============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 10 0.840 -94.218 -36.520 38.434 -99.200 -91.000 TYR 25 0.840 -72.104 -37.430 39.707 -99.200 -91.000 PHE 26 1.000 -66.568 -29.804 35.127 -99.200 -91.000 HIS 28 0.900 -68.573 -34.215 44.914 -99.200 -91.000 PHE 32 1.000 -63.089 -37.032 44.123 -99.200 -91.000 TRP 35 1.040 -57.782 -32.680 47.345 -99.200 -91.000 TRP6 35 1.020 -59.918 -33.408 48.035 -99.200 -91.000 TYR 45 0.840 -64.933 -34.386 31.919 -99.200 -91.000 HIS 46 0.900 -64.933 -39.932 31.142 -99.200 -91.000 HIS 54 0.900 -78.808 -39.369 32.247 -99.200 -91.000 TYR 58 0.840 -85.072 -35.778 32.379 -99.200 -91.000 PHE 64 1.000 -92.928 -34.089 20.425 -99.200 -91.000 TYR 107 0.840 -99.146 -38.143 36.011 -99.200 -91.000 HIS 112 0.900 -103.288 -44.480 28.519 -99.200 -91.000 TYR 114 0.840 -98.373 -46.094 27.346 -99.200 -91.000 HIS 130 0.900 -74.346 -42.132 36.600 -99.200 -91.000 TRP 133 1.040 -67.497 -46.179 39.951 -99.200 -91.000 TRP6 133 1.020 -67.053 -44.080 40.926 -99.200 -91.000 TYR 149 0.840 -61.129 -45.309 47.188 -99.200 -91.000