============================================================================= 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 -38.246 -8.378 -40.788 -99.200 -91.000 TYR 25 0.840 -26.606 -18.045 -24.472 -99.200 -91.000 PHE 26 1.000 -23.313 -27.917 -26.091 -99.200 -91.000 HIS 28 0.900 -19.356 -17.708 -24.399 -99.200 -91.000 PHE 32 1.000 -18.791 -19.692 -18.481 -99.200 -91.000 TRP 35 1.040 -11.626 -22.307 -17.802 -99.200 -91.000 TRP6 35 1.020 -12.602 -20.387 -18.778 -99.200 -91.000 TYR 45 0.840 -26.998 -28.663 -21.714 -99.200 -91.000 HIS 46 0.900 -32.720 -23.458 -19.001 -99.200 -91.000 HIS 54 0.900 -36.168 -18.866 -27.799 -99.200 -91.000 TYR 58 0.840 -37.401 -17.535 -34.776 -99.200 -91.000 PHE 64 1.000 -49.038 -23.068 -41.462 -99.200 -91.000 TYR 107 0.840 -43.160 -6.925 -43.052 -99.200 -91.000 HIS 112 0.900 -53.620 -7.033 -41.445 -99.200 -91.000 TYR 114 0.840 -52.844 -9.510 -36.828 -99.200 -91.000 HIS 130 0.900 -32.420 -16.900 -23.093 -99.200 -91.000 TRP 133 1.040 -28.367 -15.978 -15.305 -99.200 -91.000 TRP6 133 1.020 -26.435 -16.600 -16.537 -99.200 -91.000 TYR 149 0.840 -19.746 -14.357 -11.225 -99.200 -91.000