============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. PHE 18 1.000 44.225 16.802 92.333 -99.200 -91.000 PHE 21 1.000 44.908 27.720 90.630 -99.200 -91.000 TYR 29 0.840 51.913 31.962 114.152 -99.200 -91.000 PHE 71 1.000 73.933 25.664 100.828 -99.200 -91.000 TYR 103 0.840 62.588 32.814 106.296 -99.200 -91.000 PHE 109 1.000 72.954 26.596 110.351 -99.200 -91.000 TYR 121 0.840 68.614 22.349 99.337 -99.200 -91.000 TYR 124 0.840 65.178 17.140 97.438 -99.200 -91.000 HIS 134 0.900 52.212 15.458 97.068 -99.200 -91.000 PHE 143 1.000 58.092 31.792 95.560 -99.200 -91.000 PHE 146 1.000 46.535 31.415 93.141 -99.200 -91.000 TYR 152 0.840 55.834 19.012 91.016 -99.200 -91.000 HIS 159 0.900 54.227 35.431 95.417 -99.200 -91.000 PHE 164 1.000 42.832 40.636 96.327 -99.200 -91.000 TYR 207 0.840 39.802 38.603 83.869 -99.200 -91.000 TYR 210 0.840 48.003 38.613 87.506 -99.200 -91.000 PHE 217 1.000 40.827 32.917 93.982 -99.200 -91.000 TYR 220 0.840 34.986 31.635 86.448 -99.200 -91.000 TYR 238 0.840 32.604 20.566 100.866 -99.200 -91.000 PHE 239 1.000 29.333 17.046 98.584 -99.200 -91.000 TYR 250 0.840 33.556 37.951 98.325 -99.200 -91.000 PHE 264 1.000 39.060 32.012 99.819 -99.200 -91.000 PHE 269 1.000 25.670 38.113 104.386 -99.200 -91.000 TYR 280 0.840 26.098 22.289 109.597 -99.200 -91.000 TYR 281 0.840 32.347 21.030 109.528 -99.200 -91.000