============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. TYR 2 0.840 65.043 28.278 13.960 -99.200 -91.000 PHE 3 1.000 57.593 29.933 8.701 -99.200 -91.000 HIS 7 0.900 46.525 31.138 8.854 -99.200 -91.000 PHE 34 1.000 54.673 42.784 17.147 -99.200 -91.000 PHE 39 1.000 49.701 35.566 18.553 -99.200 -91.000 PHE 48 1.000 35.976 43.631 6.563 -99.200 -91.000 TYR 54 0.840 23.635 40.485 5.284 -99.200 -91.000 TYR 65 0.840 26.113 38.134 10.913 -99.200 -91.000 HIS 67 0.900 32.411 34.838 14.479 -99.200 -91.000 TYR 117 0.840 49.865 25.765 10.978 -99.200 -91.000