============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. TRP 7 1.040 23.251 15.006 10.579 -99.200 -91.000 TRP6 7 1.020 23.204 15.205 12.935 -99.200 -91.000 PHE 17 1.000 31.694 11.353 24.099 -99.200 -91.000 HIS 24 0.900 39.847 16.831 15.572 -99.200 -91.000 PHE 36 1.000 19.696 28.188 22.541 -99.200 -91.000 PHE 49 1.000 27.259 16.735 18.547 -99.200 -91.000 PHE 57 1.000 28.513 31.973 17.018 -99.200 -91.000 HIS 64 0.900 18.547 23.881 25.400 -99.200 -91.000 TYR 76 0.840 28.575 37.518 14.400 -99.200 -91.000 HIS 91 0.900 21.552 18.927 30.273 -99.200 -91.000 TYR 113 0.840 16.991 41.150 35.063 -99.200 -91.000 PHE 139 1.000 7.264 17.491 31.859 -99.200 -91.000 HIS 143 0.900 12.503 24.485 26.637 -99.200 -91.000 HIS 145 0.900 8.564 19.555 18.161 -99.200 -91.000 TYR 174 0.840 24.479 15.336 26.021 -99.200 -91.000 HIS 186 0.900 14.430 14.836 10.710 -99.200 -91.000