============================================================================= 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. TYR 5 0.840 53.828 4.243 46.013 -99.200 -91.000 TYR 14 0.840 42.576 6.189 38.985 -99.200 -91.000 TYR 22 0.840 48.919 28.078 36.126 -99.200 -91.000 HIS 23 0.900 49.001 19.689 38.600 -99.200 -91.000 PHE 24 1.000 43.684 24.446 37.499 -99.200 -91.000 TRP 34 1.040 30.394 13.968 31.323 -99.200 -91.000 TRP6 34 1.020 29.726 16.022 32.099 -99.200 -91.000 HIS 40 0.900 40.000 22.819 46.635 -99.200 -91.000 TYR 42 0.840 34.706 28.269 38.059 -99.200 -91.000 PHE 64 1.000 49.055 18.041 26.568 -99.200 -91.000 HIS 73 0.900 26.551 19.321 45.101 -99.200 -91.000 TYR 76 0.840 32.792 25.036 46.584 -99.200 -91.000 TRP 121 1.040 51.967 15.140 38.285 -99.200 -91.000 TRP6 121 1.020 49.928 14.410 37.360 -99.200 -91.000 TYR 131 0.840 54.554 22.702 44.480 -99.200 -91.000 TYR 152 0.840 41.391 18.855 60.094 -99.200 -91.000 PHE 161 1.000 37.132 9.883 52.459 -99.200 -91.000 TYR 165 0.840 49.413 6.369 57.116 -99.200 -91.000 TRP 192 1.040 38.565 20.647 54.115 -99.200 -91.000 TRP6 192 1.020 38.933 20.914 56.443 -99.200 -91.000 TYR 205 0.840 41.848 12.909 51.404 -99.200 -91.000 TYR 211 0.840 28.759 15.138 47.119 -99.200 -91.000 TRP 214 1.040 25.131 16.962 41.165 -99.200 -91.000 TRP6 214 1.020 27.455 17.247 40.967 -99.200 -91.000