============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TYR 30 0.840 114.670-107.516-205.094 -99.200 -91.000 TYR 36 0.840 115.523-107.991-198.961 -99.200 -91.000 TRP 39 1.040 109.495-108.450-186.483 -99.200 -91.000 TRP6 39 1.020 108.157-106.899-185.325 -99.200 -91.000 TYR 40 0.840 117.337-105.489-185.661 -99.200 -91.000 TYR 53 0.840 117.708-114.000-191.272 -99.200 -91.000 TRP 54 1.040 115.423-111.917-196.400 -99.200 -91.000 TRP6 54 1.020 117.128-113.505-196.709 -99.200 -91.000 PHE 66 1.000 111.781-114.443-178.881 -99.200 -91.000 PHE 75 1.000 106.167-107.051-193.297 -99.200 -91.000 TYR 90 0.840 110.540-108.080-177.959 -99.200 -91.000 TYR 91 0.840 113.528-100.251-180.678 -99.200 -91.000 TYR 95 0.840 116.605-106.615-194.207 -99.200 -91.000 TYR 96 0.840 111.674-103.044-201.231 -99.200 -91.000 PHE 102 1.000 116.547 -99.608-186.715 -99.200 -91.000 PHE 120 1.000 112.084-100.135-147.560 -99.200 -91.000 PHE 122 1.000 116.625 -95.109-147.985 -99.200 -91.000 PHE 143 1.000 105.915 -99.954-158.013 -99.200 -91.000 TYR 144 0.840 102.561-105.484-163.166 -99.200 -91.000 TRP 152 1.040 108.426 -85.972-152.289 -99.200 -91.000 TRP6 152 1.020 109.832 -87.094-150.760 -99.200 -91.000 TYR 177 0.840 107.187-101.851-164.203 -99.200 -91.000 TYR 190 0.840 116.530 -81.375-143.434 -99.200 -91.000 HIS 193 0.900 108.531 -76.149-143.482 -99.200 -91.000 TYR 196 0.840 111.372 -82.615-144.696 -99.200 -91.000 HIS 202 0.900 100.646 -99.979-157.412 -99.200 -91.000 PHE 213 1.000 112.974 -87.302-142.928 -99.200 -91.000