============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 7 0.840 4.282 63.819 14.260 -99.200 -91.000 HIS 21 0.900 19.236 59.245 29.192 -99.200 -91.000 HIS 42 0.900 0.647 51.676 22.083 -99.200 -91.000 HIS 44 0.900 -0.313 61.571 18.127 -99.200 -91.000 PHE 45 1.000 5.277 59.038 17.039 -99.200 -91.000 TRP 49 1.040 11.441 50.242 12.592 -99.200 -91.000 TRP6 49 1.020 13.778 49.893 12.673 -99.200 -91.000 PHE 56 1.000 17.120 56.574 12.668 -99.200 -91.000 HIS 74 0.900 31.517 78.313 15.935 -99.200 -91.000 TRP 83 1.040 26.332 69.797 9.806 -99.200 -91.000 TRP6 83 1.020 26.541 68.201 8.060 -99.200 -91.000 PHE 90 1.000 21.316 61.164 13.258 -99.200 -91.000 HIS 151 0.900 25.779 48.899 18.422 -99.200 -91.000 HIS 157 0.900 35.806 61.185 25.456 -99.200 -91.000 HIS 158 0.900 35.332 56.005 23.509 -99.200 -91.000