============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. HIS 21 0.900 -10.571 13.361 -18.578 -99.200 -91.000 PHE 22 1.000 -7.392 7.391 -19.744 -99.200 -91.000 TYR 29 0.840 -6.962 -6.616 -14.223 -99.200 -91.000 PHE 37 1.000 1.389 5.499 5.164 -99.200 -91.000 TYR 42 0.840 -10.757 1.725 -5.036 -99.200 -91.000 PHE 54 1.000 -8.656 5.893 -11.002 -99.200 -91.000 TRP 60 1.040 -5.518 12.003 -12.089 -99.200 -91.000 TRP6 60 1.020 -3.197 12.342 -12.438 -99.200 -91.000 PHE 74 1.000 -5.959 12.528 -17.063 -99.200 -91.000 TYR 82 0.840 11.431 21.643 -17.471 -99.200 -91.000 TYR 86 0.840 13.343 16.707 -21.228 -99.200 -91.000 HIS 89 0.900 12.371 12.932 -26.005 -99.200 -91.000 TYR 101 0.840 1.597 17.384 -10.557 -99.200 -91.000 PHE 113 1.000 8.175 18.943 -14.241 -99.200 -91.000 PHE 116 1.000 3.373 25.029 -4.592 -99.200 -91.000 PHE 119 1.000 14.039 19.847 -13.705 -99.200 -91.000