============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. HIS 14 0.900 3.165 -3.555 19.830 -99.200 -91.000 TRP 20 1.040 14.053 -10.601 24.382 -99.200 -91.000 TRP6 20 1.020 14.396 -12.509 25.717 -99.200 -91.000 TYR 57 0.840 11.912 -3.713 19.076 -99.200 -91.000 TYR 64 0.840 9.443 -9.381 8.332 -99.200 -91.000 TRP 67 1.040 4.820 -3.445 8.697 -99.200 -91.000 TRP6 67 1.020 6.122 -4.127 10.541 -99.200 -91.000 TRP 68 1.040 8.452 -8.062 0.584 -99.200 -91.000 TRP6 68 1.020 10.126 -6.461 0.080 -99.200 -91.000 PHE 78 1.000 9.733 6.752 -6.645 -99.200 -91.000 HIS 79 0.900 12.287 1.310 -8.287 -99.200 -91.000 TYR 82 0.840 7.363 9.589 -10.237 -99.200 -91.000 TYR 97 0.840 2.467 1.816 2.480 -99.200 -91.000 PHE 98 1.000 7.193 0.209 6.970 -99.200 -91.000 TYR 106 0.840 11.467 2.997 7.389 -99.200 -91.000 TRP 113 1.040 12.185 -6.668 4.476 -99.200 -91.000 TRP6 113 1.020 10.683 -4.941 5.031 -99.200 -91.000 PHE 131 1.000 15.105 1.764 -10.577 -99.200 -91.000 PHE 135 1.000 17.214 7.824 -21.835 -99.200 -91.000