NBONDS: found 116307 intra-atom interactions ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ +++++++++++++++++++++++++++++++ CLASS DIST +++++++++++++++++++++++++++++++++++ for this class: SCALe= 50.000 AVERage=sum POTEntial=soft-square SQCOnstant= 1.000 SQEXponent= 2 SQOFfsets(+/-)= 0.000 0.000 SOEXponent= 1 RSWItch= 0.500 ASYMptote= 0.100 ========== spectrum 1 restraint 37 ========== set-i-atoms 34 PRO HG1 set-j-atoms 35 PHE HN R= 5.139 NOE= 4.46 (- 2.66/+ 0.67) Delta= -0.009 E(NOE)= 0.004 ========== spectrum 1 restraint 307 ========== set-i-atoms 85 LYS HN set-j-atoms 85 LYS HG2 R= 1.789 NOE= 4.91 (- 3.11/+ 0.74) Delta= 0.011 E(NOE)= 0.006 ========== spectrum 1 restraint 352 ========== set-i-atoms 28 ALA HN set-j-atoms 29 LEU HD21 29 LEU HD22 29 LEU HD23 R= 5.020 NOE= 4.36 (- 2.56/+ 0.65) Delta= -0.010 E(NOE)= 0.005 ========== spectrum 1 restraint 748 ========== set-i-atoms 57 LEU HB2 set-j-atoms 62 LEU HG R= 3.112 NOE= 2.68 (- 0.88/+ 0.40) Delta= -0.032 E(NOE)= 0.051 ========== spectrum 1 restraint 849 ========== set-i-atoms 22 SER HA set-j-atoms 25 GLU HB2 R= 5.263 NOE= 4.53 (- 2.73/+ 0.68) Delta= -0.053 E(NOE)= 0.139 ========== spectrum 1 restraint 857 ========== set-i-atoms 28 ALA HB1 28 ALA HB2 28 ALA HB3 set-j-atoms 29 LEU HD21 29 LEU HD22 29 LEU HD23 R= 4.088 NOE= 3.53 (- 1.73/+ 0.53) Delta= -0.028 E(NOE)= 0.040 ========== spectrum 1 restraint 933 ========== set-i-atoms 40 ILE HG21 40 ILE HG22 40 ILE HG23 set-j-atoms 48 PHE HE1 48 PHE HE2 R= 1.748 NOE= 3.80 (- 2.00/+ 0.57) Delta= 0.052 E(NOE)= 0.137 ========== spectrum 1 restraint 1146 ========== set-i-atoms 29 LEU HD21 29 LEU HD22 29 LEU HD23 set-j-atoms 37 THR HG21 37 THR HG22 37 THR HG23 R= 5.791 NOE= 5.02 (- 3.22/+ 0.75) Delta= -0.021 E(NOE)= 0.023 ========== spectrum 1 restraint 1264 ========== set-i-atoms 31 MET HE1 31 MET HE2 31 MET HE3 set-j-atoms 64 LEU HN R= 5.041 NOE= 4.37 (- 2.57/+ 0.66) Delta= -0.011 E(NOE)= 0.006 ========== spectrum 1 restraint 1604 ========== set-i-atoms 35 PHE HD1 35 PHE HD2 set-j-atoms 40 ILE HD11 40 ILE HD12 40 ILE HD13 R= 3.633 NOE= 3.16 (- 1.36/+ 0.47) Delta= -0.003 E(NOE)= 0.001 ========== spectrum 1 restraint 1613 ========== set-i-atoms 35 PHE HE1 35 PHE HE2 set-j-atoms 40 ILE HG12 R= 1.780 NOE= 3.22 (- 1.42/+ 0.48) Delta= 0.020 E(NOE)= 0.019 ========== spectrum 1 restraint 2032 ========== set-i-atoms 85 LYS HN set-j-atoms 85 LYS HG1 85 LYS HG2 R= 1.781 NOE= 4.20 (- 2.40/+ 0.63) Delta= 0.019 E(NOE)= 0.018 NOEPRI: RMS diff. = 0.002, #(violat.