============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. PHE 33 1.000 -20.404 -20.567 -4.426 -99.200 -91.000 HIS 49 0.900 -34.065 -13.469 10.682 -99.200 -91.000 TYR 55 0.840 -29.702 1.786 15.175 -99.200 -91.000 TYR 66 0.840 -18.106 -21.132 -8.124 -99.200 -91.000 PHE 81 1.000 -12.967 -32.239 -2.502 -99.200 -91.000 TRP 92 1.040 -6.386 -37.236 7.937 -99.200 -91.000 TRP6 92 1.020 -5.591 -37.552 10.142 -99.200 -91.000 HIS 111 0.900 -17.053 -19.796 -12.078 -99.200 -91.000 PHE 120 1.000 -6.779 -7.502 -0.073 -99.200 -91.000 PHE 136 1.000 0.055 -14.060 -8.401 -99.200 -91.000 HIS 138 0.900 -5.071 -22.447 -10.802 -99.200 -91.000 TYR 160 0.840 -5.679 -15.811 25.677 -99.200 -91.000 TYR 161 0.840 -1.678 -20.600 23.859 -99.200 -91.000 HIS 181 0.900 -1.695 -21.649 9.380 -99.200 -91.000 TYR 191 0.840 12.420 -9.682 14.571 -99.200 -91.000 PHE 201 1.000 7.768 -8.082 30.708 -99.200 -91.000 PHE 216 1.000 8.902 -19.293 21.171 -99.200 -91.000 TYR 234 0.840 -15.993 -23.301 14.853 -99.200 -91.000 TYR 248 0.840 -9.184 -3.750 -0.258 -99.200 -91.000 TYR 266 0.840 11.933 -12.721 4.713 -99.200 -91.000 HIS 268 0.900 13.554 -18.939 0.093 -99.200 -91.000 PHE 272 1.000 1.367 -15.680 -3.392 -99.200 -91.000 PHE 300 1.000 10.860 -16.737 5.329 -99.200 -91.000 HIS 315 0.900 1.957 -33.861 -10.658 -99.200 -91.000