============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. PHE 24 1.000 92.936 33.216 92.391 -99.200 -91.000 PHE 25 1.000 92.800 30.383 96.734 -99.200 -91.000 PHE 27 1.000 84.633 37.255 92.100 -99.200 -91.000 TYR 34 0.840 79.987 28.567 82.828 -99.200 -91.000 TYR 39 0.840 76.651 23.285 92.136 -99.200 -91.000 PHE 44 1.000 77.916 28.394 87.780 -99.200 -91.000 TYR 50 0.840 89.584 39.626 90.431 -99.200 -91.000 TYR 65 0.840 81.117 23.797 100.846 -99.200 -91.000 TRP 76 1.040 92.354 28.226 109.053 -99.200 -91.000 TRP6 76 1.020 91.132 26.568 107.892 -99.200 -91.000 TYR 78 0.840 96.007 38.631 110.622 -99.200 -91.000 TRP 101 1.040 90.747 22.529 87.980 -99.200 -91.000 TRP6 101 1.020 91.299 24.088 86.289 -99.200 -91.000 PHE 103 1.000 93.704 27.237 92.213 -99.200 -91.000 PHE 138 1.000 95.430 25.413 74.823 -99.200 -91.000 PHE 148 1.000 82.323 21.694 95.033 -99.200 -91.000 TYR 153 0.840 96.294 18.971 100.782 -99.200 -91.000 TRP 164 1.040 85.817 24.358 108.239 -99.200 -91.000 TRP6 164 1.020 86.917 24.605 106.155 -99.200 -91.000 PHE 171 1.000 97.247 10.121 97.824 -99.200 -91.000 PHE 183 1.000 96.827 35.941 93.097 -99.200 -91.000 HIS 188 0.900 98.964 35.731 102.209 -99.200 -91.000 TYR 196 0.840 95.810 17.202 81.359 -99.200 -91.000