============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 12 0.840 25.767 26.364 0.684 -99.200 -91.000 PHE 17 1.000 10.096 27.316 4.841 -99.200 -91.000 TYR 22 0.840 -3.108 27.544 18.568 -99.200 -91.000 TRP 35 1.040 17.032 18.057 6.918 -99.200 -91.000 TRP6 35 1.020 18.812 19.572 6.623 -99.200 -91.000 TYR 55 0.840 4.502 19.295 23.093 -99.200 -91.000 TYR 57 0.840 5.689 12.844 14.020 -99.200 -91.000 PHE 66 1.000 2.433 22.303 8.349 -99.200 -91.000 TYR 75 0.840 11.530 39.685 15.204 -99.200 -91.000 HIS 78 0.900 13.958 37.244 18.716 -99.200 -91.000 TYR 81 0.840 14.736 30.092 23.490 -99.200 -91.000 TYR 85 0.840 17.253 26.372 24.510 -99.200 -91.000 PHE 93 1.000 4.439 31.750 19.534 -99.200 -91.000 HIS 105 0.900 -7.986 31.816 5.508 -99.200 -91.000 TYR 110 0.840 -0.216 34.816 11.641 -99.200 -91.000 PHE 114 1.000 9.463 35.333 13.182 -99.200 -91.000 HIS 124 0.900 -1.010 13.944 0.154 -99.200 -91.000 HIS 128 0.900 11.218 11.045 2.462 -99.200 -91.000 PHE 131 1.000 3.961 15.759 10.234 -99.200 -91.000 PHE 161 1.000 20.950 25.486 8.835 -99.200 -91.000 TYR 168 0.840 20.462 30.576 11.702 -99.200 -91.000 TYR 169 0.840 26.172 33.311 5.241 -99.200 -91.000 PHE 174 1.000 16.348 41.749 -10.380 -99.200 -91.000 PHE 179 1.000 9.671 30.400 -14.993 -99.200 -91.000