============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 29 rings ring int. center anis. iso. HIS 1 0.900 35.345 41.431 -0.768 -99.200 -91.000 TYR 51 0.840 28.795 25.703 -27.958 -99.200 -91.000 PHE 56 1.000 25.719 32.094 -32.749 -99.200 -91.000 PHE 64 1.000 26.617 25.919 -13.895 -99.200 -91.000 PHE 72 1.000 31.091 25.101 -23.882 -99.200 -91.000 PHE 81 1.000 29.070 19.447 -12.493 -99.200 -91.000 PHE 82 1.000 23.118 16.324 -9.565 -99.200 -91.000 PHE 90 1.000 8.730 9.255 -12.086 -99.200 -91.000 TRP 108 1.040 19.991 17.707 -29.149 -99.200 -91.000 TRP6 108 1.020 18.288 19.118 -29.988 -99.200 -91.000 PHE 115 1.000 7.478 16.208 -16.284 -99.200 -91.000 TYR 124 0.840 0.057 8.580 -9.709 -99.200 -91.000 PHE 134 1.000 14.210 10.277 -10.079 -99.200 -91.000 PHE 137 1.000 12.488 22.607 -11.337 -99.200 -91.000 TYR 138 0.840 6.518 25.294 -17.711 -99.200 -91.000 TYR 141 0.840 10.941 27.357 -25.103 -99.200 -91.000 TRP 143 1.040 5.138 20.561 -16.158 -99.200 -91.000 TRP6 143 1.020 4.693 20.930 -13.861 -99.200 -91.000 HIS 144 0.900 13.039 21.787 -17.004 -99.200 -91.000 PHE 154 1.000 25.858 20.582 -8.410 -99.200 -91.000 TYR 163 0.840 34.766 32.251 -12.441 -99.200 -91.000 TYR 167 0.840 27.839 31.197 -0.300 -99.200 -91.000 PHE 183 1.000 16.796 35.682 -6.187 -99.200 -91.000 PHE 205 1.000 17.557 47.951 -7.985 -99.200 -91.000 TYR 209 0.840 12.958 50.087 -16.205 -99.200 -91.000 TYR 211 0.840 7.595 40.441 -19.659 -99.200 -91.000 PHE 219 1.000 24.368 43.236 -15.211 -99.200 -91.000 HIS 221 0.900 20.928 49.091 -6.372 -99.200 -91.000 PHE 222 1.000 23.293 45.155 -6.673 -99.200 -91.000