============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. PHE 26 1.000 58.354 70.626 35.919 -99.200 -91.000 PHE 28 1.000 60.417 70.537 30.543 -99.200 -91.000 TRP 34 1.040 75.098 76.904 10.187 -99.200 -91.000 TRP6 34 1.020 76.263 78.640 9.117 -99.200 -91.000 HIS 38 0.900 77.200 69.106 11.961 -99.200 -91.000 PHE 46 1.000 64.498 70.229 35.211 -99.200 -91.000 TYR 47 0.840 60.952 77.668 37.593 -99.200 -91.000 PHE 60 1.000 70.193 65.362 22.181 -99.200 -91.000 TYR 80 0.840 67.821 64.794 16.592 -99.200 -91.000 HIS 96 0.900 48.459 59.412 31.924 -99.200 -91.000 TYR 111 0.840 56.464 56.565 16.974 -99.200 -91.000 PHE 120 1.000 63.790 73.551 3.217 -99.200 -91.000 TYR 131 0.840 56.773 64.778 9.859 -99.200 -91.000 PHE 137 1.000 49.769 51.248 12.300 -99.200 -91.000 PHE 138 1.000 52.658 53.418 21.367 -99.200 -91.000 TYR 158 0.840 45.084 62.209 30.461 -99.200 -91.000 TYR 162 0.840 48.008 62.987 19.734 -99.200 -91.000