============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. TYR 4 0.840 -3.284 53.994 58.455 -99.200 -91.000 HIS 24 0.900 8.801 62.644 12.812 -99.200 -91.000 PHE 29 1.000 7.526 58.209 21.410 -99.200 -91.000 TYR 36 0.840 7.509 59.598 33.023 -99.200 -91.000 HIS 47 0.900 -4.559 53.727 52.189 -99.200 -91.000 PHE 62 1.000 -2.419 60.626 26.934 -99.200 -91.000 PHE 77 1.000 -5.838 62.857 45.538 -99.200 -91.000 HIS 80 0.900 -14.557 53.551 47.973 -99.200 -91.000 TYR 88 0.840 -7.444 62.779 40.498 -99.200 -91.000 HIS 92 0.900 -2.040 70.035 36.342 -99.200 -91.000 PHE 108 1.000 -11.038 58.523 39.237 -99.200 -91.000 TYR 136 0.840 -14.945 57.291 51.215 -99.200 -91.000