============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. TRP 15 1.040 2.160 36.625 15.608 -99.200 -91.000 TRP6 15 1.020 3.782 35.591 14.248 -99.200 -91.000 PHE 25 1.000 -1.833 35.632 21.014 -99.200 -91.000 HIS 45 0.900 12.565 17.890 -0.974 -99.200 -91.000 PHE 46 1.000 6.741 20.059 7.982 -99.200 -91.000 PHE 48 1.000 9.535 21.361 10.764 -99.200 -91.000 PHE 49 1.000 8.554 24.325 14.499 -99.200 -91.000 HIS 61 0.900 10.351 30.018 8.181 -99.200 -91.000 PHE 93 1.000 3.884 28.332 -0.101 -99.200 -91.000 TYR 98 0.840 5.693 24.984 19.332 -99.200 -91.000 PHE 107 1.000 -4.283 30.790 12.602 -99.200 -91.000 PHE 114 1.000 0.359 40.236 7.406 -99.200 -91.000 TYR 129 0.840 -7.827 32.895 5.146 -99.200 -91.000 PHE 142 1.000 -1.949 32.297 1.679 -99.200 -91.000 TYR 146 0.840 -2.097 25.720 -10.013 -99.200 -91.000 HIS 148 0.900 -2.119 26.112 -16.603 -99.200 -91.000 TRP 152 1.040 6.600 26.912 -11.086 -99.200 -91.000 TRP6 152 1.020 6.180 25.259 -9.469 -99.200 -91.000 PHE 154 1.000 -1.279 31.319 -3.567 -99.200 -91.000 TYR 161 0.840 -5.533 20.264 6.931 -99.200 -91.000 PHE 172 1.000 -0.799 18.139 1.944 -99.200 -91.000