> 0.0)= 12 of 2047 NOEs NOEPRI: RMS diff. class DIST = 0.002, #(viol.> 0.0)= 12 of 2047 NOEs ======================================== 29 LEU N 29 LEU CA 29 LEU C 30 ALA N Dihedral= -20.761 Energy= 0.000 C= 1.000 Equil= -41.500 Delta= -0.739 Range= 20.000 Exponent= 2 (atom-i |atom-j ) dist. equil. delta energy const. (atom-i |atom-j |atom-k ) angle equil. delta energy const. (atom-i |atom-j |atom-k |atom-L ) angle equil. delta energy const. period ( 2 CA | 2 C | 3 N | 3 CA ) -173.994 180.000 -6.006 1.099 100.000 0 ( 6 CA | 6 C | 7 N | 7 CA ) -171.713 180.000 -8.287 2.092 100.000 0 ( 9 CA | 9 C | 10 N | 10 CA ) 174.277 180.000 5.723 0.998 100.000 0 ( 26 CA | 26 C | 27 N | 27 CA ) 174.768 180.000 5.232 0.834 100.000 0 ( 35 CA | 35 C | 36 N | 36 CA ) -174.879 180.000 -5.121 0.799 100.000 0 ( 41 CA | 41 C | 42 N | 42 CA ) -174.139 180.000 -5.861 1.047 100.000 0 ( 43 CA | 43 C | 44 N | 44 CA ) 174.051 180.000 5.949 1.078 100.000 0 ( 44 CA | 44 C | 45 N | 45 CA ) -172.221 180.000 -7.779 1.843 100.000 0 ( 57 CA | 57 C | 58 N | 58 CA ) 172.314 180.000 7.686 1.800 100.000 0 ( 68 CA | 68 C | 69 N | 69 CA ) 174.630 180.000 5.370 0.878 100.000 0 ( 75 CA | 75 C | 76 N | 76 CA ) 173.418 180.000 6.582 1.320 100.000 0 ( 89 CA | 89 C | 90 N | 90 CA ) -174.963 180.000 -5.037 0.773 100.000 0 (atom-i |atom-j |atom-k |atom-L ) angle equil. delta energy const. period ( 1 C | 2 N | 2 CA | 2 C ) 100.626 180.000 79.374 0.306 0.375 1 ( 1 C | 2 N | 2 CA | 2 C ) 100.626 60.000 -40.626 0.344 0.225 3 ( 1 C | 2 N | 2 CA | 2 C ) 100.626 135.000 34.374 0.261 0.150 4 ( 1 CB | 1 CA | 1 C | 2 N ) -100.392 -180.000 -79.608 0.410 0.500 1 ( 1 CB | 1 CA | 1 C | 2 N ) -100.392 -60.000 40.392 0.455 0.300 3 ( 1 CB | 1 CA | 1 C | 2 N ) -100.392 -135.000 -34.608 0.350 0.200 4 ( 1 CB | 1 CA | 1 C | 1 O ) 79.929 180.000 100.071 0.441 0.375 1 ( 1 CB | 1 CA | 1 C | 1 O ) 79.929 45.000 -34.929 0.264 0.150 4 ( 3 ND1 | 