============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. TRP 6 1.040 -10.949 -1.283 13.573 -99.200 -91.000 TRP6 6 1.020 -10.552 -0.199 15.609 -99.200 -91.000 TYR 7 0.840 -13.907 4.393 8.947 -99.200 -91.000 PHE 14 1.000 -8.202 -2.433 9.603 -99.200 -91.000 TYR 28 0.840 -5.324 -0.885 4.510 -99.200 -91.000 TYR 37 0.840 -4.444 -3.570 -3.173 -99.200 -91.000 TYR 43 0.840 -8.299 -11.291 18.274 -99.200 -91.000 TRP 58 1.040 -3.526 -5.341 9.223 -99.200 -91.000 TRP6 58 1.020 -3.858 -4.043 11.148 -99.200 -91.000 TRP 62 1.040 0.681 -2.975 -0.343 -99.200 -91.000 TRP6 62 1.020 -1.369 -2.114 0.384 -99.200 -91.000 TYR 66 0.840 -9.806 -5.094 -10.612 -99.200 -91.000 HIS 70 0.900 5.383 -6.893 -9.340 -99.200 -91.000 TRP 75 1.040 -0.677 -1.477 8.967 -99.200 -91.000 TRP6 75 1.020 -1.123 -2.485 6.881 -99.200 -91.000 TYR 79 0.840 -9.841 -2.893 21.034 -99.200 -91.000 TRP 91 1.040 3.288 1.812 8.584 -99.200 -91.000 TRP6 91 1.020 4.765 2.219 6.781 -99.200 -91.000 TRP 103 1.040 20.797 -0.132 -0.926 -99.200 -91.000 TRP6 103 1.020 20.181 2.023 -0.242 -99.200 -91.000 HIS 110 0.900 4.099 7.036 13.351 -99.200 -91.000 PHE 113 1.000 -5.195 1.369 10.701 -99.200 -91.000