============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. PHE 2 1.000 30.941 0.710 28.155 -99.200 -91.000 PHE 51 1.000 43.186 2.652 23.596 -99.200 -91.000 TYR 79 0.840 41.791 -8.464 24.255 -99.200 -91.000 TRP 101 1.040 35.062 -5.025 52.614 -99.200 -91.000 TRP6 101 1.020 34.370 -6.384 50.824 -99.200 -91.000 PHE 102 1.000 33.205 3.365 56.334 -99.200 -91.000 TYR 121 0.840 29.996 -12.259 44.280 -99.200 -91.000 TYR 122 0.840 32.042 -10.723 48.691 -99.200 -91.000 PHE 233 1.000 32.437 10.194 47.694 -99.200 -91.000 HIS 261 0.900 46.136 3.970 32.264 -99.200 -91.000 TYR 268 0.840 38.701 -4.329 44.357 -99.200 -91.000 PHE 269 1.000 32.294 -7.333 43.578 -99.200 -91.000 PHE 282 1.000 35.580 -3.978 34.807 -99.200 -91.000 TYR 283 0.840 35.684 -12.123 35.297 -99.200 -91.000