============================================================================= 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 2 0.900 21.638 -3.144 57.711 -99.200 -91.000 TYR 5 0.840 28.275 -7.296 49.505 -99.200 -91.000 PHE 10 1.000 22.289 3.755 44.565 -99.200 -91.000 TRP 12 1.040 26.328 -3.214 52.545 -99.200 -91.000 TRP6 12 1.020 28.466 -2.902 51.594 -99.200 -91.000 HIS 38 0.900 41.559 9.150 52.850 -99.200 -91.000 TRP 77 1.040 22.249 -2.499 15.518 -99.200 -91.000 TRP6 77 1.020 20.886 -1.293 14.040 -99.200 -91.000 TRP 84 1.040 25.088 -3.447 26.093 -99.200 -91.000 TRP6 84 1.020 24.522 -2.412 24.048 -99.200 -91.000 HIS 85 0.900 16.421 -6.310 30.223 -99.200 -91.000 TRP 105 1.040 14.530 9.288 24.177 -99.200 -91.000 TRP6 105 1.020 14.124 7.087 23.451 -99.200 -91.000 PHE 129 1.000 17.772 15.737 20.716 -99.200 -91.000 HIS 137 0.900 9.010 -0.126 27.812 -99.200 -91.000 PHE 138 1.000 13.773 1.991 27.833 -99.200 -91.000 PHE 143 1.000 13.840 -3.400 26.608 -99.200 -91.000 TYR 145 0.840 16.183 -3.944 19.801 -99.200 -91.000