============================================================================= 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. PHE 9 1.000 -24.837 -1.020 -3.866 -99.200 -91.000 HIS 28 0.900 -17.130 -3.448 19.579 -99.200 -91.000 TYR 30 0.840 -24.561 1.709 21.059 -99.200 -91.000 TRP 33 1.040 -29.509 -2.195 12.177 -99.200 -91.000 TRP6 33 1.020 -28.550 -2.496 10.042 -99.200 -91.000 TYR 34 0.840 -26.545 6.053 13.678 -99.200 -91.000 HIS 46 0.900 -36.170 -0.030 16.218 -99.200 -91.000 TYR 47 0.840 -30.098 2.790 22.159 -99.200 -91.000 TYR 63 0.840 -36.976 1.556 9.668 -99.200 -91.000 PHE 73 1.000 -29.541 -3.954 16.961 -99.200 -91.000 TYR 88 0.840 -32.423 1.787 5.759 -99.200 -91.000 PHE 89 1.000 -23.687 4.292 6.273 -99.200 -91.000 TYR 94 0.840 -14.836 -3.707 23.045 -99.200 -91.000 PHE 102 1.000 -14.297 -0.278 16.329 -99.200 -91.000 PHE 103 1.000 -20.986 4.968 12.085 -99.200 -91.000 PHE 119 1.000 -35.599 1.154 -18.009 -99.200 -91.000 PHE 126 1.000 -18.326 8.502 -25.693 -99.200 -91.000 HIS 135 0.900 -3.010 21.739 -29.254 -99.200 -91.000 PHE 148 1.000 -26.468 4.845 -13.520 -99.200 -91.000 TYR 149 0.840 -35.093 4.504 -10.789 -99.200 -91.000 HIS 152 0.900 -29.599 0.299 -5.720 -99.200 -91.000 TRP 157 1.040 -11.554 4.361 -15.548 -99.200 -91.000 TRP6 157 1.020 -11.851 4.398 -17.906 -99.200 -91.000 TRP 158 1.040 -11.293 -3.513 -13.662 -99.200 -91.000 TRP6 158 1.020 -10.389 -5.059 -12.120 -99.200 -91.000 HIS 165 0.900 -7.712 2.105 -7.059 -99.200 -91.000 TYR 186 0.840 -30.311 8.385 -10.754 -99.200 -91.000 PHE 198 1.000 -0.023 2.458 -20.237 -99.200 -91.000 TRP 199 1.040 -4.539 6.578 -27.233 -99.200 -91.000 TRP6 199 1.020 -6.383 5.116 -26.941 -99.200 -91.000 HIS 205 0.900 -8.511 -4.961 -22.334 -99.200 -91.000 PHE 206 1.000 -5.564 2.268 -22.255 -99.200 -91.000 PHE 212 1.000 -28.453 -2.069 -12.445 -99.200 -91.000 TYR 213 0.840 -23.984 -4.016 -6.466 -99.200 -91.000 TRP 221 1.040 -38.021 -8.643 -16.762 -99.200 -91.000 TRP6 221 1.020 -38.210 -6.390 -16.098 -99.200 -91.000 TRP 238 1.040 -8.109 -3.836 -27.163 -99.200 -91.000 TRP6 238 1.020 -6.537 -5.409 -26.354 -99.200 -91.000