============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. PHE 6 1.000 -30.185 19.876 116.273 -99.200 -91.000 TYR 7 0.840 -36.095 23.545 113.296 -99.200 -91.000 PHE 14 1.000 -30.140 22.554 110.507 -99.200 -91.000 TYR 15 0.840 -29.720 13.843 111.105 -99.200 -91.000 PHE 25 1.000 -26.116 3.432 113.667 -99.200 -91.000 HIS 41 0.900 -7.218 16.663 105.928 -99.200 -91.000 PHE 52 1.000 -16.049 6.238 109.099 -99.200 -91.000 TYR 64 0.840 -5.756 19.303 95.574 -99.200 -91.000 PHE 79 1.000 -8.721 15.502 98.162 -99.200 -91.000 HIS 85 0.900 -20.659 3.585 96.136 -99.200 -91.000 TYR 109 0.840 -22.395 26.583 104.304 -99.200 -91.000 PHE 129 1.000 -10.693 27.952 109.593 -99.200 -91.000 PHE 152 1.000 -20.772 16.742 111.219 -99.200 -91.000 TYR 154 0.840 -18.313 16.781 116.352 -99.200 -91.000 PHE 165 1.000 -31.367 31.346 112.088 -99.200 -91.000 PHE 166 1.000 -33.588 26.662 111.560 -99.200 -91.000