============================================================================= 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 5 1.000 19.089 49.402 -3.142 -99.200 -91.000 PHE 7 1.000 23.148 41.318 -7.399 -99.200 -91.000 TYR 23 0.840 27.848 20.680 -10.521 -99.200 -91.000 PHE 29 1.000 17.700 23.687 -6.293 -99.200 -91.000 TYR 46 0.840 23.311 32.203 20.702 -99.200 -91.000 PHE 62 1.000 7.323 26.998 9.182 -99.200 -91.000 PHE 103 1.000 32.220 28.337 -6.015 -99.200 -91.000 PHE 119 1.000 35.807 28.123 -1.920 -99.200 -91.000 PHE 123 1.000 20.673 34.227 -2.592 -99.200 -91.000 TYR 124 0.840 25.072 35.265 -4.583 -99.200 -91.000 PHE 127 1.000 20.748 33.858 -9.705 -99.200 -91.000 TYR 145 0.840 11.155 46.896 3.023 -99.200 -91.000 TRP 147 1.040 17.974 41.199 -2.981 -99.200 -91.000 TRP6 147 1.020 18.488 39.303 -4.301 -99.200 -91.000 PHE 155 1.000 20.429 44.325 -4.680 -99.200 -91.000 PHE 175 1.000 9.520 33.970 -10.235 -99.200 -91.000 TYR 183 0.840 16.020 19.895 -9.306 -99.200 -91.000 HIS 196 0.900 23.060 16.115 -2.013 -99.200 -91.000 PHE 199 1.000 23.342 13.143 10.113 -99.200 -91.000 TYR 202 0.840 15.879 24.530 13.241 -99.200 -91.000