============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. TRP 3 1.040 -29.633 7.792 25.743 -99.200 -91.000 TRP6 3 1.020 -27.554 6.684 25.329 -99.200 -91.000 PHE 5 1.000 -31.479 13.086 16.062 -99.200 -91.000 HIS 17 0.900 -23.251 21.154 23.148 -99.200 -91.000 PHE 22 1.000 -26.604 20.150 13.978 -99.200 -91.000 TYR 25 0.840 -29.880 25.910 11.221 -99.200 -91.000 TYR 28 0.840 -40.803 22.348 9.907 -99.200 -91.000 HIS 48 0.900 -35.452 13.382 14.117 -99.200 -91.000 TYR 52 0.840 -38.357 10.696 16.279 -99.200 -91.000 PHE 63 1.000 -42.565 4.582 19.323 -99.200 -91.000 TYR 69 0.840 -36.639 13.076 20.135 -99.200 -91.000 TYR 73 0.840 -31.859 4.419 18.394 -99.200 -91.000 TYR 75 0.840 -25.954 4.763 18.622 -99.200 -91.000 PHE 94 1.000 -40.673 4.447 10.626 -99.200 -91.000 PHE 106 1.000 -29.835 17.116 11.972 -99.200 -91.000 TYR 111 0.840 -24.882 25.646 12.037 -99.200 -91.000 HIS 115 0.900 -31.283 30.266 7.523 -99.200 -91.000 TYR 123 0.840 -37.773 36.483 9.419 -99.200 -91.000