============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. TYR 8 0.840 58.608 13.269 -4.198 -99.200 -91.000 TYR 11 0.840 50.880 14.294 -2.607 -99.200 -91.000 PHE 28 1.000 54.820 6.525 22.080 -99.200 -91.000 PHE 40 1.000 63.525 12.515 26.275 -99.200 -91.000 PHE 85 1.000 57.977 9.477 10.123 -99.200 -91.000 TYR 99 0.840 72.127 10.887 22.969 -99.200 -91.000 PHE 100 1.000 68.586 4.600 20.048 -99.200 -91.000 HIS 120 0.900 64.287 -5.481 25.120 -99.200 -91.000 PHE 121 1.000 68.136 -0.935 18.983 -99.200 -91.000 HIS 125 0.900 67.089 -8.565 13.907 -99.200 -91.000 HIS 130 0.900 59.661 -11.287 14.619 -99.200 -91.000 PHE 143 1.000 56.891 -0.900 27.818 -99.200 -91.000 HIS 146 0.900 65.383 -3.527 31.700 -99.200 -91.000