============================================================================= 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. TYR 15 0.840 73.628 10.337 -3.739 -99.200 -91.000 PHE 29 1.000 65.122 7.698 14.056 -99.200 -91.000 TYR 44 0.840 65.233 12.426 6.402 -99.200 -91.000 TYR 46 0.840 71.853 15.351 1.403 -99.200 -91.000 PHE 47 1.000 71.021 17.432 12.275 -99.200 -91.000 PHE 81 1.000 61.234 19.155 12.174 -99.200 -91.000 HIS 84 0.900 64.619 11.314 17.965 -99.200 -91.000 TYR 90 0.840 69.676 6.342 18.428 -99.200 -91.000 PHE 157 1.000 68.583 22.662 22.709 -99.200 -91.000 HIS 158 0.900 63.278 16.256 25.914 -99.200 -91.000 HIS 162 0.900 75.680 9.397 29.695 -99.200 -91.000 TYR 164 0.840 73.867 20.279 30.649 -99.200 -91.000 HIS 170 0.900 82.084 15.795 29.278 -99.200 -91.000 HIS 183 0.900 77.972 -0.001 1.823 -99.200 -91.000 TYR 185 0.840 76.112 5.229 7.785 -99.200 -91.000 PHE 192 1.000 92.429 19.314 14.164 -99.200 -91.000