============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TYR 36 0.840 6.815 67.156 33.040 -99.200 -91.000 TYR 38 0.840 2.699 58.525 38.578 -99.200 -91.000 PHE 39 1.000 8.787 58.101 34.854 -99.200 -91.000 HIS 51 0.900 10.992 47.225 30.975 -99.200 -91.000 TRP 67 1.040 38.428 33.036 29.901 -99.200 -91.000 TRP6 67 1.020 38.740 34.954 28.533 -99.200 -91.000 HIS 85 0.900 12.992 48.137 23.796 -99.200 -91.000 PHE 92 1.000 23.088 50.708 28.479 -99.200 -91.000 HIS 96 0.900 21.971 62.406 32.132 -99.200 -91.000 PHE 105 1.000 26.709 44.310 30.733 -99.200 -91.000 PHE 118 1.000 41.194 37.881 31.744 -99.200 -91.000 TYR 128 0.840 34.363 51.712 32.698 -99.200 -91.000 PHE 133 1.000 32.677 46.072 19.310 -99.200 -91.000 HIS 137 0.900 27.868 46.410 16.048 -99.200 -91.000 TYR 167 0.840 37.967 58.688 -0.596 -99.200 -91.000 HIS 169 0.900 44.266 50.527 0.693 -99.200 -91.000 PHE 182 1.000 24.213 46.969 10.277 -99.200 -91.000 HIS 185 0.900 30.101 44.526 9.339 -99.200 -91.000 PHE 186 1.000 28.270 42.452 19.429 -99.200 -91.000 PHE 188 1.000 37.219 41.063 12.499 -99.200 -91.000