============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. PHE 5 1.000 19.940 33.168 34.813 -99.200 -91.000 TYR 21 0.840 19.005 24.471 35.531 -99.200 -91.000 TYR 24 0.840 13.579 21.161 37.673 -99.200 -91.000 TYR 27 0.840 6.935 30.326 40.490 -99.200 -91.000 TRP 30 1.040 11.868 34.497 32.643 -99.200 -91.000 TRP6 30 1.020 13.397 34.187 30.884 -99.200 -91.000 PHE 45 1.000 8.811 32.588 44.613 -99.200 -91.000 HIS 47 0.900 16.752 34.962 37.609 -99.200 -91.000 TYR 51 0.840 16.180 38.711 35.656 -99.200 -91.000 TYR 64 0.840 25.206 40.190 33.826 -99.200 -91.000 TYR 66 0.840 29.978 36.086 34.458 -99.200 -91.000 PHE 96 1.000 19.151 27.618 38.268 -99.200 -91.000 TYR 103 0.840 17.713 18.958 36.713 -99.200 -91.000 TYR 107 0.840 9.267 18.011 40.207 -99.200 -91.000 TYR 110 0.840 5.007 20.185 37.043 -99.200 -91.000 PHE 113 1.000 -4.402 22.352 33.359 -99.200 -91.000