============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. PHE 8 1.000 34.020 20.013 68.321 -99.200 -91.000 PHE 25 1.000 38.075 19.752 56.983 -99.200 -91.000 HIS 28 0.900 32.080 29.154 64.973 -99.200 -91.000 PHE 32 1.000 36.738 29.238 82.709 -99.200 -91.000 TRP 39 1.040 43.013 21.273 64.126 -99.200 -91.000 TRP6 39 1.020 41.076 21.538 62.817 -99.200 -91.000 PHE 40 1.000 44.384 13.946 67.073 -99.200 -91.000 PHE 58 1.000 40.952 26.854 70.491 -99.200 -91.000 TYR 78 0.840 42.117 16.484 56.828 -99.200 -91.000 PHE 106 1.000 35.628 18.681 18.148 -99.200 -91.000 PHE 137 1.000 42.108 15.867 11.997 -99.200 -91.000 TYR 138 0.840 37.614 8.471 12.868 -99.200 -91.000 PHE 150 1.000 44.594 12.717 2.300 -99.200 -91.000 TYR 159 0.840 44.773 17.935 18.531 -99.200 -91.000 TYR 167 0.840 46.438 14.282 -6.478 -99.200 -91.000 TYR 174 0.840 38.319 14.545 4.373 -99.200 -91.000