============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. HIS 6 0.900 23.126 -65.337 40.337 -99.200 -91.000 TRP 31 1.040 26.124 -55.025 19.940 -99.200 -91.000 TRP6 31 1.020 27.583 -56.281 21.314 -99.200 -91.000 TRP 49 1.040 26.149 -70.440 23.332 -99.200 -91.000 TRP6 49 1.020 27.263 -68.387 23.599 -99.200 -91.000 TYR 59 0.840 29.492 -64.292 22.173 -99.200 -91.000 PHE 63 1.000 21.494 -59.609 33.372 -99.200 -91.000 TYR 68 0.840 12.048 -57.535 38.901 -99.200 -91.000 PHE 69 1.000 13.574 -52.579 39.792 -99.200 -91.000 PHE 77 1.000 20.127 -42.843 36.150 -99.200 -91.000 PHE 78 1.000 20.811 -48.034 36.264 -99.200 -91.000 PHE 85 1.000 29.530 -62.444 28.308 -99.200 -91.000 HIS 86 0.900 37.059 -59.052 25.737 -99.200 -91.000 HIS 93 0.900 29.054 -71.875 34.119 -99.200 -91.000 TYR 94 0.840 33.085 -67.627 29.137 -99.200 -91.000 HIS 95 0.900 26.820 -68.065 37.433 -99.200 -91.000 TYR 103 0.840 15.989 -44.422 40.900 -99.200 -91.000 TYR 105 0.840 23.692 -51.753 36.385 -99.200 -91.000 TYR 108 0.840 29.447 -61.151 40.755 -99.200 -91.000