============================================================================= 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. HIS 2 0.900 2.785 -19.374 22.562 -99.200 -91.000 TRP 15 1.040 -9.876 -12.131 8.348 -99.200 -91.000 TRP6 15 1.020 -8.625 -10.155 8.067 -99.200 -91.000 TYR 28 0.840 -0.761 -3.080 -1.534 -99.200 -91.000 TYR 35 0.840 4.411 4.183 6.324 -99.200 -91.000 TRP 37 1.040 9.391 4.441 1.698 -99.200 -91.000 TRP6 37 1.020 8.712 6.098 3.224 -99.200 -91.000 PHE 41 1.000 8.594 -2.533 -4.282 -99.200 -91.000 PHE 42 1.000 2.606 -1.637 -5.824 -99.200 -91.000 PHE 45 1.000 -0.646 -1.548 -9.519 -99.200 -91.000 PHE 71 1.000 -3.285 -10.535 7.316 -99.200 -91.000 HIS 77 0.900 -3.209 -23.097 6.178 -99.200 -91.000 PHE 85 1.000 1.182 -15.897 4.155 -99.200 -91.000 HIS 92 0.900 5.396 -10.988 -2.511 -99.200 -91.000 HIS 97 0.900 13.821 -8.639 -8.507 -99.200 -91.000 PHE 103 1.000 6.826 -8.737 2.314 -99.200 -91.000 HIS 116 0.900 -10.796 5.583 10.142 -99.200 -91.000 HIS 117 0.900 -15.052 -0.806 8.872 -99.200 -91.000 PHE 118 1.000 -13.816 -4.590 12.909 -99.200 -91.000 PHE 122 1.000 -7.472 -3.239 16.112 -99.200 -91.000 TYR 130 0.840 -6.440 -8.892 13.867 -99.200 -91.000 HIS 143 0.900 11.665 -19.452 6.401 -99.200 -91.000 TYR 145 0.840 12.415 -11.455 0.439 -99.200 -91.000 HIS 146 0.900 17.882 -16.340 -2.774 -99.200 -91.000