============================================================================= 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 7 0.840 -35.284 2.942 34.441 -99.200 -91.000 HIS 15 0.900 -24.265 -11.239 50.417 -99.200 -91.000 PHE 24 1.000 -3.551 9.195 56.545 -99.200 -91.000 PHE 28 1.000 -17.848 7.150 51.148 -99.200 -91.000 PHE 36 1.000 -20.369 -0.650 41.107 -99.200 -91.000 TYR 41 0.840 -34.784 -5.242 37.257 -99.200 -91.000 HIS 61 0.900 -17.764 15.287 51.536 -99.200 -91.000 PHE 70 1.000 -17.851 7.090 45.137 -99.200 -91.000 TYR 74 0.840 -20.079 1.227 36.361 -99.200 -91.000 PHE 76 1.000 -23.350 -0.430 32.780 -99.200 -91.000 TYR 77 0.840 -20.608 -8.805 33.186 -99.200 -91.000 PHE 78 1.000 -26.815 -5.239 28.508 -99.200 -91.000 TYR 81 0.840 -29.651 -10.796 23.808 -99.200 -91.000 HIS 83 0.900 -18.073 -7.623 28.783 -99.200 -91.000 TYR 90 0.840 -21.466 6.027 40.622 -99.200 -91.000 TYR 93 0.840 -21.278 16.416 42.763 -99.200 -91.000 PHE 97 1.000 -23.277 12.464 28.410 -99.200 -91.000 PHE 107 1.000 -24.389 -5.376 24.307 -99.200 -91.000 TYR 111 0.840 -16.795 3.620 17.788 -99.200 -91.000 TYR 121 0.840 -25.397 8.311 45.917 -99.200 -91.000 PHE 126 1.000 -33.113 5.931 31.575 -99.200 -91.000 TYR 127 0.840 -25.833 3.421 34.329 -99.200 -91.000 PHE 129 1.000 -24.380 1.475 28.400 -99.200 -91.000 TYR 130 0.840 -26.654 8.956 24.034 -99.200 -91.000 TYR 171 0.840 -32.209 -14.333 35.428 -99.200 -91.000