============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 2 0.840 71.367 -5.038 92.918 -99.200 -91.000 HIS 8 0.900 63.717 -16.092 91.494 -99.200 -91.000 TYR 18 0.840 52.149 -7.707 111.037 -99.200 -91.000 TRP 50 1.040 62.877 -17.697 100.578 -99.200 -91.000 TRP6 50 1.020 64.572 -19.005 101.588 -99.200 -91.000 HIS 53 0.900 58.956 -18.377 94.668 -99.200 -91.000 PHE 57 1.000 64.557 -26.568 98.447 -99.200 -91.000 TRP 73 1.040 64.255 -26.948 111.643 -99.200 -91.000 TRP6 73 1.020 63.026 -26.430 113.583 -99.200 -91.000 TYR 83 0.840 67.901 -7.471 107.107 -99.200 -91.000 PHE 88 1.000 63.789 -2.078 116.536 -99.200 -91.000 TYR 94 0.840 62.264 -13.451 119.127 -99.200 -91.000 TYR 98 0.840 56.359 -11.721 121.621 -99.200 -91.000 TYR 124 0.840 75.138 -11.642 110.264 -99.200 -91.000 PHE 134 1.000 67.343 -11.850 106.044 -99.200 -91.000 HIS 149 0.900 69.872 -38.502 107.804 -99.200 -91.000 HIS 164 0.900 81.389 -19.213 97.475 -99.200 -91.000 TYR 170 0.840 75.215 -7.171 97.016 -99.200 -91.000 HIS 175 0.900 79.574 -3.728 100.442 -99.200 -91.000 HIS 202 0.900 65.575 -22.907 126.475 -99.200 -91.000 PHE 203 1.000 60.051 -27.126 120.535 -99.200 -91.000 TYR 204 0.840 63.512 -31.246 119.638 -99.200 -91.000 HIS 215 0.900 50.161 -20.180 130.858 -99.200 -91.000 PHE 218 1.000 48.939 -24.371 137.604 -99.200 -91.000