============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. TRP 20 1.040 54.560 15.824 -13.687 -99.200 -91.000 TRP6 20 1.020 52.637 16.252 -14.996 -99.200 -91.000 HIS 22 0.900 51.140 10.098 -5.387 -99.200 -91.000 TRP 48 1.040 43.720 7.788 0.704 -99.200 -91.000 TRP6 48 1.020 43.796 8.321 3.004 -99.200 -91.000 PHE 64 1.000 55.181 11.568 -16.006 -99.200 -91.000 HIS 75 0.900 52.645 8.780 7.828 -99.200 -91.000 HIS 77 0.900 49.406 6.501 10.608 -99.200 -91.000 HIS 95 0.900 64.010 2.614 -2.421 -99.200 -91.000 TYR 109 0.840 48.918 -0.848 6.220 -99.200 -91.000 PHE 124 1.000 65.729 6.933 -7.051 -99.200 -91.000 PHE 132 1.000 66.528 15.689 8.621 -99.200 -91.000 TYR 133 0.840 63.161 9.852 12.663 -99.200 -91.000 HIS 138 0.900 50.733 11.643 10.857 -99.200 -91.000 TRP 146 1.040 66.405 19.419 0.116 -99.200 -91.000 TRP6 146 1.020 65.189 21.446 0.281 -99.200 -91.000 TYR 150 0.840 63.780 19.895 -9.787 -99.200 -91.000 TYR 173 0.840 55.842 9.376 19.590 -99.200 -91.000 TRP 177 1.040 54.338 17.655 14.151 -99.200 -91.000 TRP6 177 1.020 52.168 16.727 13.950 -99.200 -91.000 TYR 188 0.840 65.990 19.639 4.141 -99.200 -91.000 HIS 198 0.900 45.560 16.295 4.783 -99.200 -91.000 HIS 209 0.900 48.686 27.137 9.448 -99.200 -91.000