============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TRP 7 1.040 33.182 31.997 13.519 -99.200 -91.000 TRP6 7 1.020 35.288 33.049 13.298 -99.200 -91.000 PHE 26 1.000 26.775 37.875 9.771 -99.200 -91.000 TYR 30 0.840 25.961 32.737 20.369 -99.200 -91.000 HIS 51 0.900 31.263 47.949 7.256 -99.200 -91.000 PHE 59 1.000 31.781 40.755 13.704 -99.200 -91.000 PHE 61 1.000 26.787 37.738 15.983 -99.200 -91.000 HIS 64 0.900 13.729 35.072 18.598 -99.200 -91.000 TRP 65 1.040 19.530 35.356 23.652 -99.200 -91.000 TRP6 65 1.020 21.369 33.971 23.129 -99.200 -91.000 PHE 67 1.000 17.876 30.220 25.819 -99.200 -91.000 PHE 74 1.000 27.318 38.079 20.817 -99.200 -91.000 PHE 79 1.000 41.159 43.400 14.995 -99.200 -91.000 TRP 92 1.040 28.516 39.946 25.380 -99.200 -91.000 TRP6 92 1.020 27.197 40.150 27.333 -99.200 -91.000 TYR 103 0.840 9.541 47.454 37.008 -99.200 -91.000 TRP 105 1.040 16.098 50.727 36.878 -99.200 -91.000 TRP6 105 1.020 17.687 49.594 38.191 -99.200 -91.000 TYR 112 0.840 35.714 39.663 27.841 -99.200 -91.000 PHE 115 1.000 31.980 34.858 19.339 -99.200 -91.000