============================================================================= 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 14 1.040 31.774 23.241 30.209 -99.200 -91.000 TRP6 14 1.020 30.722 21.112 30.275 -99.200 -91.000 HIS 20 0.900 39.532 15.441 27.034 -99.200 -91.000 TYR 24 0.840 35.128 14.436 29.241 -99.200 -91.000 PHE 33 1.000 20.571 7.816 23.869 -99.200 -91.000 PHE 36 1.000 18.531 6.821 34.297 -99.200 -91.000 TYR 42 0.840 11.344 11.870 24.631 -99.200 -91.000 PHE 43 1.000 17.958 11.366 21.276 -99.200 -91.000 HIS 45 0.900 15.389 10.871 15.532 -99.200 -91.000 PHE 46 1.000 19.787 10.977 16.338 -99.200 -91.000 HIS 50 0.900 30.999 2.518 22.486 -99.200 -91.000 HIS 58 0.900 21.621 15.152 20.868 -99.200 -91.000 HIS 72 0.900 27.233 33.660 26.783 -99.200 -91.000 HIS 87 0.900 15.628 20.996 23.716 -99.200 -91.000 HIS 89 0.900 7.354 26.984 21.222 -99.200 -91.000 PHE 98 1.000 14.864 18.789 29.231 -99.200 -91.000 HIS 103 0.900 22.496 9.835 38.045 -99.200 -91.000 HIS 112 0.900 35.877 11.041 31.062 -99.200 -91.000 PHE 117 1.000 31.518 14.857 40.876 -99.200 -91.000 HIS 122 0.900 27.767 15.169 43.462 -99.200 -91.000 PHE 128 1.000 25.714 25.048 34.177 -99.200 -91.000 TYR 140 0.840 9.044 21.268 27.366 -99.200 -91.000