============================================================================= 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. TRP 14 1.040 24.802 24.490 11.358 -99.200 -91.000 TRP6 14 1.020 25.743 24.553 9.188 -99.200 -91.000 TYR 18 0.840 26.587 20.130 9.797 -99.200 -91.000 PHE 27 1.000 24.509 21.158 4.354 -99.200 -91.000 PHE 32 1.000 34.585 23.777 0.529 -99.200 -91.000 PHE 36 1.000 35.813 24.345 -5.487 -99.200 -91.000 PHE 46 1.000 39.392 25.477 -1.191 -99.200 -91.000 PHE 59 1.000 37.003 19.477 -2.353 -99.200 -91.000 HIS 62 0.900 38.945 21.961 2.714 -99.200 -91.000 HIS 89 0.900 43.373 26.739 16.083 -99.200 -91.000 HIS 94 0.900 40.904 29.494 6.809 -99.200 -91.000 PHE 104 1.000 37.735 35.106 4.297 -99.200 -91.000 HIS 118 0.900 19.999 20.982 1.952 -99.200 -91.000 PHE 122 1.000 18.403 31.661 4.158 -99.200 -91.000 HIS 125 0.900 19.883 42.083 8.262 -99.200 -91.000 TRP 127 1.040 20.880 31.696 7.902 -99.200 -91.000 TRP6 127 1.020 22.531 30.037 8.258 -99.200 -91.000 TYR 131 0.840 30.151 33.988 5.243 -99.200 -91.000