============================================================================= 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 20.418 96.193 6.966 -99.200 -91.000 PHE 26 1.000 23.102 81.007 -15.445 -99.200 -91.000 TYR 31 0.840 21.327 79.871 -20.606 -99.200 -91.000 TYR 38 0.840 6.428 89.317 0.489 -99.200 -91.000 PHE 70 1.000 9.202 88.525 3.884 -99.200 -91.000 PHE 71 1.000 7.829 85.042 -3.282 -99.200 -91.000 PHE 77 1.000 8.227 79.054 -8.988 -99.200 -91.000 PHE 97 1.000 11.637 89.340 15.712 -99.200 -91.000 PHE 102 1.000 11.688 85.881 7.597 -99.200 -91.000 PHE 126 1.000 31.050 100.071 13.418 -99.200 -91.000 TYR 131 0.840 24.031 85.344 14.248 -99.200 -91.000 TYR 150 0.840 14.021 94.235 10.582 -99.200 -91.000 HIS 151 0.900 21.345 98.943 14.211 -99.200 -91.000 TYR 158 0.840 19.972 87.996 18.185 -99.200 -91.000 PHE 159 1.000 22.269 85.796 22.154 -99.200 -91.000