3 CG | 3 CB | 3 CA ) -88.392 -180.000 -91.608 0.617 0.600 1 ( 2 C | 3 N | 3 CA | 3 C ) -103.241 -180.000 -76.759 0.289 0.375 1 ( 2 C | 3 N | 3 CA | 3 C ) -103.241 -60.000 43.241 0.369 0.225 3 ( 2 C | 3 N | 3 CA | 3 C ) -103.241 -135.000 -31.759 0.240 0.150 4 ( 2 C | 3 N | 3 CA | 3 CB ) 133.936 180.000 46.064 0.153 0.500 1 ( 2 C | 3 N | 3 CA | 3 CB ) 133.936 90.000 -43.936 0.385 0.400 2 ( 2 C | 3 N | 3 CA | 3 CB ) 133.936 180.000 46.064 0.524 0.300 3 ( 4 ND1 | 4 CG | 4 CB | 4 CA ) -88.232 -180.000 -91.768 0.619 0.600 1 ( 3 C | 4 N | 4 CA | 4 C ) -105.943 -180.000 -74.057 0.272 0.375 1 ( 3 C | 4 N | 4 CA | 4 C ) -105.943 -60.000 45.943 0.392 0.225 3 ( 3 C | 4 N | 4 CA | 4 CB ) 131.371 180.000 48.629 0.170 0.500 1 ( 3 C | 4 N | 4 CA | 4 CB ) 131.371 90.000 -41.371 0.349 0.400 2 ( 3 C | 4 N | 4 CA | 4 CB ) 131.371 180.000 48.629 0.548 0.300 3 ( 3 CB | 3 CA | 3 C | 4 N ) -105.051 -180.000 -74.949 0.370 0.500 1 ( 3 CB | 3 CA | 3 C | 4 N ) -105.051 -60.000 45.051 0.513 0.300 3 ( 3 CB | 3 CA | 3 C | 3 O ) 74.487 180.000 105.513 0.475 0.375 1 ( 3 CB | 3 CA | 3 C | 3 O ) 74.487 108.000 33.513 0.148 0.075 5 ( 5 ND1 | 5 CG | 5 CB | 5 CA ) -97.514 -180.000 -82.486 0.522 0.600 1 ( 4 C | 5 N | 5 CA | 5 C ) -115.846 -180.000 -64.154 0.212 0.375 1 ( 4 C | 5 N | 5 CA | 5 C ) -115.846 -60.000 55.846 0.445 0.225 3 ( 4 C | 5 N | 5 CA | 5 CB ) 119.806 180.000 60.194 0.251 0.500 1 ( 4 C | 5 N | 5 CA | 5 CB ) 119.806 60.000 -59.806 0.600 0.300 3 ( 4 CB | 4 CA | 4 C | 5 N ) -65.014 -180.000 -114.986 0.711 0.500 1 ( 4 CB | 4 CA | 4 C | 4 O ) 115.467 180.000 64.533 0.214 0.375 1 ( 4 CB | 4 CA | 4 C | 4 O ) 115.467 60.000 -55.467 0.444 0.225 3 ( 6 ND1 | 6 CG | 6 CB | 6 CA ) 87.227 180.000 92.773 0.629 0.600 1 ( 5 C | 6 N | 6 CA | 6 C ) -75.769 -180.000 -104.231 0.467 0.375 1 ( 5 C | 6 N | 6 CA | 6 C ) -75.769 -45.000 30.769 0.232 0.150 4 ( 5 C | 6 N | 6 CA | 6 C ) -75.769 -108.000 -32.231 0.146 0.075 5 ( 5 C | 6 N | 6 CA | 6 CB ) 159.492 90.000 -69.492 0.702 0.400 2 ( 5 CB | 5 CA | 5 C | 6 N ) -125.037 -180.000 -54.963 0.213 0.500 1 ( 5 CB | 5 CA | 5 C | 6 N ) -125.037 -90.000 35.037 0.264 0.400 2 ( 5 CB | 5 CA | 5 C | 6 N ) -125.037 -180.000 -54.963 0.590 0.300 3 ( 5 CB | 5 CA | 5 