============================================================================= 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 35.019 72.929 84.554 -99.200 -91.000 PHE 21 1.000 41.563 64.253 82.955 -99.200 -91.000 TYR 29 0.840 29.075 50.718 99.521 -99.200 -91.000 PHE 71 1.000 16.058 49.105 75.961 -99.200 -91.000 TYR 103 0.840 25.553 46.726 86.941 -99.200 -91.000 PHE 109 1.000 12.552 45.126 83.947 -99.200 -91.000 TYR 121 0.840 18.749 54.284 78.231 -99.200 -91.000 TYR 124 0.840 18.456 60.815 78.493 -99.200 -91.000 HIS 134 0.900 27.149 66.193 85.549 -99.200 -91.000 PHE 143 1.000 32.783 52.836 80.393 -99.200 -91.000 PHE 146 1.000 41.566 59.691 84.248 -99.200 -91.000 TYR 152 0.840 28.836 65.683 77.507 -99.200 -91.000 HIS 159 0.900 37.663 51.728 82.111 -99.200 -91.000 PHE 164 1.000 48.374 53.327 88.898 -99.200 -91.000 TYR 207 0.840 54.331 60.186 79.745 -99.200 -91.000 TYR 210 0.840 47.199 54.957 78.668 -99.200 -91.000 PHE 217 1.000 46.086 61.278 87.966 -99.200 -91.000 TYR 220 0.840 52.374 67.568 84.336 -99.200 -91.000 TYR 238 0.840 41.310 73.309 98.120 -99.200 -91.000 PHE 239 1.000 42.964 78.087 98.095 -99.200 -91.000 TYR 250 0.840 52.167 59.473 95.302 -99.200 -91.000 PHE 264 1.000 44.170 61.118 93.862 -99.200 -91.000 PHE 269 1.000 55.449 61.300 104.530 -99.200 -91.000 TYR 280 0.840 42.965 71.962 109.080 -99.200 -91.000 TYR 281 0.840 36.719 70.331 106.207 -99.200 -91.000