============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. PHE 6 1.000 -18.375 -5.969 21.350 -99.200 -91.000 HIS 7 0.900 -22.953 -11.371 18.954 -99.200 -91.000 TYR 14 0.840 -13.517 -10.639 18.689 -99.200 -91.000 HIS 44 0.900 -2.705 -14.075 39.866 -99.200 -91.000 HIS 47 0.900 -3.396 -12.888 36.137 -99.200 -91.000 PHE 67 1.000 1.558 -14.726 22.410 -99.200 -91.000 PHE 92 1.000 -5.174 -10.689 20.221 -99.200 -91.000 TYR 100 0.840 6.409 -13.242 18.549 -99.200 -91.000 HIS 125 0.900 11.231 -11.712 31.833 -99.200 -91.000 PHE 126 1.000 12.625 -7.071 33.063 -99.200 -91.000 PHE 146 1.000 -6.524 -0.431 33.586 -99.200 -91.000 PHE 147 1.000 1.342 -3.854 31.575 -99.200 -91.000 TYR 152 0.840 8.060 -0.043 41.043 -99.200 -91.000 PHE 165 1.000 10.336 2.236 21.071 -99.200 -91.000 TYR 191 0.840 4.522 -24.773 40.569 -99.200 -91.000 HIS 212 0.900 4.604 0.479 58.522 -99.200 -91.000 TYR 239 0.840 16.636 -8.097 43.060 -99.200 -91.000