============================================================================= 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. HIS 23 0.900 -20.020 78.604 -40.572 -99.200 -91.000 HIS 26 0.900 -13.843 76.219 -36.029 -99.200 -91.000 TYR 28 0.840 -19.174 85.541 -36.499 -99.200 -91.000 HIS 32 0.900 -8.958 88.485 -33.856 -99.200 -91.000 TYR 33 0.840 -7.058 83.851 -36.063 -99.200 -91.000 TYR 40 0.840 -8.558 98.612 -41.415 -99.200 -91.000 HIS 57 0.900 -24.453 82.783 -28.077 -99.200 -91.000 PHE 61 1.000 -27.397 76.840 -28.401 -99.200 -91.000 TYR 90 0.840 -17.233 94.213 -40.530 -99.200 -91.000 TYR 104 0.840 -29.496 79.762 -32.832 -99.200 -91.000 PHE 107 1.000 -32.576 75.079 -34.710 -99.200 -91.000 PHE 123 1.000 -32.576 76.757 -29.096 -99.200 -91.000 HIS 133 0.900 -23.171 88.164 -31.135 -99.200 -91.000 TYR 136 0.840 -19.633 95.345 -34.240 -99.200 -91.000 TYR 137 0.840 -20.946 90.659 -37.102 -99.200 -91.000 HIS 143 0.900 -21.216 103.674 -39.198 -99.200 -91.000 TYR 151 0.840 -16.285 103.190 -39.969 -99.200 -91.000 PHE 169 1.000 -2.907 72.541 -15.862 -99.200 -91.000