============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. HIS 22 0.900 8.284 23.976 46.611 -99.200 -91.000 TYR 23 0.840 5.593 27.828 52.772 -99.200 -91.000 PHE 36 1.000 -0.399 26.477 51.636 -99.200 -91.000 PHE 81 1.000 2.782 38.859 60.883 -99.200 -91.000 TYR 91 0.840 -0.006 43.530 63.427 -99.200 -91.000 PHE 93 1.000 -0.749 36.754 64.166 -99.200 -91.000 TYR 97 0.840 -1.268 30.119 56.252 -99.200 -91.000 TYR 98 0.840 2.541 23.604 55.614 -99.200 -91.000 TYR 112 0.840 29.552 26.189 62.253 -99.200 -91.000 PHE 148 1.000 20.955 35.276 68.335 -99.200 -91.000 PHE 151 1.000 22.720 40.988 58.710 -99.200 -91.000 TYR 154 0.840 14.179 36.707 56.068 -99.200 -91.000 PHE 169 1.000 19.248 33.773 55.983 -99.200 -91.000 TYR 179 0.840 16.980 34.336 50.718 -99.200 -91.000 PHE 191 1.000 17.753 24.468 66.021 -99.200 -91.000 TYR 196 0.840 4.751 29.815 58.513 -99.200 -91.000 PHE 207 1.000 -10.853 41.029 56.475 -99.200 -91.000 TYR 210 0.840 -15.587 36.332 55.034 -99.200 -91.000 PHE 214 1.000 -10.339 31.256 53.329 -99.200 -91.000 HIS 218 0.900 -13.569 28.142 52.299 -99.200 -91.000 TRP 229 1.040 1.019 25.633 45.422 -99.200 -91.000 TRP6 229 1.020 2.352 26.696 43.803 -99.200 -91.000