============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 38 rings ring int. center anis. iso. TRP 14 1.040 73.839 14.683 -30.051 -99.200 -91.000 TRP6 14 1.020 71.926 13.345 -29.709 -99.200 -91.000 HIS 42 0.900 61.632 28.518 -19.308 -99.200 -91.000 TRP 45 1.040 70.739 27.815 -23.962 -99.200 -91.000 TRP6 45 1.020 69.524 25.980 -24.853 -99.200 -91.000 HIS 53 0.900 78.015 19.504 -12.618 -99.200 -91.000 HIS 59 0.900 60.204 17.481 -19.642 -99.200 -91.000 TRP 90 1.040 52.770 6.219 -8.443 -99.200 -91.000 TRP6 90 1.020 50.960 7.761 -8.517 -99.200 -91.000 TYR 99 0.840 49.086 18.422 -2.986 -99.200 -91.000 HIS 102 0.900 54.930 19.084 -5.721 -99.200 -91.000 TRP 110 1.040 60.266 17.412 -14.560 -99.200 -91.000 TRP6 110 1.020 60.821 19.710 -14.512 -99.200 -91.000 PHE 112 1.000 61.727 9.839 -17.526 -99.200 -91.000 PHE 115 1.000 65.058 14.279 -9.383 -99.200 -91.000 PHE 120 1.000 64.823 15.182 -25.851 -99.200 -91.000 PHE 124 1.000 62.732 6.597 -22.037 -99.200 -91.000 HIS 125 0.900 65.348 3.311 -13.890 -99.200 -91.000 PHE 156 1.000 42.886 18.421 -21.151 -99.200 -91.000 HIS 157 0.900 47.412 19.991 -11.944 -99.200 -91.000 HIS 188 0.900 37.807 18.453 -23.876 -99.200 -91.000 PHE 195 1.000 37.582 37.529 -22.689 -99.200 -91.000 HIS 202 0.900 51.046 30.284 -38.690 -99.200 -91.000 TYR 210 0.840 43.378 22.168 -29.318 -99.200 -91.000 TYR 218 0.840 52.588 42.074 -27.466 -99.200 -91.000 HIS 247 0.900 57.522 41.827 -13.555 -99.200 -91.000 PHE 249 1.000 52.067 33.774 -11.040 -99.200 -91.000 TYR 267 0.840 61.303 25.481 -15.291 -99.200 -91.000 TRP 281 1.040 45.517 38.128 -3.639 -99.200 -91.000 TRP6 281 1.020 46.323 37.360 -1.541 -99.200 -91.000 HIS 287 0.900 37.457 34.710 0.646 -99.200 -91.000 HIS 289 0.900 40.579 30.881 -2.827 -99.200 -91.000 HIS 291 0.900 44.500 27.337 -6.419 -99.200 -91.000 HIS 322 0.900 58.470 23.199 -36.988 -99.200 -91.000 PHE 324 1.000 62.662 18.403 -36.740 -99.200 -91.000 HIS 352 0.900 59.433 4.450 -37.807 -99.200 -91.000 TYR 353 0.840 64.190 1.960 -31.734 -99.200 -91.000 HIS 360 0.900 59.929 -12.650 -29.208 -99.200 -91.000