============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. PHE 9 1.000 23.718 16.215 30.108 -99.200 -91.000 HIS 13 0.900 24.739 13.145 38.098 -99.200 -91.000 HIS 16 0.900 24.261 14.587 34.658 -99.200 -91.000 PHE 51 1.000 29.276 21.969 23.209 -99.200 -91.000 TYR 61 0.840 24.450 6.588 29.248 -99.200 -91.000 TYR 66 0.840 18.952 4.814 26.213 -99.200 -91.000 PHE 68 1.000 18.865 7.861 19.941 -99.200 -91.000 TYR 79 0.840 14.479 31.821 29.281 -99.200 -91.000 PHE 87 1.000 12.245 21.524 22.583 -99.200 -91.000 TYR 89 0.840 5.505 14.462 27.214 -99.200 -91.000 TYR 97 0.840 9.196 21.693 39.070 -99.200 -91.000 TRP 122 1.040 18.890 14.476 40.106 -99.200 -91.000 TRP6 122 1.020 20.217 15.417 38.406 -99.200 -91.000