============================================================================= 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 6 1.040 20.648 17.398 49.866 -99.200 -91.000 TRP6 6 1.020 22.976 17.771 49.811 -99.200 -91.000 TYR 42 0.840 25.438 15.335 40.457 -99.200 -91.000 PHE 56 1.000 23.124 -1.067 32.489 -99.200 -91.000 TYR 68 0.840 3.702 9.984 40.100 -99.200 -91.000 PHE 69 1.000 8.441 15.781 43.915 -99.200 -91.000 PHE 94 1.000 14.309 23.917 46.359 -99.200 -91.000 TYR 101 0.840 8.976 22.471 31.991 -99.200 -91.000 PHE 103 1.000 0.559 17.502 36.326 -99.200 -91.000 TYR 113 0.840 8.694 12.932 27.247 -99.200 -91.000 HIS 115 0.900 13.773 13.373 25.068 -99.200 -91.000 TYR 119 0.840 28.569 9.104 27.736 -99.200 -91.000 TYR 120 0.840 27.834 -0.187 33.317 -99.200 -91.000 TYR 124 0.840 38.499 -7.823 31.476 -99.200 -91.000 TYR 148 0.840 3.922 21.468 41.817 -99.200 -91.000 PHE 152 1.000 15.051 12.233 37.607 -99.200 -91.000 TRP 154 1.040 19.542 6.954 33.810 -99.200 -91.000 TRP6 154 1.020 18.240 7.344 35.739 -99.200 -91.000 PHE 174 1.000 20.956 14.542 31.431 -99.200 -91.000 PHE 175 1.000 26.716 17.325 34.867 -99.200 -91.000 PHE 176 1.000 17.809 17.465 36.073 -99.200 -91.000 TYR 178 0.840 12.924 21.362 37.014 -99.200 -91.000