============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. HIS 21 0.900 66.870 52.335 29.441 -99.200 -91.000 TYR 33 0.840 72.370 55.155 10.214 -99.200 -91.000 HIS 36 0.900 70.257 59.288 2.933 -99.200 -91.000 HIS 42 0.900 64.371 55.116 -2.877 -99.200 -91.000 HIS 48 0.900 59.850 43.769 13.997 -99.200 -91.000 TYR 87 0.840 55.339 51.928 22.393 -99.200 -91.000 TRP 88 1.040 59.885 49.128 22.289 -99.200 -91.000 TRP6 88 1.020 61.227 47.213 22.644 -99.200 -91.000 PHE 122 1.000 54.635 22.510 10.106 -99.200 -91.000 PHE 132 1.000 70.512 25.673 26.353 -99.200 -91.000 PHE 148 1.000 61.522 20.416 25.601 -99.200 -91.000 TRP 156 1.040 67.826 16.427 27.960 -99.200 -91.000 TRP6 156 1.020 66.822 14.614 26.818 -99.200 -91.000 HIS 169 0.900 44.341 36.342 6.977 -99.200 -91.000 PHE 210 1.000 64.154 32.081 1.848 -99.200 -91.000 TYR 232 0.840 79.587 47.520 -0.099 -99.200 -91.000 TYR 237 0.840 82.022 38.434 7.186 -99.200 -91.000 TYR 256 0.840 81.784 34.744 -5.966 -99.200 -91.000 HIS 261 0.900 83.508 32.335 -1.196 -99.200 -91.000 PHE 262 1.000 77.297 33.996 -0.733 -99.200 -91.000 PHE 277 1.000 61.619 41.229 -4.917 -99.200 -91.000