============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 36 rings ring int. center anis. iso. PHE 5 1.000 -38.724 -38.140 -9.474 -99.200 -91.000 TYR 7 0.840 -35.811 -34.151 -1.764 -99.200 -91.000 HIS 34 0.900 -19.705 -12.709 -2.494 -99.200 -91.000 PHE 36 1.000 -21.552 -18.492 -0.155 -99.200 -91.000 TYR 56 0.840 -20.068 -21.946 12.943 -99.200 -91.000 TYR 62 0.840 -20.196 -24.113 7.046 -99.200 -91.000 PHE 63 1.000 -26.419 -18.002 0.477 -99.200 -91.000 TYR 64 0.840 -25.701 -14.959 6.682 -99.200 -91.000 HIS 67 0.900 -35.218 -13.723 11.683 -99.200 -91.000 PHE 69 1.000 -40.710 -12.315 14.629 -99.200 -91.000 PHE 77 1.000 -27.124 -9.795 9.593 -99.200 -91.000 TYR 99 0.840 -42.322 -1.662 -3.207 -99.200 -91.000 PHE 101 1.000 -34.545 -2.876 4.734 -99.200 -91.000 HIS 109 0.900 -24.080 6.717 -0.486 -99.200 -91.000 TYR 114 0.840 -24.991 -13.760 -1.809 -99.200 -91.000 HIS 121 0.900 -49.165 -18.109 -5.412 -99.200 -91.000 HIS 123 0.900 -45.998 -17.329 -11.290 -99.200 -91.000 HIS 133 0.900 -37.911 -0.038 -4.631 -99.200 -91.000 HIS 137 0.900 -34.408 2.982 -5.535 -99.200 -91.000 PHE 142 1.000 -27.168 -14.209 -6.707 -99.200 -91.000 PHE 183 1.000 -54.168 -24.596 -5.674 -99.200 -91.000 TRP 188 1.040 -45.788 -32.265 -6.463 -99.200 -91.000 TRP6 188 1.020 -45.322 -31.153 -8.487 -99.200 -91.000 TRP 195 1.040 -42.246 -28.880 -12.774 -99.200 -91.000 TRP6 195 1.020 -43.794 -28.363 -14.449 -99.200 -91.000 PHE 222 1.000 -33.581 -36.160 -10.009 -99.200 -91.000 PHE 233 1.000 -28.571 -26.812 8.631 -99.200 -91.000 HIS 236 0.900 -28.322 -28.725 14.590 -99.200 -91.000 TYR 248 0.840 -38.001 -34.003 23.834 -99.200 -91.000 TYR 251 0.840 -38.361 -26.374 12.019 -99.200 -91.000 PHE 252 1.000 -41.621 -21.320 16.881 -99.200 -91.000 PHE 255 1.000 -41.889 -29.058 22.739 -99.200 -91.000 HIS 258 0.900 -30.316 -29.457 22.498 -99.200 -91.000 TYR 279 0.840 -21.198 -44.830 -2.387 -99.200 -91.000 TYR 293 0.840 -33.458 -40.523 -12.203 -99.200 -91.000 PHE 301 1.000 -36.330 -43.871 4.474 -99.200 -91.000