============================================================================= 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 16.753 50.403 10.800 -99.200 -91.000 PHE 34 1.000 5.530 35.777 20.044 -99.200 -91.000 HIS 50 0.900 5.805 53.255 7.067 -99.200 -91.000 PHE 55 1.000 17.586 50.789 5.191 -99.200 -91.000 TYR 67 0.840 5.510 31.827 20.838 -99.200 -91.000 PHE 95 1.000 15.768 32.160 40.575 -99.200 -91.000 TYR 111 0.840 2.337 27.376 16.267 -99.200 -91.000 PHE 116 1.000 21.933 28.192 14.023 -99.200 -91.000 HIS 130 0.900 15.052 26.789 31.237 -99.200 -91.000 PHE 131 1.000 14.871 27.275 22.809 -99.200 -91.000 HIS 139 0.900 22.694 18.661 23.220 -99.200 -91.000 PHE 154 1.000 40.700 40.211 23.705 -99.200 -91.000 PHE 157 1.000 36.791 47.471 24.591 -99.200 -91.000 HIS 161 0.900 47.988 50.138 22.590 -99.200 -91.000 PHE 162 1.000 48.769 46.824 18.936 -99.200 -91.000 HIS 177 0.900 27.848 38.087 27.324 -99.200 -91.000 PHE 197 1.000 51.826 44.228 17.296 -99.200 -91.000 HIS 214 0.900 37.146 49.254 27.650 -99.200 -91.000 TRP 219 1.040 28.073 43.915 32.267 -99.200 -91.000 TRP6 219 1.020 25.956 43.951 33.325 -99.200 -91.000 TYR 232 0.840 19.794 50.233 21.961 -99.200 -91.000 PHE 233 1.000 22.014 51.670 18.532 -99.200 -91.000 TYR 246 0.840 20.699 27.411 9.877 -99.200 -91.000 PHE 259 1.000 25.884 19.159 24.695 -99.200 -91.000 HIS 263 0.900 36.560 19.891 20.667 -99.200 -91.000 TYR 264 0.840 38.079 24.982 24.065 -99.200 -91.000 TYR 270 0.840 24.024 24.486 24.736 -99.200 -91.000