============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. PHE 1 1.000 61.921 5.118 31.523 -99.200 -91.000 TRP 9 1.040 65.213 9.927 47.874 -99.200 -91.000 TRP6 9 1.020 66.658 11.340 46.642 -99.200 -91.000 PHE 22 1.000 63.997 6.311 37.081 -99.200 -91.000 PHE 33 1.000 77.709 -7.776 47.226 -99.200 -91.000 HIS 34 0.900 73.406 -1.181 47.540 -99.200 -91.000 PHE 46 1.000 66.414 3.058 33.030 -99.200 -91.000 PHE 50 1.000 74.001 12.784 43.346 -99.200 -91.000 PHE 63 1.000 81.943 -0.811 38.727 -99.200 -91.000 TYR 80 0.840 70.657 10.802 26.749 -99.200 -91.000 PHE 94 1.000 65.123 20.760 31.124 -99.200 -91.000 PHE 95 1.000 69.121 19.689 38.870 -99.200 -91.000 HIS 155 0.900 49.091 18.221 31.443 -99.200 -91.000 TRP 167 1.040 56.902 4.000 45.624 -99.200 -91.000 TRP6 167 1.020 58.495 3.013 47.049 -99.200 -91.000