============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TYR 10 0.840 -5.982 25.731 -11.581 -99.200 -91.000 PHE 16 1.000 -8.965 26.603 -9.433 -99.200 -91.000 HIS 17 0.900 -10.500 34.508 -7.809 -99.200 -91.000 HIS 20 0.900 -22.425 27.459 -11.973 -99.200 -91.000 HIS 24 0.900 -22.730 31.305 -9.708 -99.200 -91.000 PHE 31 1.000 -9.458 21.861 -0.470 -99.200 -91.000 TRP 38 1.040 -11.862 20.326 -9.566 -99.200 -91.000 TRP6 38 1.020 -13.756 21.645 -10.072 -99.200 -91.000 PHE 54 1.000 -24.780 35.981 -10.939 -99.200 -91.000 TYR 55 0.840 -23.140 44.164 -13.114 -99.200 -91.000 TRP 61 1.040 -25.120 47.250 -12.806 -99.200 -91.000 TRP6 61 1.020 -24.422 46.743 -10.607 -99.200 -91.000 TYR 64 0.840 -32.407 54.508 -19.503 -99.200 -91.000 HIS 66 0.900 -39.568 50.595 -11.697 -99.200 -91.000 TYR 70 0.840 -32.760 54.575 -10.575 -99.200 -91.000 TYR 73 0.840 -18.979 50.507 -5.747 -99.200 -91.000 TYR 75 0.840 -21.889 50.314 -2.102 -99.200 -91.000 TRP 82 1.040 -27.519 44.633 -6.073 -99.200 -91.000 TRP6 82 1.020 -29.113 45.554 -7.556 -99.200 -91.000 HIS 83 0.900 -27.731 49.335 -1.509 -99.200 -91.000