 -91.000 TRP6 193 1.020 18.478 73.585 26.184 -99.200 -91.000 TYR 206 0.840 17.111 64.068 23.771 -99.200 -91.000 TYR 212 0.840 6.041 66.948 32.023 -99.200 -91.000 TRP 215 1.040 -0.870 67.512 31.988 -99.200 -91.000 TRP6 215 1.020 0.014 67.445 29.794 -99.200 -91.000