============================================================================= 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 4 0.840 5.058 103.027 73.135 -99.200 -91.000 TYR 15 0.840 0.350 87.681 77.224 -99.200 -91.000 PHE 18 1.000 -0.025 88.124 82.491 -99.200 -91.000 PHE 26 1.000 3.385 76.895 78.396 -99.200 -91.000 PHE 28 1.000 6.835 83.126 77.170 -99.200 -91.000 TRP 37 1.040 2.060 88.701 70.326 -99.200 -91.000 TRP6 37 1.020 2.249 87.901 72.537 -99.200 -91.000 HIS 44 0.900 1.856 98.297 57.892 -99.200 -91.000 PHE 47 1.000 2.068 100.501 62.350 -99.200 -91.000 TYR 60 0.840 3.251 100.012 67.004 -99.200 -91.000 PHE 76 1.000 -9.593 91.851 90.442 -99.200 -91.000 PHE 106 1.000 2.795 79.703 53.454 -99.200 -91.000 TYR 110 0.840 7.276 84.644 58.695 -99.200 -91.000 PHE 114 1.000 1.811 86.957 57.875 -99.200 -91.000 TYR 121 0.840 -3.166 101.071 62.387 -99.200 -91.000 PHE 127 1.000 -16.290 96.067 54.988 -99.200 -91.000 TYR 145 0.840 -1.011 93.194 59.491 -99.200 -91.000 TRP 157 1.040 -13.915 76.835 62.373 -99.200 -91.000 TRP6 157 1.020 -13.126 78.992 62.923 -99.200 -91.000 PHE 182 1.000 -20.617 91.652 57.067 -99.200 -91.000 PHE 186 1.000 -17.499 95.594 60.759 -99.200 -91.000 TYR 195 0.840 0.529 94.294 68.411 -99.200 -91.000 TYR 205 0.840 -6.749 82.623 56.336 -99.200 -91.000 PHE 206 1.000 -2.061 84.372 55.544 -99.200 -91.000