============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 2 1.000 -1.750 27.191 1.320 -99.200 -91.000 TYR 16 0.840 2.862 39.022 7.778 -99.200 -91.000 PHE 21 1.000 -6.674 34.621 17.402 -99.200 -91.000 PHE 24 1.000 -11.482 34.880 15.125 -99.200 -91.000 TYR 28 0.840 -16.103 37.246 11.922 -99.200 -91.000 PHE 35 1.000 -9.455 33.166 21.853 -99.200 -91.000 TYR 38 0.840 -6.791 37.032 24.288 -99.200 -91.000 PHE 52 1.000 -3.396 39.193 21.238 -99.200 -91.000 HIS 55 0.900 -1.626 30.803 25.634 -99.200 -91.000 PHE 60 1.000 -2.153 33.352 12.982 -99.200 -91.000 HIS 89 0.900 -8.349 24.245 19.072 -99.200 -91.000 PHE 97 1.000 -11.063 25.766 14.402 -99.200 -91.000 PHE 101 1.000 -8.036 29.458 8.311 -99.200 -91.000 TYR 107 0.840 -3.313 41.179 7.903 -99.200 -91.000 PHE 115 1.000 0.105 37.878 2.606 -99.200 -91.000 TRP 120 1.040 -3.093 31.911 2.309 -99.200 -91.000 TRP6 120 1.020 -2.252 30.638 4.140 -99.200 -91.000 PHE 123 1.000 -4.943 25.713 5.487 -99.200 -91.000