============================================================================= 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 24 0.900 33.887 19.617 69.052 -99.200 -91.000 TYR 25 0.840 43.869 16.569 70.090 -99.200 -91.000 PHE 62 1.000 30.015 11.115 68.991 -99.200 -91.000 HIS 80 0.900 41.861 1.233 78.375 -99.200 -91.000 TRP 105 1.040 30.251 5.568 80.847 -99.200 -91.000 TRP6 105 1.020 32.201 5.554 82.177 -99.200 -91.000 PHE 108 1.000 25.605 3.624 75.442 -99.200 -91.000 HIS 112 0.900 19.486 4.456 63.579 -99.200 -91.000 PHE 129 1.000 26.898 11.517 60.224 -99.200 -91.000 TYR 134 0.840 23.395 11.363 65.915 -99.200 -91.000 TYR 141 0.840 20.768 4.805 87.387 -99.200 -91.000 TYR 161 0.840 13.225 13.651 64.668 -99.200 -91.000 HIS 168 0.900 16.030 3.308 67.173 -99.200 -91.000 TRP 174 1.040 5.031 0.582 63.914 -99.200 -91.000 TRP6 174 1.020 3.408 -1.018 63.295 -99.200 -91.000 HIS 177 0.900 14.292 -3.445 61.699 -99.200 -91.000 PHE 210 1.000 7.415 -7.873 41.555 -99.200 -91.000 TYR 230 0.840 22.075 -7.848 66.392 -99.200 -91.000 TYR 242 0.840 1.163 -6.210 56.235 -99.200 -91.000 HIS 245 0.900 -4.077 -2.638 60.668 -99.200 -91.000 TRP 258 1.040 -16.930 -3.774 44.922 -99.200 -91.000 TRP6 258 1.020 -14.975 -5.049 45.348 -99.200 -91.000 HIS 262 0.900 -13.498 5.811 47.144 -99.200 -91.000 TYR 275 0.840 3.965 6.768 57.913 -99.200 -91.000