============================================================================= 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. TRP 16 1.040 -12.351 22.070 6.834 -99.200 -91.000 TRP6 16 1.020 -13.689 23.957 6.322 -99.200 -91.000 TYR 24 0.840 -10.053 27.330 5.998 -99.200 -91.000 TYR 27 0.840 -9.328 32.381 2.865 -99.200 -91.000 TRP 28 1.040 -4.796 41.417 2.634 -99.200 -91.000 TRP6 28 1.020 -5.847 42.602 0.899 -99.200 -91.000 PHE 40 1.000 -17.898 38.753 -8.282 -99.200 -91.000 TRP 44 1.040 -9.316 37.225 7.695 -99.200 -91.000 TRP6 44 1.020 -9.761 37.150 10.023 -99.200 -91.000 TYR 51 0.840 -15.400 29.215 5.754 -99.200 -91.000 TYR 55 0.840 -19.233 24.324 7.339 -99.200 -91.000 PHE 66 1.000 -7.406 23.386 0.288 -99.200 -91.000 TYR 76 0.840 7.752 41.717 -4.274 -99.200 -91.000 TRP 83 1.040 -13.269 22.781 -3.867 -99.200 -91.000 TRP6 83 1.020 -15.233 21.762 -3.101 -99.200 -91.000 PHE 96 1.000 -7.338 25.229 -4.874 -99.200 -91.000 TRP 107 1.040 4.693 33.839 -0.103 -99.200 -91.000 TRP6 107 1.020 4.377 34.911 -2.190 -99.200 -91.000 HIS 112 0.900 -14.193 31.877 -9.796 -99.200 -91.000