============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 1 1.000 39.780 109.589 40.995 -99.200 -91.000 TYR 7 0.840 33.340 108.968 29.881 -99.200 -91.000 HIS 30 0.900 48.538 96.684 12.516 -99.200 -91.000 PHE 31 1.000 44.490 100.146 6.721 -99.200 -91.000 TYR 35 0.840 35.042 93.154 5.378 -99.200 -91.000 TYR 43 0.840 39.456 95.883 20.182 -99.200 -91.000 TYR 70 0.840 25.466 95.697 20.133 -99.200 -91.000 PHE 77 1.000 24.827 103.010 21.361 -99.200 -91.000 PHE 81 1.000 28.834 108.324 6.145 -99.200 -91.000 PHE 89 1.000 24.470 109.673 4.294 -99.200 -91.000 HIS 93 0.900 16.070 107.922 9.960 -99.200 -91.000 HIS 94 0.900 16.274 102.154 8.166 -99.200 -91.000 TYR 95 0.840 23.576 100.115 11.543 -99.200 -91.000 TYR 136 0.840 19.991 111.531 12.281 -99.200 -91.000 PHE 140 1.000 30.438 114.098 8.508 -99.200 -91.000 PHE 155 1.000 36.916 105.356 18.765 -99.200 -91.000 TYR 156 0.840 40.850 111.799 22.278 -99.200 -91.000 HIS 165 0.900 22.148 111.922 28.005 -99.200 -91.000