============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. TYR 3 0.840 33.402 23.134 16.003 -99.200 -91.000 TRP 21 1.040 20.632 5.982 22.611 -99.200 -91.000 TRP6 21 1.020 21.008 4.457 20.850 -99.200 -91.000 PHE 40 1.000 22.347 -6.483 5.499 -99.200 -91.000 TYR 49 0.840 29.224 -1.622 -0.546 -99.200 -91.000 PHE 50 1.000 27.020 -4.259 5.629 -99.200 -91.000 HIS 68 0.900 27.911 -4.584 11.456 -99.200 -91.000 TYR 74 0.840 27.081 -1.137 23.443 -99.200 -91.000 PHE 79 1.000 28.220 8.608 15.869 -99.200 -91.000 TYR 96 0.840 32.247 4.851 15.827 -99.200 -91.000 HIS 100 0.900 31.044 3.280 8.255 -99.200 -91.000 PHE 110 1.000 27.266 6.534 7.627 -99.200 -91.000 PHE 126 1.000 10.336 7.448 20.245 -99.200 -91.000 TYR 130 0.840 10.526 12.059 18.535 -99.200 -91.000 TRP 134 1.040 17.337 9.274 15.736 -99.200 -91.000 TRP6 134 1.020 19.308 8.264 16.552 -99.200 -91.000