============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 2 0.840 63.040 11.905 46.277 -99.200 -91.000 PHE 9 1.000 67.924 15.755 55.104 -99.200 -91.000 PHE 16 1.000 58.668 10.629 53.362 -99.200 -91.000 TYR 20 0.840 58.450 4.656 55.346 -99.200 -91.000 PHE 36 1.000 53.117 10.316 92.368 -99.200 -91.000 TYR 67 0.840 67.903 6.651 94.233 -99.200 -91.000 PHE 85 1.000 74.311 4.065 74.931 -99.200 -91.000 TYR 97 0.840 80.714 13.696 85.843 -99.200 -91.000 TYR 117 0.840 73.158 2.678 65.532 -99.200 -91.000 TYR 120 0.840 77.399 8.550 61.075 -99.200 -91.000 TYR 126 0.840 69.379 1.669 68.346 -99.200 -91.000 PHE 132 1.000 65.257 6.799 79.123 -99.200 -91.000 PHE 143 1.000 63.819 14.517 80.651 -99.200 -91.000 TYR 154 0.840 56.109 14.719 76.830 -99.200 -91.000 PHE 169 1.000 40.683 9.880 80.944 -99.200 -91.000 TYR 174 0.840 48.799 15.710 84.916 -99.200 -91.000 TYR 215 0.840 61.067 4.268 89.500 -99.200 -91.000 TYR 218 0.840 51.738 0.867 92.807 -99.200 -91.000 PHE 226 1.000 45.535 1.724 92.656 -99.200 -91.000