============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 40 rings ring int. center anis. iso. TRP 14 1.040 -29.848 -28.827 24.579 -99.200 -91.000 TRP6 14 1.020 -30.928 -27.849 26.439 -99.200 -91.000 PHE 19 1.000 -31.606 -42.075 9.928 -99.200 -91.000 TRP 37 1.040 -31.135 -20.443 11.446 -99.200 -91.000 TRP6 37 1.020 -29.643 -20.562 9.617 -99.200 -91.000 HIS 43 0.900 -15.746 -34.175 12.539 -99.200 -91.000 TYR 47 0.840 -11.082 -35.196 6.734 -99.200 -91.000 TRP 49 1.040 -10.633 -39.996 5.450 -99.200 -91.000 TRP6 49 1.020 -11.357 -39.598 7.665 -99.200 -91.000 PHE 53 1.000 -22.484 -37.599 4.256 -99.200 -91.000 HIS 65 0.900 -34.578 -41.981 26.217 -99.200 -91.000 TYR 70 0.840 -41.781 -42.392 13.515 -99.200 -91.000 TYR 84 0.840 -26.431 -21.136 5.185 -99.200 -91.000 HIS 86 0.900 -15.618 -19.972 10.098 -99.200 -91.000 TYR 89 0.840 -13.934 -28.124 7.995 -99.200 -91.000 TRP 91 1.040 -10.680 -29.362 4.198 -99.200 -91.000 TRP6 91 1.020 -9.032 -30.466 2.910 -99.200 -91.000 PHE 110 1.000 -38.703 -24.017 19.910 -99.200 -91.000 TYR 113 0.840 -41.293 -35.631 24.960 -99.200 -91.000 HIS 115 0.900 -37.442 -24.709 25.164 -99.200 -91.000 TYR 132 0.840 -15.513 -22.765 36.978 -99.200 -91.000 TRP 139 1.040 -29.099 -41.337 20.294 -99.200 -91.000 TRP6 139 1.020 -29.739 -39.127 19.736 -99.200 -91.000 TRP 146 1.040 -14.974 -55.194 22.990 -99.200 -91.000 TRP6 146 1.020 -15.619 -56.593 24.797 -99.200 -91.000 PHE 178 1.000 -14.488 -26.227 25.156 -99.200 -91.000 TYR 182 0.840 -13.659 -36.664 34.895 -99.200 -91.000 PHE 199 1.000 -18.110 -29.000 27.451 -99.200 -91.000 PHE 205 1.000 -23.036 -15.697 36.839 -99.200 -91.000 TRP 209 1.040 -29.479 -26.818 31.120 -99.200 -91.000 TRP6 209 1.020 -27.693 -28.177 31.866 -99.200 -91.000 TYR 210 0.840 -26.170 -19.197 28.599 -99.200 -91.000 TYR 226 0.840 -6.421 -34.080 28.898 -99.200 -91.000 PHE 228 1.000 -7.623 -31.654 21.084 -99.200 -91.000 TYR 229 0.840 -15.744 -31.403 23.759 -99.200 -91.000 HIS 231 0.900 -14.162 -20.446 22.994 -99.200 -91.000 PHE 233 1.000 -17.973 -14.982 23.177 -99.200 -91.000 TRP 238 1.040 -19.505 -18.265 9.848 -99.200 -91.000 TRP6 238 1.020 -20.512 -20.368 10.256 -99.200 -91.000 PHE 246 1.000 -34.204 -15.984 8.069 -99.200 -91.000