============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 35 rings ring int. center anis. iso. TRP 36 1.040 -29.323 4.748 -2.268 -99.200 -91.000 TRP6 36 1.020 -30.694 2.894 -2.779 -99.200 -91.000 PHE 38 1.000 -21.367 0.839 -3.147 -99.200 -91.000 TYR 48 0.840 -26.271 -13.608 4.573 -99.200 -91.000 TYR 51 0.840 -26.029 -12.868 13.909 -99.200 -91.000 HIS 70 0.900 -35.192 8.459 -6.340 -99.200 -91.000 HIS 73 0.900 -29.765 10.799 -10.506 -99.200 -91.000 TYR 83 0.840 -34.702 -5.321 -4.073 -99.200 -91.000 TYR 95 0.840 -28.451 -6.279 -11.291 -99.200 -91.000 TYR 97 0.840 -21.763 0.641 -8.100 -99.200 -91.000 HIS 111 0.900 -32.769 -13.903 -5.768 -99.200 -91.000 TYR 112 0.840 -26.258 -15.304 -0.577 -99.200 -91.000 TYR 117 0.840 -35.758 -2.208 8.248 -99.200 -91.000 TYR 121 0.840 -37.389 7.591 17.952 -99.200 -91.000 HIS 136 0.900 -19.123 -10.007 17.937 -99.200 -91.000 PHE 151 1.000 -16.722 12.407 5.352 -99.200 -91.000 HIS 153 0.900 -8.999 18.323 3.403 -99.200 -91.000 TYR 154 0.840 -10.488 11.369 8.967 -99.200 -91.000 HIS 162 0.900 -13.490 21.127 13.115 -99.200 -91.000 TYR 166 0.840 -26.671 28.334 5.660 -99.200 -91.000 TYR 170 0.840 -29.021 15.246 5.880 -99.200 -91.000 HIS 171 0.900 -21.423 9.256 1.979 -99.200 -91.000 TYR 178 0.840 -17.862 0.334 21.578 -99.200 -91.000 TYR 186 0.840 -11.732 5.937 18.717 -99.200 -91.000 TRP 187 1.040 -20.028 6.777 17.191 -99.200 -91.000 TRP6 187 1.020 -20.820 5.012 18.503 -99.200 -91.000 TRP 193 1.040 -16.982 8.467 -0.684 -99.200 -91.000 TRP6 193 1.020 -16.726 10.588 0.359 -99.200 -91.000 TRP 197 1.040 -12.544 9.442 2.992 -99.200 -91.000 TRP6 197 1.020 -13.328 8.693 5.093 -99.200 -91.000 TYR 202 0.840 -12.909 0.210 7.726 -99.200 -91.000 TYR 204 0.840 -10.053 5.471 13.124 -99.200 -91.000 PHE 205 1.000 -16.791 10.053 10.977 -99.200 -91.000 TYR 217 0.840 -32.225 10.433 11.089 -99.200 -91.000 TYR 219 0.840 -32.181 3.607 9.453 -99.200 -91.000