============================================================================= 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 19 0.840 45.877 100.365 137.830 -99.200 -91.000 TRP 26 1.040 30.252 94.349 125.307 -99.200 -91.000 TRP6 26 1.020 31.938 95.324 123.949 -99.200 -91.000 HIS 32 0.900 18.775 89.788 132.292 -99.200 -91.000 HIS 35 0.900 13.500 87.388 138.653 -99.200 -91.000 TYR 38 0.840 14.519 96.671 131.262 -99.200 -91.000 HIS 46 0.900 31.562 96.962 138.437 -99.200 -91.000 PHE 70 1.000 25.677 100.999 124.254 -99.200 -91.000 HIS 73 0.900 20.177 92.240 123.582 -99.200 -91.000 PHE 82 1.000 11.819 101.573 128.652 -99.200 -91.000 HIS 85 0.900 20.665 93.605 117.537 -99.200 -91.000 TYR 88 0.840 31.005 90.890 115.202 -99.200 -91.000 HIS 103 0.900 49.200 99.746 121.037 -99.200 -91.000 PHE 107 1.000 47.101 100.622 130.893 -99.200 -91.000 HIS 116 0.900 23.367 89.162 125.694 -99.200 -91.000 PHE 121 1.000 32.644 90.470 123.229 -99.200 -91.000 PHE 129 1.000 45.688 88.468 111.376 -99.200 -91.000 TYR 131 0.840 45.458 98.389 117.847 -99.200 -91.000 PHE 134 1.000 45.467 95.882 123.894 -99.200 -91.000 TRP 141 1.040 28.845 86.306 134.521 -99.200 -91.000 TRP6 141 1.020 27.870 84.922 136.150 -99.200 -91.000 PHE 142 1.000 27.117 83.185 130.684 -99.200 -91.000 TYR 150 0.840 29.156 75.362 141.947 -99.200 -91.000 PHE 151 1.000 23.317 78.384 140.633 -99.200 -91.000 HIS 158 0.900 17.708 86.515 129.746 -99.200 -91.000 HIS 167 0.900 27.484 86.969 147.119 -99.200 -91.000 TYR 168 0.840 28.903 89.520 143.209 -99.200 -91.000 HIS 169 0.900 24.786 95.351 143.403 -99.200 -91.000 PHE 186 1.000 14.990 76.932 117.704 -99.200 -91.000 TRP 197 1.040 22.830 79.337 117.558 -99.200 -91.000 TRP6 197 1.020 22.678 81.457 116.532 -99.200 -91.000 HIS 201 0.900 12.955 83.669 115.696 -99.200 -91.000 TRP 202 1.040 13.736 86.440 125.085 -99.200 -91.000 TRP6 202 1.020 15.779 85.335 124.716 -99.200 -91.000 TYR 225 0.840 27.968 79.623 139.050 -99.200 -91.000 PHE 237 1.000 41.249 89.046 136.332 -99.200 -91.000 HIS 242 0.900 54.202 82.366 133.244 -99.200 -91.000 TYR 245 0.840 51.632 80.460 121.761 -99.200 -91.000