============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. TYR 16 0.840 10.113 33.856 38.003 -99.200 -91.000 PHE 20 1.000 16.156 29.285 35.101 -99.200 -91.000 TYR 29 0.840 27.011 25.691 52.204 -99.200 -91.000 PHE 49 1.000 11.018 24.965 45.718 -99.200 -91.000 HIS 61 0.900 32.247 21.043 50.783 -99.200 -91.000 TRP 70 1.040 38.735 20.661 62.796 -99.200 -91.000 TRP6 70 1.020 38.911 19.164 64.624 -99.200 -91.000 PHE 80 1.000 44.602 31.724 54.009 -99.200 -91.000 HIS 81 0.900 53.212 33.184 50.419 -99.200 -91.000 PHE 121 1.000 30.340 11.282 44.149 -99.200 -91.000 HIS 134 0.900 47.532 28.435 41.258 -99.200 -91.000 PHE 141 1.000 52.251 18.633 48.628 -99.200 -91.000 TYR 161 0.840 20.759 8.797 44.499 -99.200 -91.000 PHE 177 1.000 48.961 18.631 44.119 -99.200 -91.000 HIS 257 0.900 22.749 33.976 37.897 -99.200 -91.000 HIS 265 0.900 14.750 30.372 52.437 -99.200 -91.000 PHE 272 1.000 12.443 28.754 41.720 -99.200 -91.000