============================================================================= 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 21 1.000 1.905 8.308 39.618 -99.200 -91.000 PHE 25 1.000 7.467 3.760 36.920 -99.200 -91.000 TYR 28 0.840 14.355 2.308 37.591 -99.200 -91.000 TRP 51 1.040 3.786 1.479 34.324 -99.200 -91.000 TRP6 51 1.020 3.066 3.243 35.744 -99.200 -91.000 TYR 74 0.840 3.115 2.278 24.494 -99.200 -91.000 PHE 79 1.000 9.927 7.880 28.783 -99.200 -91.000 HIS 81 0.900 15.116 -2.365 27.514 -99.200 -91.000 HIS 100 0.900 -2.461 9.849 22.606 -99.200 -91.000 TYR 108 0.840 4.023 11.947 31.968 -99.200 -91.000 TYR 110 0.840 13.567 9.917 33.094 -99.200 -91.000 TYR 119 0.840 3.764 13.081 11.032 -99.200 -91.000 TYR 155 0.840 10.185 -0.863 26.015 -99.200 -91.000 PHE 169 1.000 -0.377 0.493 7.794 -99.200 -91.000 TRP 193 1.040 -6.592 -11.788 23.315 -99.200 -91.000 TRP6 193 1.020 -4.433 -11.477 22.389 -99.200 -91.000 TYR 204 0.840 4.018 -8.415 15.306 -99.200 -91.000 TYR 212 0.840 -9.442 -9.021 27.080 -99.200 -91.000