============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. PHE 20 1.000 -22.736 140.851 -5.026 -99.200 -91.000 PHE 21 1.000 -29.834 138.406 -6.049 -99.200 -91.000 TRP 36 1.040 -32.860 147.059 -5.353 -99.200 -91.000 TRP6 36 1.020 -32.744 145.026 -6.555 -99.200 -91.000 PHE 37 1.000 -41.083 148.981 -4.830 -99.200 -91.000 TRP 55 1.040 -27.735 155.972 -5.457 -99.200 -91.000 TRP6 55 1.020 -25.801 157.330 -5.511 -99.200 -91.000 TYR 66 0.840 -24.986 140.979 3.945 -99.200 -91.000 TYR 76 0.840 -36.250 139.704 -2.799 -99.200 -91.000 PHE 97 1.000 -30.405 123.026 -2.859 -99.200 -91.000 PHE 102 1.000 -30.387 112.639 7.215 -99.200 -91.000 PHE 111 1.000 -36.173 104.324 21.710 -99.200 -91.000 TRP 133 1.040 -35.031 104.847 9.527 -99.200 -91.000 TRP6 133 1.020 -33.927 105.806 11.387 -99.200 -91.000 HIS 135 0.900 -29.126 96.900 14.564 -99.200 -91.000 PHE 148 1.000 -36.186 96.249 13.607 -99.200 -91.000 TYR 155 0.840 -39.964 110.925 13.554 -99.200 -91.000 TYR 169 0.840 -31.291 100.613 14.955 -99.200 -91.000 PHE 183 1.000 -23.553 109.331 7.080 -99.200 -91.000