============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 38 rings ring int. center anis. iso. TYR 6 0.840 -31.148 -5.080 14.139 -99.200 -91.000 TYR 10 0.840 -35.452 6.637 22.907 -99.200 -91.000 TYR 17 0.840 -25.957 14.347 5.049 -99.200 -91.000 TRP 34 1.040 -32.653 2.007 12.653 -99.200 -91.000 TRP6 34 1.020 -33.711 -0.054 12.155 -99.200 -91.000 TYR 39 0.840 -31.609 2.532 -1.290 -99.200 -91.000 HIS 62 0.900 -8.879 1.942 18.695 -99.200 -91.000 TYR 68 0.840 -21.265 -2.039 9.669 -99.200 -91.000 TYR 69 0.840 -22.557 -3.929 17.241 -99.200 -91.000 TYR 81 0.840 -33.963 1.637 8.251 -99.200 -91.000 TYR 86 0.840 -27.732 4.377 23.602 -99.200 -91.000 TYR 105 0.840 -14.219 26.912 33.377 -99.200 -91.000 PHE 110 1.000 -15.192 14.244 29.807 -99.200 -91.000 HIS 126 0.900 -3.398 9.894 12.110 -99.200 -91.000 HIS 131 0.900 -13.786 11.829 3.326 -99.200 -91.000 PHE 140 1.000 -21.602 10.404 19.082 -99.200 -91.000 PHE 152 1.000 -16.612 12.908 6.969 -99.200 -91.000 PHE 161 1.000 -24.683 25.350 -1.120 -99.200 -91.000 PHE 165 1.000 -22.388 29.502 1.497 -99.200 -91.000 TYR 170 0.840 -16.529 28.194 15.588 -99.200 -91.000 TYR 171 0.840 -12.874 21.914 17.044 -99.200 -91.000 TYR 181 0.840 -3.363 11.197 5.378 -99.200 -91.000 TRP 188 1.040 -5.513 23.571 14.205 -99.200 -91.000 TRP6 188 1.020 -4.104 25.422 14.646 -99.200 -91.000 TYR 195 0.840 -8.444 27.112 24.116 -99.200 -91.000 PHE 204 1.000 -6.853 29.688 16.923 -99.200 -91.000 PHE 207 1.000 -19.667 37.462 16.357 -99.200 -91.000 PHE 221 1.000 -3.475 29.064 21.703 -99.200 -91.000 TYR 226 0.840 -4.774 31.554 34.813 -99.200 -91.000 TYR 228 0.840 -9.371 22.717 32.876 -99.200 -91.000 TYR 245 0.840 8.382 22.543 11.158 -99.200 -91.000 HIS 246 0.900 8.275 23.964 15.618 -99.200 -91.000 HIS 262 0.900 -6.221 7.279 35.944 -99.200 -91.000 HIS 263 0.900 -5.568 9.829 32.757 -99.200 -91.000 HIS 264 0.900 -4.262 4.394 28.070 -99.200 -91.000 HIS 265 0.900 -10.242 -0.250 25.843 -99.200 -91.000 HIS 266 0.900 -9.908 1.333 32.154 -99.200 -91.000 HIS 267 0.900 -14.873 -0.722 25.835 -99.200 -91.000