============================================================================= 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. TRP 14 1.040 -7.885 -3.200 48.070 -99.200 -91.000 TRP6 14 1.020 -6.627 -1.380 47.222 -99.200 -91.000 HIS 18 0.900 -11.092 -0.429 47.850 -99.200 -91.000 PHE 20 1.000 -15.366 6.119 43.449 -99.200 -91.000 PHE 22 1.000 -6.317 4.069 43.014 -99.200 -91.000 TYR 23 0.840 -9.326 -3.626 39.222 -99.200 -91.000 TRP 39 1.040 -2.435 -9.662 46.161 -99.200 -91.000 TRP6 39 1.020 -3.782 -8.327 47.587 -99.200 -91.000 TRP 51 1.040 -1.834 9.928 32.129 -99.200 -91.000 TRP6 51 1.020 -0.854 7.890 31.444 -99.200 -91.000 TYR 56 0.840 -4.772 4.253 32.513 -99.200 -91.000 TYR 62 0.840 2.341 -8.368 47.238 -99.200 -91.000 TYR 66 0.840 5.072 -7.886 50.874 -99.200 -91.000 PHE 75 1.000 0.856 0.828 34.646 -99.200 -91.000 PHE 79 1.000 0.123 1.769 30.895 -99.200 -91.000 TYR 80 0.840 3.614 6.590 24.724 -99.200 -91.000 HIS 81 0.900 4.653 7.026 32.977 -99.200 -91.000 TYR 85 0.840 12.987 -0.908 33.039 -99.200 -91.000 TRP 101 1.040 10.434 -2.728 50.213 -99.200 -91.000 TRP6 101 1.020 8.085 -2.627 49.896 -99.200 -91.000 TRP 132 1.040 13.446 10.628 28.413 -99.200 -91.000 TRP6 132 1.020 12.506 12.064 30.053 -99.200 -91.000 PHE 135 1.000 7.275 14.292 30.026 -99.200 -91.000 TYR 142 0.840 3.813 11.548 27.276 -99.200 -91.000 TYR 153 0.840 -5.121 -0.358 29.101 -99.200 -91.000