============================================================================= 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. HIS 21 0.900 -5.221 -21.396 -5.565 -99.200 -91.000 PHE 23 1.000 0.192 -23.231 -8.094 -99.200 -91.000 TRP 31 1.040 4.808 -24.015 -12.446 -99.200 -91.000 TRP6 31 1.020 6.290 -22.475 -11.469 -99.200 -91.000 PHE 34 1.000 5.985 -21.609 -0.386 -99.200 -91.000 HIS 46 0.900 -0.623 -8.276 5.365 -99.200 -91.000 PHE 54 1.000 9.304 -16.405 -0.155 -99.200 -91.000 TYR 59 0.840 9.052 -19.486 -3.822 -99.200 -91.000 TYR 68 0.840 -12.111 -8.643 -8.079 -99.200 -91.000 TRP 69 1.040 -12.014 -8.723 -13.332 -99.200 -91.000 TRP6 69 1.020 -12.624 -6.535 -12.685 -99.200 -91.000 PHE 77 1.000 -8.265 -11.328 -23.597 -99.200 -91.000 HIS 78 0.900 -5.862 -10.519 -19.294 -99.200 -91.000 HIS 80 0.900 -3.966 -18.172 -14.509 -99.200 -91.000 PHE 85 1.000 8.336 -13.881 -6.921 -99.200 -91.000 TYR 95 0.840 11.130 -11.595 -2.789 -99.200 -91.000 TYR 104 0.840 -12.155 -7.468 -22.516 -99.200 -91.000 TYR 106 0.840 -2.448 -9.316 -15.839 -99.200 -91.000