============================================================================= 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. PHE 30 1.000 65.663 -33.116 83.944 -99.200 -91.000 TRP 35 1.040 61.622 -18.654 88.974 -99.200 -91.000 TRP6 35 1.020 61.420 -17.245 87.084 -99.200 -91.000 TYR 36 0.840 69.187 -18.978 91.195 -99.200 -91.000 PHE 49 1.000 63.788 -25.339 97.268 -99.200 -91.000 HIS 53 0.900 58.654 -27.377 96.647 -99.200 -91.000 PHE 62 1.000 59.766 -12.321 95.944 -99.200 -91.000 HIS 79 0.900 58.835 -3.068 100.389 -99.200 -91.000 TYR 86 0.840 63.164 -10.601 90.862 -99.200 -91.000 PHE 87 1.000 69.722 -12.641 85.756 -99.200 -91.000 HIS 96 0.900 76.215 -29.424 80.444 -99.200 -91.000 PHE 99 1.000 71.920 -19.202 86.081 -99.200 -91.000 PHE 120 1.000 74.442 15.101 69.165 -99.200 -91.000 PHE 141 1.000 65.979 5.041 79.064 -99.200 -91.000 TYR 142 0.840 60.535 4.971 86.554 -99.200 -91.000 TRP 150 1.040 72.541 1.906 66.010 -99.200 -91.000 TRP6 150 1.020 72.962 4.200 65.612 -99.200 -91.000 TYR 174 0.840 66.732 3.733 85.262 -99.200 -91.000 TYR 179 0.840 78.797 5.690 71.923 -99.200 -91.000 TRP 187 1.040 78.933 9.928 57.027 -99.200 -91.000 TRP6 187 1.020 76.808 10.024 58.084 -99.200 -91.000 HIS 190 0.900 74.649 1.938 53.174 -99.200 -91.000 TYR 193 0.840 74.633 5.052 57.673 -99.200 -91.000 HIS 199 0.900 60.349 3.482 77.994 -99.200 -91.000