============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TYR 21 0.840 12.381 42.933 82.033 -99.200 -91.000 PHE 34 1.000 19.058 60.213 72.819 -99.200 -91.000 HIS 50 0.900 4.387 50.986 85.978 -99.200 -91.000 PHE 55 1.000 12.496 41.985 87.741 -99.200 -91.000 TYR 67 0.840 22.617 62.180 72.264 -99.200 -91.000 PHE 95 1.000 27.470 53.024 52.031 -99.200 -91.000 TYR 111 0.840 25.047 67.121 76.862 -99.200 -91.000 PHE 116 1.000 34.208 49.739 78.512 -99.200 -91.000 HIS 130 0.900 31.962 56.538 61.337 -99.200 -91.000 PHE 131 1.000 31.067 56.518 69.839 -99.200 -91.000 HIS 139 0.900 42.591 53.981 69.265 -99.200 -91.000 PHE 154 1.000 33.342 27.416 68.889 -99.200 -91.000 PHE 157 1.000 24.926 26.962 68.280 -99.200 -91.000 HIS 161 0.900 28.392 16.064 70.098 -99.200 -91.000 PHE 162 1.000 31.551 16.929 73.729 -99.200 -91.000 HIS 177 0.900 28.609 39.599 65.356 -99.200 -91.000 PHE 197 1.000 35.291 15.715 75.395 -99.200 -91.000 HIS 214 0.900 23.514 25.831 65.128 -99.200 -91.000 TRP 219 1.040 23.690 36.692 60.627 -99.200 -91.000 TRP6 219 1.020 22.245 38.255 59.547 -99.200 -91.000 TYR 232 0.840 14.032 40.660 70.960 -99.200 -91.000 PHE 233 1.000 13.896 37.874 74.409 -99.200 -91.000 TYR 246 0.840 34.228 51.153 82.881 -99.200 -91.000 PHE 259 1.000 43.641 50.766 67.551 -99.200 -91.000 HIS 263 0.900 48.488 41.695 72.080 -99.200 -91.000 TYR 264 0.840 44.968 37.341 68.687 -99.200 -91.000 TYR 270 0.840 38.313 49.837 68.052 -99.200 -91.000