============================================================================= 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 -94.223 -36.511 38.546 -99.200 -91.000 TYR 25 0.840 -72.071 -37.347 39.943 -99.200 -91.000 PHE 26 1.000 -66.627 -29.671 35.316 -99.200 -91.000 HIS 28 0.900 -68.537 -34.089 45.148 -99.200 -91.000 PHE 32 1.000 -63.105 -36.954 44.136 -99.200 -91.000 TRP 35 1.040 -57.703 -32.575 47.406 -99.200 -91.000 TRP6 35 1.020 -59.839 -33.293 48.114 -99.200 -91.000 TYR 45 0.840 -64.994 -34.256 32.117 -99.200 -91.000 HIS 46 0.900 -64.984 -39.753 31.117 -99.200 -91.000 HIS 54 0.900 -78.898 -39.258 32.678 -99.200 -91.000 TYR 58 0.840 -85.039 -35.710 32.579 -99.200 -91.000 PHE 64 1.000 -92.798 -33.995 20.546 -99.200 -91.000 TYR 107 0.840 -99.082 -38.221 36.134 -99.200 -91.000 HIS 112 0.900 -103.141 -44.580 28.458 -99.200 -91.000 TYR 114 0.840 -98.242 -46.064 27.407 -99.200 -91.000 HIS 130 0.900 -74.783 -41.871 36.773 -99.200 -91.000 TRP 133 1.040 -67.554 -46.094 40.035 -99.200 -91.000 TRP6 133 1.020 -67.103 -43.980 40.968 -99.200 -91.000 TYR 149 0.840 -61.054 -45.256 47.249 -99.200 -91.000