============================================================================= 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 13 1.040 37.449 13.876 10.934 -99.200 -91.000 TRP6 13 1.020 38.406 14.090 13.073 -99.200 -91.000 PHE 14 1.000 38.283 4.962 10.524 -99.200 -91.000 PHE 35 1.000 45.578 6.454 17.855 -99.200 -91.000 HIS 43 0.900 52.075 3.077 29.706 -99.200 -91.000 PHE 55 1.000 38.410 17.085 32.914 -99.200 -91.000 HIS 66 0.900 46.625 5.248 13.302 -99.200 -91.000 PHE 69 1.000 56.424 7.901 14.013 -99.200 -91.000 HIS 71 0.900 57.110 -0.764 11.234 -99.200 -91.000 HIS 72 0.900 54.448 5.407 6.471 -99.200 -91.000 PHE 82 1.000 44.181 0.295 18.147 -99.200 -91.000 HIS 84 0.900 34.188 -4.053 16.437 -99.200 -91.000 TYR 86 0.840 43.285 -2.573 21.679 -99.200 -91.000 PHE 90 1.000 39.242 8.904 21.937 -99.200 -91.000 TYR 107 0.840 48.952 20.756 16.031 -99.200 -91.000 HIS 126 0.900 53.744 18.650 21.121 -99.200 -91.000 HIS 127 0.900 52.132 17.789 28.660 -99.200 -91.000 PHE 128 1.000 58.050 11.754 22.260 -99.200 -91.000