============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. HIS 28 0.900 -18.787 -9.770 137.853 -99.200 -91.000 TYR 34 0.840 -20.973 -5.012 138.308 -99.200 -91.000 TRP 37 1.040 -17.009 7.502 134.366 -99.200 -91.000 TRP6 37 1.020 -15.004 8.032 133.220 -99.200 -91.000 TYR 38 0.840 -14.772 5.824 142.297 -99.200 -91.000 TYR 51 0.840 -24.281 3.103 141.076 -99.200 -91.000 PHE 57 1.000 -23.105 7.584 146.010 -99.200 -91.000 PHE 64 1.000 -20.338 15.844 137.594 -99.200 -91.000 PHE 73 1.000 -17.242 1.279 129.268 -99.200 -91.000 TYR 88 0.840 -13.873 15.042 137.107 -99.200 -91.000 TYR 89 0.840 -7.779 9.416 140.029 -99.200 -91.000 PHE 91 1.000 -12.927 0.265 140.452 -99.200 -91.000 HIS 95 0.900 -13.090 -8.359 132.806 -99.200 -91.000 PHE 98 1.000 -12.415 -6.081 141.623 -99.200 -91.000 PHE 100 1.000 -9.451 3.282 141.472 -99.200 -91.000 PHE 118 1.000 2.123 40.078 150.096 -99.200 -91.000 PHE 120 1.000 5.607 36.275 154.147 -99.200 -91.000 PHE 141 1.000 0.515 32.441 140.454 -99.200 -91.000 TYR 142 0.840 -6.052 30.498 135.144 -99.200 -91.000 TRP 150 1.040 14.938 33.013 145.534 -99.200 -91.000 TRP6 150 1.020 13.986 34.541 147.070 -99.200 -91.000 TYR 175 0.840 -3.263 27.126 139.276 -99.200 -91.000 TYR 188 0.840 19.576 37.127 156.510 -99.200 -91.000 HIS 191 0.900 25.286 38.301 150.452 -99.200 -91.000 TYR 194 0.840 19.558 38.135 151.248 -99.200 -91.000 HIS 200 0.900 0.866 35.323 136.023 -99.200 -91.000 PHE 211 1.000 15.323 41.114 153.880 -99.200 -91.000