============================================================================= 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 1 1.040 15.270 54.819 37.563 -99.200 -91.000 TRP6 1 1.020 15.247 54.202 35.288 -99.200 -91.000 TYR 11 0.840 17.864 65.607 11.621 -99.200 -91.000 PHE 18 1.000 18.208 54.622 4.450 -99.200 -91.000 PHE 27 1.000 9.528 62.438 19.574 -99.200 -91.000 TYR 29 0.840 0.797 56.555 24.058 -99.200 -91.000 HIS 37 0.900 11.719 53.712 9.946 -99.200 -91.000 PHE 38 1.000 2.186 57.078 13.858 -99.200 -91.000 PHE 50 1.000 9.271 37.749 15.582 -99.200 -91.000 PHE 57 1.000 5.370 47.392 20.115 -99.200 -91.000 TRP 85 1.040 23.947 62.260 4.445 -99.200 -91.000 TRP6 85 1.020 26.268 62.694 4.427 -99.200 -91.000 PHE 108 1.000 12.853 65.191 23.288 -99.200 -91.000 TYR 133 0.840 25.095 62.579 0.454 -99.200 -91.000 TYR 134 0.840 31.963 62.077 2.127 -99.200 -91.000 PHE 144 1.000 27.072 53.264 8.751 -99.200 -91.000 HIS 147 0.900 36.445 51.758 10.671 -99.200 -91.000 TYR 165 0.840 8.098 72.639 20.458 -99.200 -91.000 HIS 173 0.900 14.838 60.921 34.197 -99.200 -91.000 TYR 175 0.840 17.623 49.479 34.360 -99.200 -91.000