============================================================================= 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 -41.239 106.235 -76.582 -99.200 -91.000 HIS 26 0.900 -35.570 100.681 -75.268 -99.200 -91.000 TYR 28 0.840 -37.444 107.329 -83.448 -99.200 -91.000 HIS 32 0.900 -33.122 98.509 -88.216 -99.200 -91.000 TYR 33 0.840 -34.833 95.372 -83.926 -99.200 -91.000 TYR 40 0.840 -40.973 98.103 -98.100 -99.200 -91.000 HIS 57 0.900 -29.982 113.547 -79.775 -99.200 -91.000 PHE 61 1.000 -30.601 115.278 -73.343 -99.200 -91.000 TYR 90 0.840 -41.177 106.197 -92.270 -99.200 -91.000 TYR 104 0.840 -35.393 116.960 -75.942 -99.200 -91.000 PHE 107 1.000 -37.865 118.922 -70.689 -99.200 -91.000 PHE 123 1.000 -32.316 119.983 -72.503 -99.200 -91.000 HIS 133 0.900 -33.012 112.615 -85.282 -99.200 -91.000 TYR 136 0.840 -35.612 109.799 -92.977 -99.200 -91.000 TYR 137 0.840 -38.448 109.793 -88.135 -99.200 -91.000 HIS 143 0.900 -40.525 111.575-100.769 -99.200 -91.000 TYR 151 0.840 -40.431 106.523-101.036 -99.200 -91.000 PHE 169 1.000 -13.858 93.219 -73.578 -99.200 -91.000