============================================================================= 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. PHE 5 1.000 17.895 12.534 3.060 -99.200 -91.000 PHE 7 1.000 13.914 4.446 7.274 -99.200 -91.000 TYR 23 0.840 9.142 -16.162 10.892 -99.200 -91.000 PHE 29 1.000 19.530 -13.184 6.420 -99.200 -91.000 TYR 46 0.840 13.603 -4.869 -20.729 -99.200 -91.000 PHE 62 1.000 29.694 -9.786 -9.017 -99.200 -91.000 PHE 103 1.000 4.821 -8.681 5.962 -99.200 -91.000 PHE 119 1.000 1.315 -8.752 1.894 -99.200 -91.000 PHE 123 1.000 16.463 -2.746 2.521 -99.200 -91.000 TYR 124 0.840 12.001 -1.737 4.473 -99.200 -91.000 PHE 127 1.000 16.412 -3.121 9.861 -99.200 -91.000 TYR 145 0.840 25.739 9.900 -3.039 -99.200 -91.000 TRP 147 1.040 19.023 4.332 2.918 -99.200 -91.000 TRP6 147 1.020 18.433 2.445 4.223 -99.200 -91.000 PHE 155 1.000 16.503 7.578 4.698 -99.200 -91.000 PHE 175 1.000 27.538 -2.761 10.231 -99.200 -91.000 TYR 183 0.840 21.361 -16.700 9.724 -99.200 -91.000 HIS 196 0.900 13.767 -21.255 2.107 -99.200 -91.000 PHE 199 1.000 13.692 -23.826 -10.357 -99.200 -91.000 TYR 202 0.840 21.175 -12.548 -12.944 -99.200 -91.000