============================================================================= 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 5 0.840 20.769 94.177 13.971 -99.200 -91.000 TYR 14 0.840 8.445 95.710 19.118 -99.200 -91.000 TYR 22 0.840 7.131 114.429 6.190 -99.200 -91.000 HIS 23 0.900 9.515 107.302 9.653 -99.200 -91.000 PHE 24 1.000 5.171 112.515 12.133 -99.200 -91.000 TRP 34 1.040 -5.800 102.698 22.645 -99.200 -91.000 TRP6 34 1.020 -5.883 105.031 23.019 -99.200 -91.000 HIS 40 0.900 10.166 114.322 20.149 -99.200 -91.000 TYR 42 0.840 -0.815 116.995 18.451 -99.200 -91.000 PHE 64 1.000 0.052 102.388 4.050 -99.200 -91.000 HIS 73 0.900 2.137 112.749 31.280 -99.200 -91.000 TYR 76 0.840 6.307 117.515 25.360 -99.200 -91.000 TRP 121 1.040 11.581 102.204 8.429 -99.200 -91.000 TRP6 121 1.020 9.745 101.632 9.804 -99.200 -91.000 TYR 131 0.840 16.751 111.074 6.316 -99.200 -91.000 TYR 152 0.840 23.095 114.270 26.848 -99.200 -91.000 PHE 161 1.000 15.746 104.365 29.157 -99.200 -91.000 TYR 165 0.840 27.112 100.092 22.550 -99.200 -91.000 TRP 193 1.040 16.207 114.520 25.424 -99.200 -91.000 TRP6 193 1.020 18.252 115.427 26.208 -99.200 -91.000 TYR 206 0.840 16.967 106.035 23.738 -99.200 -91.000 TYR 212 0.840 5.809 108.818 31.866 -99.200 -91.000 TRP 215 1.040 -1.159 109.373 31.649 -99.200 -91.000 TRP6 215 1.020 -0.267 109.334 29.457 -99.200 -91.000