============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. HIS 2 0.900 37.353 5.972 17.653 -99.200 -91.000 PHE 8 1.000 20.613 -1.360 5.124 -99.200 -91.000 PHE 11 1.000 16.261 -6.830 1.339 -99.200 -91.000 TRP 20 1.040 23.364 -8.051 12.189 -99.200 -91.000 TRP6 20 1.020 24.578 -6.242 13.096 -99.200 -91.000 HIS 33 0.900 41.602 0.937 9.393 -99.200 -91.000 PHE 44 1.000 13.230 3.006 0.409 -99.200 -91.000 HIS 59 0.900 35.034 12.199 15.657 -99.200 -91.000 TYR 60 0.840 30.727 6.058 15.118 -99.200 -91.000 PHE 95 1.000 7.810 5.279 1.951 -99.200 -91.000 HIS 103 0.900 17.991 14.120 2.380 -99.200 -91.000 TYR 110 0.840 25.514 14.525 -1.886 -99.200 -91.000 PHE 111 1.000 31.061 10.957 -8.459 -99.200 -91.000 PHE 138 1.000 14.455 -2.040 -0.957 -99.200 -91.000 HIS 142 0.900 16.589 7.097 1.764 -99.200 -91.000 TYR 145 0.840 21.299 11.872 -2.141 -99.200 -91.000 HIS 146 0.900 20.390 11.194 5.711 -99.200 -91.000 TYR 149 0.840 20.945 16.511 2.809 -99.200 -91.000 HIS 154 0.900 23.481 19.289 8.569 -99.200 -91.000 TYR 155 0.840 27.592 15.412 11.150 -99.200 -91.000 HIS 157 0.900 36.708 18.591 8.965 -99.200 -91.000 PHE 160 1.000 29.937 9.989 1.658 -99.200 -91.000 PHE 162 1.000 25.510 0.120 1.026 -99.200 -91.000 HIS 164 0.900 24.710 -2.849 -2.635 -99.200 -91.000 TYR 167 0.840 20.350 -13.406 -2.909 -99.200 -91.000 HIS 203 0.900 43.366 8.270 -8.863 -99.200 -91.000