============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. HIS 9 0.900 9.880 -1.787 22.620 -99.200 -91.000 HIS 14 0.900 23.117 -6.069 26.639 -99.200 -91.000 TRP 23 1.040 10.823 -11.431 17.361 -99.200 -91.000 TRP6 23 1.020 11.206 -11.302 15.025 -99.200 -91.000 TYR 42 0.840 18.485 -1.112 13.844 -99.200 -91.000 PHE 53 1.000 10.516 3.575 16.241 -99.200 -91.000 PHE 60 1.000 16.019 -5.584 10.262 -99.200 -91.000 PHE 75 1.000 3.951 2.923 27.958 -99.200 -91.000 PHE 84 1.000 9.625 1.481 26.768 -99.200 -91.000 PHE 89 1.000 3.709 8.296 30.930 -99.200 -91.000 PHE 101 1.000 21.820 2.556 27.112 -99.200 -91.000 HIS 107 0.900 13.665 -0.998 25.449 -99.200 -91.000