============================================================================= 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. PHE 4 1.000 38.034 2.836 16.914 -99.200 -91.000 TYR 18 0.840 44.032 20.317 15.064 -99.200 -91.000 TYR 24 0.840 34.233 25.664 11.385 -99.200 -91.000 TYR 25 0.840 39.696 28.240 17.916 -99.200 -91.000 HIS 31 0.900 35.674 16.071 20.489 -99.200 -91.000 PHE 67 1.000 39.794 7.976 16.464 -99.200 -91.000 TYR 88 0.840 26.899 0.698 9.436 -99.200 -91.000 PHE 104 1.000 35.898 11.368 13.566 -99.200 -91.000 PHE 114 1.000 27.851 14.100 -0.070 -99.200 -91.000 TRP 126 1.040 30.443 -1.590 -5.684 -99.200 -91.000 TRP6 126 1.020 29.324 -1.011 -3.693 -99.200 -91.000 TRP 138 1.040 34.115 14.852 1.746 -99.200 -91.000 TRP6 138 1.020 33.841 12.834 0.577 -99.200 -91.000 TYR 139 0.840 37.398 15.047 -5.476 -99.200 -91.000 PHE 153 1.000 31.466 5.289 0.675 -99.200 -91.000 TRP 158 1.040 40.619 -1.846 4.912 -99.200 -91.000 TRP6 158 1.020 39.656 0.109 5.768 -99.200 -91.000 TYR 161 0.840 42.124 5.399 4.198 -99.200 -91.000