============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. HIS 10 0.900 76.760 14.593 22.999 -99.200 -91.000 HIS 13 0.900 69.470 14.211 23.004 -99.200 -91.000 TYR 14 0.840 71.995 9.839 23.046 -99.200 -91.000 TYR 30 0.840 84.241 -1.418 19.641 -99.200 -91.000 PHE 35 1.000 77.637 8.889 21.903 -99.200 -91.000 TYR 38 0.840 73.207 9.889 15.447 -99.200 -91.000 TYR 57 0.840 51.744 15.819 17.223 -99.200 -91.000 HIS 59 0.900 61.320 11.097 20.376 -99.200 -91.000 HIS 78 0.900 62.976 7.315 18.135 -99.200 -91.000 TYR 102 0.840 58.567 3.419 2.056 -99.200 -91.000 TRP 106 1.040 49.227 -3.357 10.790 -99.200 -91.000 TRP6 106 1.020 48.627 -1.922 12.591 -99.200 -91.000 PHE 116 1.000 56.327 0.441 24.678 -99.200 -91.000 PHE 120 1.000 55.209 4.117 28.397 -99.200 -91.000