============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. HIS 14 0.900 40.475 10.296 56.426 -99.200 -91.000 HIS 15 0.900 42.247 20.166 56.774 -99.200 -91.000 TYR 49 0.840 32.097 26.468 52.288 -99.200 -91.000 PHE 55 1.000 33.766 22.092 51.427 -99.200 -91.000 PHE 65 1.000 31.237 19.895 60.808 -99.200 -91.000 PHE 80 1.000 30.747 25.236 46.614 -99.200 -91.000 HIS 81 0.900 23.226 28.103 43.342 -99.200 -91.000 TYR 83 0.840 23.464 30.318 39.224 -99.200 -91.000 TYR 86 0.840 31.390 27.258 41.937 -99.200 -91.000 PHE 124 1.000 7.507 27.432 54.190 -99.200 -91.000 HIS 130 0.900 15.172 15.059 40.414 -99.200 -91.000 TYR 132 0.840 20.100 16.718 36.742 -99.200 -91.000 PHE 150 1.000 32.358 8.753 47.394 -99.200 -91.000 PHE 154 1.000 23.881 2.224 33.706 -99.200 -91.000 TYR 161 0.840 13.290 15.151 45.549 -99.200 -91.000 PHE 178 1.000 4.979 25.533 59.674 -99.200 -91.000 HIS 183 0.900 0.353 24.522 48.065 -99.200 -91.000 TYR 187 0.840 13.890 22.869 41.942 -99.200 -91.000 TYR 195 0.840 15.203 35.276 37.871 -99.200 -91.000 HIS 225 0.900 26.754 7.450 42.717 -99.200 -91.000 PHE 231 1.000 11.743 18.098 54.020 -99.200 -91.000 TRP 262 1.040 8.334 22.482 58.258 -99.200 -91.000 TRP6 262 1.020 7.978 22.765 55.942 -99.200 -91.000 PHE 263 1.000 14.748 22.718 56.311 -99.200 -91.000