============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 16 0.840 76.296-166.331 61.538 -99.200 -91.000 TYR 30 0.840 39.883-159.888 58.160 -99.200 -91.000 PHE 36 1.000 43.692-164.243 63.533 -99.200 -91.000 HIS 62 0.900 48.985-175.838 50.157 -99.200 -91.000 TYR 76 0.840 56.782-192.512 53.490 -99.200 -91.000 TYR 90 0.840 69.024-182.003 48.474 -99.200 -91.000 PHE 92 1.000 65.112-171.115 46.414 -99.200 -91.000 TYR 94 0.840 58.154-179.338 47.295 -99.200 -91.000 TYR 100 0.840 57.710-170.200 36.200 -99.200 -91.000 TRP 110 1.040 49.155-162.197 47.258 -99.200 -91.000 TRP6 110 1.020 47.905-162.031 45.266 -99.200 -91.000 PHE 125 1.000 69.628-172.244 49.623 -99.200 -91.000 TYR 128 0.840 62.051-162.736 47.385 -99.200 -91.000 TYR 136 0.840 65.387-161.572 44.794 -99.200 -91.000 PHE 145 1.000 56.586-150.681 54.930 -99.200 -91.000 HIS 148 0.900 60.636-150.982 49.690 -99.200 -91.000 TYR 184 0.840 56.594-151.970 67.598 -99.200 -91.000 TYR 185 0.840 61.650-146.952 66.802 -99.200 -91.000 PHE 194 1.000 62.358-159.767 67.181 -99.200 -91.000 PHE 207 1.000 62.110-170.827 65.822 -99.200 -91.000 TRP 218 1.040 58.436-144.676 71.296 -99.200 -91.000 TRP6 218 1.020 57.005-144.047 69.524 -99.200 -91.000 PHE 220 1.000 61.615-138.473 68.970 -99.200 -91.000 TYR 227 0.840 48.523-127.950 62.267 -99.200 -91.000