============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. TYR 10 0.840 48.740 13.169 36.853 -99.200 -91.000 HIS 26 0.900 26.604 18.304 57.733 -99.200 -91.000 TYR 32 0.840 43.918 9.545 63.194 -99.200 -91.000 TYR 38 0.840 45.350 1.298 48.868 -99.200 -91.000 HIS 39 0.900 51.451 1.356 40.158 -99.200 -91.000 HIS 50 0.900 49.823 17.667 62.614 -99.200 -91.000 PHE 54 1.000 40.477 16.624 59.677 -99.200 -91.000 PHE 58 1.000 48.946 14.716 54.191 -99.200 -91.000 PHE 60 1.000 49.808 10.585 48.753 -99.200 -91.000 PHE 74 1.000 41.273 11.493 50.371 -99.200 -91.000 HIS 104 0.900 37.819 15.743 43.600 -99.200 -91.000 TRP 105 1.040 41.397 9.032 39.650 -99.200 -91.000 TRP6 105 1.020 42.916 9.602 41.361 -99.200 -91.000 PHE 111 1.000 39.132 20.232 32.881 -99.200 -91.000 TRP 119 1.040 32.027 20.501 51.007 -99.200 -91.000 TRP6 119 1.020 32.707 19.839 53.189 -99.200 -91.000 HIS 120 0.900 34.654 13.499 46.761 -99.200 -91.000