============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TYR 36 0.840 -73.505 -28.281 14.426 -99.200 -91.000 PHE 41 1.000 -68.098 -26.200 11.162 -99.200 -91.000 TRP 46 1.040 -72.149 -38.132 12.712 -99.200 -91.000 TRP6 46 1.020 -72.304 -39.962 11.241 -99.200 -91.000 HIS 50 0.900 -74.245 -37.564 21.612 -99.200 -91.000 PHE 51 1.000 -77.036 -42.351 12.682 -99.200 -91.000 PHE 78 1.000 -67.385 -42.861 11.657 -99.200 -91.000 PHE 80 1.000 -69.401 -45.956 19.105 -99.200 -91.000 TYR 96 0.840 -63.667 -47.945 18.360 -99.200 -91.000 PHE 117 1.000 -55.799 -46.584 28.078 -99.200 -91.000 TYR 129 0.840 -59.138 -50.389 5.588 -99.200 -91.000 HIS 131 0.900 -51.699 -43.231 8.815 -99.200 -91.000 HIS 133 0.900 -58.423 -47.692 2.238 -99.200 -91.000 HIS 142 0.900 -62.231 -37.835 25.434 -99.200 -91.000 PHE 144 1.000 -65.834 -37.352 29.737 -99.200 -91.000 HIS 145 0.900 -63.117 -40.002 39.556 -99.200 -91.000 TYR 194 0.840 -40.386 -36.434 25.615 -99.200 -91.000 PHE 218 1.000 -49.553 -21.961 28.148 -99.200 -91.000 PHE 224 1.000 -63.439 -31.356 19.729 -99.200 -91.000 HIS 249 0.900 -53.453 -15.719 14.646 -99.200 -91.000