============================================================================= 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. PHE 25 1.000 -11.073 21.678 51.118 -99.200 -91.000 PHE 37 1.000 -18.065 11.525 53.805 -99.200 -91.000 HIS 47 0.900 -8.998 12.168 57.188 -99.200 -91.000 TYR 49 0.840 -9.703 4.532 54.501 -99.200 -91.000 HIS 68 0.900 -15.400 0.573 44.775 -99.200 -91.000 TYR 70 0.840 -25.315 3.352 44.524 -99.200 -91.000 TRP 72 1.040 -21.235 5.945 51.481 -99.200 -91.000 TRP6 72 1.020 -19.854 7.849 51.243 -99.200 -91.000 TRP 92 1.040 -16.745 7.286 40.403 -99.200 -91.000 TRP6 92 1.020 -15.924 8.783 42.055 -99.200 -91.000 TRP 107 1.040 -23.113 9.247 42.803 -99.200 -91.000 TRP6 107 1.020 -22.224 11.114 43.961 -99.200 -91.000 HIS 111 0.900 -21.236 17.844 41.687 -99.200 -91.000 HIS 113 0.900 -30.144 18.204 41.632 -99.200 -91.000 PHE 119 1.000 -11.396 19.610 45.430 -99.200 -91.000 HIS 139 0.900 -7.174 17.893 33.574 -99.200 -91.000 TYR 140 0.840 -6.091 23.430 39.630 -99.200 -91.000 HIS 141 0.900 -0.544 16.525 33.633 -99.200 -91.000 TRP 153 1.040 -6.094 22.426 29.637 -99.200 -91.000 TRP6 153 1.020 -4.568 21.021 30.774 -99.200 -91.000 PHE 167 1.000 -5.585 31.247 31.443 -99.200 -91.000 TYR 171 0.840 3.713 21.455 42.998 -99.200 -91.000 TYR 178 0.840 5.208 17.694 53.638 -99.200 -91.000 TYR 181 0.840 0.341 14.152 52.886 -99.200 -91.000