============================================================================= 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 6 1.000 -17.121 -27.189 51.768 -99.200 -91.000 PHE 21 1.000 -0.362 -20.964 41.775 -99.200 -91.000 PHE 36 1.000 -4.322 -22.691 55.903 -99.200 -91.000 PHE 38 1.000 2.247 -26.374 55.505 -99.200 -91.000 TYR 47 0.840 -4.023 -24.411 45.900 -99.200 -91.000 PHE 64 1.000 -12.432 -11.910 53.447 -99.200 -91.000 HIS 75 0.900 -24.736 -18.439 45.311 -99.200 -91.000 HIS 96 0.900 -7.873 -6.846 53.823 -99.200 -91.000 PHE 99 1.000 0.400 -10.321 56.871 -99.200 -91.000 TYR 107 0.840 -0.171 -19.026 54.307 -99.200 -91.000 PHE 113 1.000 -11.251 -16.695 55.875 -99.200 -91.000 PHE 121 1.000 -10.650 -22.762 56.722 -99.200 -91.000 TRP 123 1.040 -7.290 -23.187 50.853 -99.200 -91.000 TRP6 123 1.020 -8.466 -21.177 51.260 -99.200 -91.000