============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. PHE 34 1.000 43.213 -44.096 -14.495 -99.200 -91.000 TYR 42 0.840 49.100 -38.865 -1.441 -99.200 -91.000 PHE 65 1.000 40.233 -43.269 1.256 -99.200 -91.000 TYR 72 0.840 27.382 -35.133 8.387 -99.200 -91.000 TYR 79 0.840 35.629 -30.928 -6.132 -99.200 -91.000 HIS 89 0.900 41.631 -15.578 -19.242 -99.200 -91.000 PHE 113 1.000 37.952 -27.234 -9.488 -99.200 -91.000 PHE 129 1.000 32.177 -32.323 -23.744 -99.200 -91.000 TYR 142 0.840 10.979 -20.717 -19.638 -99.200 -91.000 TYR 156 0.840 15.659 -35.839 -22.362 -99.200 -91.000 TYR 172 0.840 25.931 -30.726 -29.232 -99.200 -91.000 PHE 198 1.000 31.937 -26.363 -12.405 -99.200 -91.000