============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. HIS 28 0.900 10.610 2.764 -19.386 -99.200 -91.000 TYR 34 0.840 1.399 8.425 -12.580 -99.200 -91.000 PHE 39 1.000 1.426 15.070 -4.875 -99.200 -91.000 PHE 56 1.000 4.827 17.847 -8.752 -99.200 -91.000 TYR 79 0.840 15.714 12.364 -6.845 -99.200 -91.000 PHE 88 1.000 10.162 11.347 -20.504 -99.200 -91.000 PHE 92 1.000 20.210 20.872 -11.416 -99.200 -91.000 PHE 95 1.000 19.376 23.368 -6.093 -99.200 -91.000 PHE 108 1.000 18.296 26.797 29.200 -99.200 -91.000 PHE 117 1.000 0.218 33.856 30.102 -99.200 -91.000 HIS 119 0.900 9.213 37.281 24.756 -99.200 -91.000 PHE 122 1.000 7.334 39.365 18.118 -99.200 -91.000 TYR 125 0.840 2.429 26.387 25.951 -99.200 -91.000 PHE 130 1.000 3.335 20.738 18.214 -99.200 -91.000 TYR 135 0.840 9.365 34.126 19.483 -99.200 -91.000 PHE 147 1.000 8.650 21.046 20.541 -99.200 -91.000 TYR 164 0.840 24.167 28.123 11.076 -99.200 -91.000 PHE 167 1.000 20.235 28.356 19.630 -99.200 -91.000 TYR 171 0.840 21.461 30.327 24.918 -99.200 -91.000 PHE 177 1.000 10.297 34.360 29.791 -99.200 -91.000