============================================================================= 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. TRP 2 1.040 -5.507 19.373 63.626 -99.200 -91.000 TRP6 2 1.020 -4.128 21.139 62.881 -99.200 -91.000 PHE 16 1.000 1.628 25.238 52.073 -99.200 -91.000 TYR 19 0.840 -14.228 24.861 50.884 -99.200 -91.000 TYR 24 0.840 -12.270 23.090 55.117 -99.200 -91.000 TRP 25 1.040 -11.562 17.613 49.313 -99.200 -91.000 TRP6 25 1.020 -12.491 15.511 48.760 -99.200 -91.000 HIS 26 0.900 -5.381 14.484 55.083 -99.200 -91.000 TYR 47 0.840 -14.719 19.416 34.637 -99.200 -91.000 TYR 59 0.840 -17.342 16.587 32.622 -99.200 -91.000 PHE 63 1.000 -19.708 11.163 32.520 -99.200 -91.000 TYR 90 0.840 -14.056 14.090 6.494 -99.200 -91.000 HIS 91 0.900 -10.281 8.722 12.643 -99.200 -91.000 PHE 95 1.000 -10.090 17.381 5.488 -99.200 -91.000 PHE 110 1.000 -11.759 21.206 1.453 -99.200 -91.000 HIS 111 0.900 -12.151 22.063 -6.324 -99.200 -91.000 TYR 112 0.840 -18.084 17.071 0.890 -99.200 -91.000 PHE 118 1.000 -12.523 14.489 -5.965 -99.200 -91.000 HIS 121 0.900 -2.174 22.096 -7.442 -99.200 -91.000 PHE 144 1.000 -15.761 20.563 28.606 -99.200 -91.000