============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. TRP 7 1.040 15.093 4.375 32.337 -99.200 -91.000 TRP6 7 1.020 14.995 3.350 30.187 -99.200 -91.000 HIS 12 0.900 2.712 10.531 30.875 -99.200 -91.000 TRP 14 1.040 5.534 1.647 24.715 -99.200 -91.000 TRP6 14 1.020 6.456 1.989 22.547 -99.200 -91.000 HIS 24 0.900 0.697 5.043 18.504 -99.200 -91.000 PHE 33 1.000 8.167 -1.344 5.439 -99.200 -91.000 HIS 36 0.900 15.541 6.124 5.977 -99.200 -91.000 PHE 43 1.000 10.293 -6.041 7.323 -99.200 -91.000 PHE 46 1.000 5.154 -6.844 5.992 -99.200 -91.000 HIS 48 0.900 2.907 -7.707 -1.007 -99.200 -91.000 HIS 64 0.900 6.938 -7.715 11.527 -99.200 -91.000 HIS 81 0.900 17.934 -2.811 35.181 -99.200 -91.000 HIS 82 0.900 17.901 -3.044 27.072 -99.200 -91.000 HIS 93 0.900 15.301 -8.307 13.903 -99.200 -91.000 HIS 97 0.900 14.614 -11.847 10.325 -99.200 -91.000 TYR 103 0.840 18.920 -1.286 6.182 -99.200 -91.000 PHE 106 1.000 18.309 4.479 7.532 -99.200 -91.000 HIS 113 0.900 7.518 12.063 11.052 -99.200 -91.000 HIS 116 0.900 6.880 16.569 17.132 -99.200 -91.000 HIS 119 0.900 0.759 9.420 21.524 -99.200 -91.000 PHE 123 1.000 8.330 11.793 21.679 -99.200 -91.000 PHE 138 1.000 16.212 -1.728 19.872 -99.200 -91.000 TYR 146 0.840 23.063 -6.399 14.352 -99.200 -91.000 TYR 151 0.840 24.709 -7.866 9.767 -99.200 -91.000