============================================================================= 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. TYR 5 0.840 50.276 17.349 29.090 -99.200 -91.000 TYR 14 0.840 62.071 16.847 22.795 -99.200 -91.000 TYR 22 0.840 47.439 20.037 3.776 -99.200 -91.000 HIS 23 0.900 52.604 16.254 11.474 -99.200 -91.000 PHE 24 1.000 55.684 13.391 5.812 -99.200 -91.000 TRP 34 1.040 73.092 14.993 10.623 -99.200 -91.000 TRP6 34 1.020 72.884 13.338 8.952 -99.200 -91.000 HIS 40 0.900 56.295 4.443 10.134 -99.200 -91.000 TYR 42 0.840 62.895 8.083 1.584 -99.200 -91.000 PHE 64 1.000 57.767 26.534 7.849 -99.200 -91.000 HIS 73 0.900 69.368 0.212 10.883 -99.200 -91.000 TYR 76 0.840 61.306 0.224 7.363 -99.200 -91.000 TRP 121 1.040 51.705 19.270 15.970 -99.200 -91.000 TRP6 121 1.020 54.036 19.060 15.620 -99.200 -91.000 TYR 131 0.840 43.959 13.116 12.442 -99.200 -91.000 TYR 152 0.840 50.864 -4.621 20.042 -99.200 -91.000 PHE 161 1.000 60.674 2.075 24.191 -99.200 -91.000 TYR 165 0.840 49.474 5.382 31.349 -99.200 -91.000 TRP 192 1.040 55.155 -1.532 15.672 -99.200 -91.000 TRP6 192 1.020 53.974 -3.427 16.451 -99.200 -91.000 TYR 205 0.840 55.968 4.508 21.681 -99.200 -91.000 TYR 211 0.840 68.122 0.930 15.853 -99.200 -91.000 TRP 214 1.040 72.922 3.367 11.200 -99.200 -91.000 TRP6 214 1.020 70.925 4.628 11.053 -99.200 -91.000