============================================================================= 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. PHE 11 1.000 10.139 31.952 17.712 -99.200 -91.000 PHE 17 1.000 10.844 24.077 -0.339 -99.200 -91.000 HIS 24 0.900 -9.041 21.434 -4.649 -99.200 -91.000 PHE 28 1.000 -0.567 16.458 -0.584 -99.200 -91.000 HIS 45 0.900 10.625 21.755 30.352 -99.200 -91.000 TRP 56 1.040 -9.497 18.811 19.075 -99.200 -91.000 TRP6 56 1.020 -10.751 17.763 20.781 -99.200 -91.000 PHE 59 1.000 -4.668 20.609 9.085 -99.200 -91.000 HIS 61 0.900 -8.153 31.316 7.955 -99.200 -91.000 TYR 71 0.840 5.463 24.498 10.738 -99.200 -91.000 PHE 74 1.000 4.773 28.489 23.757 -99.200 -91.000 TRP 77 1.040 -0.178 20.080 32.369 -99.200 -91.000 TRP6 77 1.020 0.434 17.812 32.144 -99.200 -91.000 PHE 85 1.000 -0.176 26.891 21.303 -99.200 -91.000 TYR 92 0.840 -0.157 37.031 -0.980 -99.200 -91.000 PHE 105 1.000 -2.553 22.946 23.792 -99.200 -91.000 PHE 108 1.000 7.035 15.469 21.420 -99.200 -91.000 HIS 134 0.900 0.088 25.552 33.113 -99.200 -91.000 HIS 145 0.900 -5.321 10.867 32.293 -99.200 -91.000 PHE 160 1.000 -3.354 -6.676 14.977 -99.200 -91.000