============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. TYR 2 0.840 2.949 -23.174 11.417 -99.200 -91.000 PHE 7 1.000 9.910 -16.692 5.690 -99.200 -91.000 TYR 25 0.840 34.929 3.797 5.221 -99.200 -91.000 PHE 27 1.000 35.105 -1.077 15.371 -99.200 -91.000 HIS 32 0.900 38.022 2.208 17.922 -99.200 -91.000 HIS 34 0.900 42.281 -1.157 10.133 -99.200 -91.000 PHE 36 1.000 35.958 -5.935 14.598 -99.200 -91.000 PHE 44 1.000 31.752 -8.031 16.397 -99.200 -91.000 PHE 45 1.000 26.287 -5.498 12.314 -99.200 -91.000 TYR 59 0.840 36.191 -10.512 19.514 -99.200 -91.000 PHE 71 1.000 28.503 -6.332 25.300 -99.200 -91.000 PHE 94 1.000 27.786 -0.102 10.085 -99.200 -91.000 TYR 97 0.840 31.723 2.393 3.469 -99.200 -91.000 TYR 98 0.840 24.997 -2.250 5.851 -99.200 -91.000 HIS 101 0.900 30.005 2.295 0.200 -99.200 -91.000 PHE 109 1.000 21.563 -16.564 3.817 -99.200 -91.000 PHE 144 1.000 14.789 -11.150 -0.485 -99.200 -91.000 PHE 148 1.000 9.550 -11.641 1.871 -99.200 -91.000 PHE 150 1.000 3.509 -5.127 7.091 -99.200 -91.000 TYR 182 0.840 10.138 -14.181 13.759 -99.200 -91.000 TRP 204 1.040 19.713 -20.024 5.820 -99.200 -91.000 TRP6 204 1.020 18.090 -21.762 5.854 -99.200 -91.000 PHE 206 1.000 24.204 -12.541 10.801 -99.200 -91.000 PHE 211 1.000 23.676 -18.693 20.381 -99.200 -91.000 HIS 215 0.900 20.817 -18.607 23.686 -99.200 -91.000