============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. PHE 6 1.000 98.818 207.579 137.232 -99.200 -91.000 TYR 8 0.840 104.683 207.258 133.426 -99.200 -91.000 HIS 9 0.900 100.610 211.998 128.972 -99.200 -91.000 HIS 35 0.900 109.789 208.690 146.925 -99.200 -91.000 HIS 50 0.900 96.060 213.256 130.908 -99.200 -91.000 HIS 79 0.900 122.969 209.206 146.939 -99.200 -91.000 PHE 86 1.000 130.985 223.886 142.284 -99.200 -91.000 TYR 108 0.840 120.195 206.034 147.003 -99.200 -91.000 TYR 136 0.840 112.413 228.557 144.241 -99.200 -91.000 TYR 152 0.840 107.511 228.911 143.549 -99.200 -91.000 TYR 153 0.840 107.919 228.463 148.689 -99.200 -91.000 TYR 157 0.840 100.282 220.972 150.048 -99.200 -91.000 PHE 158 1.000 95.984 227.752 147.816 -99.200 -91.000 HIS 179 0.900 129.270 230.299 153.395 -99.200 -91.000 TYR 181 0.840 128.477 225.746 156.751 -99.200 -91.000 TYR 183 0.840 117.256 223.449 157.781 -99.200 -91.000 TYR 193 0.840 106.865 216.360 156.063 -99.200 -91.000 TRP 225 1.040 114.853 236.480 154.215 -99.200 -91.000 TRP6 225 1.020 114.726 238.681 153.357 -99.200 -91.000 TYR 266 0.840 107.532 222.467 171.757 -99.200 -91.000