============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 10 rings ring int. center anis. iso. HIS 21 0.900 127.442 66.071 6.054 -99.200 -91.000 PHE 51 1.000 132.589 66.039 -16.090 -99.200 -91.000 HIS 79 0.900 123.032 61.020 -17.686 -99.200 -91.000 HIS 85 0.900 134.634 57.886 -11.329 -99.200 -91.000 HIS 92 0.900 136.309 51.195 -5.943 -99.200 -91.000 TYR 101 0.840 119.858 63.655 -13.586 -99.200 -91.000 HIS 104 0.900 123.982 74.985 -17.852 -99.200 -91.000 PHE 107 1.000 125.751 72.366 -12.812 -99.200 -91.000 TYR 126 0.840 123.742 71.845 -21.574 -99.200 -91.000 PHE 137 1.000 127.482 62.112 10.236 -99.200 -91.000