============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 9 rings ring int. center anis. iso. HIS 4 0.900 22.463 35.200 7.340 -99.200 -91.000 PHE 11 1.000 6.284 27.884 24.220 -99.200 -91.000 PHE 13 1.000 2.022 24.753 14.451 -99.200 -91.000 PHE 23 1.000 7.702 25.072 14.867 -99.200 -91.000 PHE 30 1.000 18.180 27.863 7.450 -99.200 -91.000 TRP 39 1.040 -1.339 31.711 11.416 -99.200 -91.000 TRP6 39 1.020 -1.023 29.410 11.921 -99.200 -91.000 PHE 51 1.000 7.024 29.550 11.644 -99.200 -91.000 PHE 55 1.000 2.718 27.391 19.128 -99.200 -91.000