============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. HIS 10 0.900 36.633 19.546 18.238 -99.200 -91.000 TYR 14 0.840 24.857 22.360 20.990 -99.200 -91.000 TRP 35 1.040 16.234 8.650 18.236 -99.200 -91.000 TRP6 35 1.020 14.760 8.321 16.419 -99.200 -91.000 HIS 41 0.900 15.132 23.146 4.178 -99.200 -91.000 HIS 55 0.900 36.392 24.379 14.475 -99.200 -91.000 PHE 73 1.000 11.376 7.221 12.402 -99.200 -91.000 TYR 75 0.840 5.276 17.741 12.505 -99.200 -91.000 TYR 78 0.840 8.466 20.030 4.876 -99.200 -91.000 TYR 101 0.840 37.117 16.027 22.079 -99.200 -91.000 HIS 106 0.900 19.636 16.876 28.230 -99.200 -91.000 TRP 125 1.040 30.723 22.945 9.847 -99.200 -91.000 TRP6 125 1.020 29.326 21.790 11.376 -99.200 -91.000 HIS 129 0.900 29.385 37.919 -0.002 -99.200 -91.000 TRP 134 1.040 30.695 23.097 1.792 -99.200 -91.000 TRP6 134 1.020 29.119 22.438 0.152 -99.200 -91.000 HIS 156 0.900 10.431 43.305 8.718 -99.200 -91.000 TYR 157 0.840 10.556 36.309 5.782 -99.200 -91.000 PHE 159 1.000 -0.196 38.250 6.265 -99.200 -91.000 PHE 194 1.000 16.910 22.103 19.846 -99.200 -91.000 PHE 200 1.000 10.736 30.524 5.936 -99.200 -91.000 TYR 215 0.840 16.558 30.735 13.084 -99.200 -91.000 HIS 221 0.900 6.430 21.970 15.398 -99.200 -91.000 TRP 224 1.040 6.523 13.705 14.779 -99.200 -91.000 TRP6 224 1.020 8.665 14.428 14.086 -99.200 -91.000