============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. HIS 23 0.900 11.481 35.511 -22.614 -99.200 -91.000 HIS 24 0.900 20.409 33.436 -26.962 -99.200 -91.000 TRP 36 1.040 10.886 26.071 -39.707 -99.200 -91.000 TRP6 36 1.020 10.714 25.649 -37.384 -99.200 -91.000 TYR 39 0.840 16.889 26.231 -34.552 -99.200 -91.000 TRP 41 1.040 17.866 17.580 -42.024 -99.200 -91.000 TRP6 41 1.020 20.147 17.511 -41.394 -99.200 -91.000 HIS 47 0.900 23.696 14.685 -39.723 -99.200 -91.000 PHE 56 1.000 25.107 16.398 -27.269 -99.200 -91.000 PHE 74 1.000 24.691 17.175 -21.705 -99.200 -91.000 PHE 79 1.000 23.112 19.339 -12.344 -99.200 -91.000 HIS 81 0.900 26.728 11.863 -16.281 -99.200 -91.000 TYR 83 0.840 19.416 17.544 -20.584 -99.200 -91.000 PHE 87 1.000 13.510 16.924 -31.408 -99.200 -91.000 HIS 94 0.900 1.665 29.640 -36.219 -99.200 -91.000 TYR 105 0.840 19.028 22.264 -15.372 -99.200 -91.000 TYR 112 0.840 6.115 22.762 -18.352 -99.200 -91.000 TYR 113 0.840 14.703 23.070 -18.808 -99.200 -91.000 HIS 117 0.900 7.725 32.564 -33.280 -99.200 -91.000 TYR 134 0.840 13.591 27.589 -14.372 -99.200 -91.000 HIS 135 0.900 5.579 25.451 -14.747 -99.200 -91.000 PHE 140 1.000 15.067 21.651 -4.070 -99.200 -91.000 HIS 166 0.900 28.503 32.028 -48.725 -99.200 -91.000