============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. PHE 12 1.000 26.218 56.781 46.703 -99.200 -91.000 PHE 26 1.000 1.370 47.395 52.607 -99.200 -91.000 TYR 31 0.840 -1.733 43.317 54.116 -99.200 -91.000 TYR 38 0.840 21.144 42.736 38.802 -99.200 -91.000 PHE 71 1.000 21.626 47.095 37.835 -99.200 -91.000 PHE 72 1.000 15.410 42.179 39.220 -99.200 -91.000 PHE 78 1.000 7.400 40.133 39.637 -99.200 -91.000 PHE 98 1.000 27.881 56.076 32.560 -99.200 -91.000 PHE 103 1.000 20.718 51.595 35.419 -99.200 -91.000 PHE 127 1.000 29.745 68.537 50.835 -99.200 -91.000 TYR 132 0.840 20.401 65.443 37.918 -99.200 -91.000 TYR 151 0.840 28.398 54.186 39.905 -99.200 -91.000 HIS 152 0.900 31.981 61.621 44.472 -99.200 -91.000 TYR 159 0.840 25.792 64.293 34.913 -99.200 -91.000 PHE 160 1.000 25.506 68.667 32.386 -99.200 -91.000