============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. HIS 21 0.900 42.315 70.749 -5.061 -99.200 -91.000 PHE 37 1.000 34.211 68.430 13.828 -99.200 -91.000 HIS 46 0.900 40.446 48.204 5.065 -99.200 -91.000 PHE 48 1.000 40.005 57.273 0.254 -99.200 -91.000 PHE 68 1.000 37.590 66.065 4.357 -99.200 -91.000 PHE 83 1.000 47.250 60.321 10.635 -99.200 -91.000 HIS 88 0.900 53.084 72.209 12.646 -99.200 -91.000 TYR 112 0.840 31.178 72.254 14.852 -99.200 -91.000 PHE 118 1.000 41.949 67.299 -3.026 -99.200 -91.000 HIS 120 0.900 49.266 64.831 -7.280 -99.200 -91.000 TRP 121 1.040 52.102 57.879 -6.464 -99.200 -91.000 TRP6 121 1.020 54.372 57.545 -7.038 -99.200 -91.000 TYR 132 0.840 54.642 74.460 -1.939 -99.200 -91.000 TYR 134 0.840 50.325 78.951 7.119 -99.200 -91.000