============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. TRP 5 1.040 -24.356 57.073 55.066 -99.200 -91.000 TRP6 5 1.020 -22.042 56.621 55.163 -99.200 -91.000 TYR 41 0.840 -19.708 59.114 64.557 -99.200 -91.000 PHE 55 1.000 -22.074 75.532 72.471 -99.200 -91.000 TYR 67 0.840 -41.398 64.549 64.571 -99.200 -91.000 PHE 68 1.000 -36.622 58.752 60.835 -99.200 -91.000 PHE 95 1.000 -30.786 50.570 58.473 -99.200 -91.000 TYR 102 0.840 -36.323 52.033 72.753 -99.200 -91.000 PHE 104 1.000 -44.558 57.109 68.359 -99.200 -91.000 TYR 114 0.840 -36.646 61.567 77.514 -99.200 -91.000 HIS 116 0.900 -31.594 61.099 79.765 -99.200 -91.000 TYR 120 0.840 -16.737 65.314 77.300 -99.200 -91.000 TYR 121 0.840 -17.353 74.609 71.735 -99.200 -91.000 TYR 125 0.840 -6.572 82.132 73.616 -99.200 -91.000 TYR 149 0.840 -41.217 53.066 62.859 -99.200 -91.000 PHE 153 1.000 -30.155 62.243 67.269 -99.200 -91.000 TRP 155 1.040 -25.698 67.510 71.116 -99.200 -91.000 TRP6 155 1.020 -26.972 67.144 69.167 -99.200 -91.000 PHE 175 1.000 -24.331 59.927 73.489 -99.200 -91.000 PHE 176 1.000 -18.522 57.125 70.162 -99.200 -91.000 PHE 177 1.000 -27.423 57.000 68.815 -99.200 -91.000 TYR 179 0.840 -32.301 53.154 67.802 -99.200 -91.000