============================================================================= 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. TYR 32 0.840 -0.199 -16.551 35.713 -99.200 -91.000 TYR 34 0.840 0.647 -12.316 30.588 -99.200 -91.000 TRP 35 1.040 3.500 -16.410 23.443 -99.200 -91.000 TRP6 35 1.020 5.513 -16.326 22.222 -99.200 -91.000 TYR 36 0.840 0.582 -8.685 24.295 -99.200 -91.000 PHE 49 1.000 -6.218 -15.285 28.962 -99.200 -91.000 PHE 62 1.000 -3.049 -17.238 15.797 -99.200 -91.000 TYR 86 0.840 2.677 -13.616 15.129 -99.200 -91.000 TYR 87 0.840 7.044 -7.281 19.207 -99.200 -91.000 TRP 91 1.040 3.400 -10.257 34.967 -99.200 -91.000 TRP6 91 1.020 2.697 -8.002 35.073 -99.200 -91.000 TYR 99 0.840 3.475 -7.277 30.315 -99.200 -91.000 PHE 101 1.000 5.377 -5.656 25.716 -99.200 -91.000 PHE 122 1.000 29.437 1.301 -4.233 -99.200 -91.000 PHE 143 1.000 16.688 -9.165 1.604 -99.200 -91.000 TYR 144 0.840 9.716 -14.350 -0.114 -99.200 -91.000 TRP 152 1.040 27.699 -2.324 9.464 -99.200 -91.000 TRP6 152 1.020 28.635 -1.572 7.433 -99.200 -91.000 TYR 176 0.840 10.394 -8.062 0.796 -99.200 -91.000 TYR 181 0.840 23.356 4.595 4.354 -99.200 -91.000 TRP 189 1.040 39.055 4.319 5.438 -99.200 -91.000 TRP6 189 1.020 38.006 2.273 4.897 -99.200 -91.000 HIS 192 0.900 39.911 0.251 13.493 -99.200 -91.000 TYR 195 0.840 36.295 -0.081 10.118 -99.200 -91.000 HIS 201 0.900 17.333 -14.500 3.574 -99.200 -91.000