============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 5 0.840 44.926 15.358 32.749 -99.200 -91.000 PHE 25 1.000 35.113 22.324 46.399 -99.200 -91.000 PHE 33 1.000 41.786 25.647 39.244 -99.200 -91.000 TRP 47 1.040 50.029 11.656 32.038 -99.200 -91.000 TRP6 47 1.020 48.737 11.945 33.998 -99.200 -91.000 TYR 62 0.840 39.780 5.351 25.038 -99.200 -91.000 PHE 69 1.000 44.777 11.946 36.759 -99.200 -91.000 TYR 74 0.840 41.770 8.488 39.123 -99.200 -91.000 TYR 78 0.840 30.475 15.802 38.880 -99.200 -91.000 PHE 81 1.000 34.160 18.040 43.170 -99.200 -91.000 PHE 82 1.000 26.952 15.224 43.578 -99.200 -91.000 TYR 91 0.840 40.707 21.558 51.334 -99.200 -91.000 PHE 93 1.000 38.184 13.251 45.065 -99.200 -91.000 HIS 116 0.900 46.393 10.873 72.711 -99.200 -91.000 HIS 117 0.900 42.079 12.646 74.365 -99.200 -91.000 HIS 118 0.900 37.913 6.009 72.319 -99.200 -91.000 HIS 119 0.900 47.827 4.197 71.593 -99.200 -91.000 HIS 120 0.900 46.860 9.132 77.949 -99.200 -91.000 HIS 121 0.900 47.143 2.121 78.181 -99.200 -91.000