============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TRP 24 1.040 30.316 36.674 16.023 -99.200 -91.000 TRP6 24 1.020 28.229 35.831 16.748 -99.200 -91.000 PHE 31 1.000 32.798 43.724 18.405 -99.200 -91.000 TYR 33 0.840 24.002 48.267 12.686 -99.200 -91.000 PHE 34 1.000 26.671 47.394 21.077 -99.200 -91.000 TRP 57 1.040 29.793 45.491 34.473 -99.200 -91.000 TRP6 57 1.020 29.839 47.714 33.700 -99.200 -91.000 PHE 58 1.000 31.280 41.572 36.481 -99.200 -91.000 HIS 87 0.900 27.689 55.696 33.879 -99.200 -91.000 PHE 88 1.000 22.016 56.068 37.243 -99.200 -91.000 TRP 113 1.040 19.847 52.278 21.560 -99.200 -91.000 TRP6 113 1.020 19.491 51.140 19.520 -99.200 -91.000 TYR 121 0.840 19.375 40.571 23.568 -99.200 -91.000 HIS 127 0.900 8.163 47.573 28.874 -99.200 -91.000 HIS 130 0.900 8.336 51.901 18.043 -99.200 -91.000 PHE 134 1.000 17.552 49.268 15.131 -99.200 -91.000 PHE 142 1.000 30.786 31.499 13.538 -99.200 -91.000 PHE 147 1.000 22.093 28.191 21.949 -99.200 -91.000 PHE 148 1.000 17.197 37.653 19.758 -99.200 -91.000 TYR 156 0.840 8.855 42.230 18.251 -99.200 -91.000 TYR 162 0.840 14.214 51.885 10.652 -99.200 -91.000 TYR 177 0.840 28.284 41.606 9.050 -99.200 -91.000 PHE 179 1.000 24.709 45.811 9.663 -99.200 -91.000 TYR 182 0.840 12.977 40.675 12.605 -99.200 -91.000