C | 5 O ) 55.639 180.000 124.361 0.587 0.375 1 ( 5 CB | 5 CA | 5 C | 5 O ) 55.639 90.000 34.361 0.191 0.300 2 ( 7 ND1 | 7 CG | 7 CB | 7 CA ) -92.370 -180.000 -87.630 0.575 0.600 1 ( 6 C | 7 N | 7 CA | 7 C ) -127.829 -180.000 -52.171 0.145 0.375 1 ( 6 C | 7 N | 7 CA | 7 C ) -127.829 -90.000 37.829 0.226 0.300 2 ( 6 C | 7 N | 7 CA | 7 C ) -127.829 -180.000 -52.171 0.431 0.225 3 ( 6 C | 7 N | 7 CA | 7 CB ) 109.676 180.000 70.324 0.332 0.500 1 ( 6 C | 7 N | 7 CA | 7 CB ) 109.676 60.000 -49.676 0.557 0.300 3 ( 6 CB | 6 CA | 6 C | 7 N ) -73.587 -180.000 -106.413 0.641 0.500 1 ( 6 CB | 6 CA | 6 C | 7 N ) -73.587 -108.000 -34.413 0.199 0.100 5 ( 6 CB | 6 CA | 6 C | 6 O ) 105.276 180.000 74.724 0.276 0.375 1 ( 6 CB | 6 CA | 6 C | 6 O ) 105.276 60.000 -45.276 0.386 0.225 3 ( 8 ND1 | 8 CG | 8 CB | 8 CA ) 69.861 180.000 110.139 0.807 0.600 1 ( 7 C | 8 N | 8 CA | 8 C ) -107.515 -180.000 -72.485 0.262 0.375 1 ( 7 C | 8 N | 8 CA | 8 C ) -107.515 -60.000 47.515 0.404 0.225 3 ( 7 C | 8 N | 8 CA | 8 CB ) 130.306 180.000 49.694 0.177 0.500 1 ( 7 C | 8 N | 8 CA | 8 CB ) 130.306 90.000 -40.306 0.335 0.400 2 ( 7 C | 8 N | 8 CA | 8 CB ) 130.306 180.000 49.694 0.557 0.300 3 ( 7 CB | 7 CA | 7 C | 8 N ) -108.137 -180.000 -71.863 0.344 0.500 1 ( 7 CB | 7 CA | 7 C | 8 N ) -108.137 -60.000 48.137 0.544 0.300 3 ( 7 CB | 7 CA | 7 C | 7 O ) 70.940 180.000 109.060 0.497 0.375 1 ( 7 CB | 7 CA | 7 C | 7 O ) 70.940 36.000 -34.940 0.150 0.075 5 ( 8 C | 9 N | 9 CA | 9 C ) -169.062 -90.000 79.062 0.578 0.300 2 ( 8 C | 9 N | 9 CA | 9 C ) -169.062 -135.000 34.062 0.258 0.150 4 ( 8 C | 9 N | 9 CA | 9 CB ) 68.417 180.000 111.583 0.684 0.500 1 ( 8 C | 9 N | 9 CA | 9 CB ) 68.417 36.000 -32.417 0.195 0.100 5 ( 8 CB | 8 CA | 8 C | 9 N ) -89.290 -180.000 -90.710 0.506 0.500 1 ( 8 CB | 8 CA | 8 C | 9 N ) -89.290 -45.000 44.290 0.400 0.200 4 ( 8 CB | 8 CA | 8 C | 8 O ) 89.703 180.000 90.297 0.377 0.375 1 ( 8 CB | 8 CA | 8 C | 8 O ) 89.703 45.000 -44.703 0.300 0.150 4 ( 10 ND1 | 10 CG | 10 CB | 10 CA ) 140.531 180.000 39.469 0.137 0.600 1 ( 10 CD2 | 10 CG | 10 CB | 10 CA ) -41.095 -90.000 -48.905 0.909 0.800 2 ( 9 C | 10 N | 10 CA | 10 C ) -96.971 -180.000 -83.029 0.329 0.375 1 ( 9 C | 10 N | 10 CA | 10 C ) -96.971 -60.000 36.971 0.305 0.225 3 ( 9 C | 10 N | 10 CA | 10 C ) -96.971 -135.000 -38.029 0.283 0.150 4 ( 9 C | 10 N | 10 CA | 10 CB ) 141.469 180.000 38.531 0.109 0.500 1 ( 9 C | 10 N | 10 CA | 10 CB ) 141.469 90.000 -51.469 0.490 0.400 2 ( 9 C | 10 N | 10 CA | 10 CB ) 141.469 180.000 38.531 0.430 0.300 3 ( 9 C | 10 N | 10 CA | 10 CB ) 141.469 108.000 -33.469 0.198 0.100 5 ( 9 CB | 9 CA | 9 C | 10 N ) -130.534 -180.000 -49.466 0.175 0.500 1 ( 9 CB | 9 CA | 9 C | 10 N ) -130.534 -90.000 40.534 0.338 0.400 2 ( 9 CB | 9 CA | 9 C | 10 N ) -130.534 -180.000 -49.466 0.556 0.300 3 ( 9 CB | 9 CA | 9 C | 9 O ) 50.363 180.000 129.637 0.614 0.375 1 ( 9 CB | 9 CA | 9 C | 9 O ) 50.363 90.000 39.637 0.244 0.300 2 ( 10 C | 11 N | 11 CA | 11 C ) -73.565 -180.000 -106.435 0.481 0.375 1 ( 10 C | 11 N | 11 CA | 11 C ) -73.565 -108.000 -34.435 0.149 0.075 5 ( 10 C | 11 N | 11 CA | 11 CB ) 163.409 90.000 -73.409 0.735 0.400 2 ( 10 CB | 10 CA | 10 C | 11 N ) -83.866 -180.000 -96.134 0.553 0.500 1 ( 10 CB | 10 CA | 10 C | 11 N ) -83.866 -45.000 38.866 0.382 0.200 4 ( 10 CB | 10 CA | 10 C | 10 O ) 95.881 180.000 84.119 0.337 0.375 1 ( 10 CB | 10 CA | 10 C | 10 O ) 95.881 60.000 -35.881 0.293 0.225 3 ( 10 CB | 10 CA | 10 C | 10 O ) 95.881 135.000 39.119 0.288 0.150 4 ( 11 C | 12 N | 12 CA | 12 C ) -72.071 -180.000 -107.929 0.490 0.375 1 ( 11 C | 12 N | 12 CA | 12 C ) -72.071 -108.000 -35.929 0.150 0.075 5 ( 11 C | 12 N | 12 CA | 12 CB ) 164.701 90.000 -74.701 0.744 0.400 2 ( 11 CB | 11 CA | 11 C | 12 N ) -138.452 -180.000 -41.548 0.126 0.500 1 ( 11 CB | 11 CA | 11 C | 12 N ) -138.452 -90.000 48.452 0.448 0.400 2 ( 11 CB | 11 CA | 11 C | 12 N ) -138.452 -180.000 -41.548 0.471 0.300 3 ( 11 CB | 11 CA | 11 C | 12 N ) -138.452 -108.000 30.452 0.189 0.100 5 ( 11 CB | 11 CA | 11 C | 11 O ) 42.704 180.000 137.296 0.651 0.375 1 ( 11 CB | 11 CA | 11 C | 11 O ) 42.704 90.000 47.296 0.324 0.300 2 ( 12 C | 13 N | 13 CA | 13 C ) 62.373 180.000 117.627 0.549 0.375 1 ( 12 C | 13 N | 13 CA | 13 CB ) -62.177 -180.000 -117.823 0.733 0.500 1 ( 12 CB | 12 CA | 12 C | 13 N ) -125.629 -180.000 -54.371 0.209 0.500 1 ( 12 CB | 12 CA | 12 C | 13 N ) -125.629 -90.000 35.629 0.271 0.400 2 ( 12 CB | 12 CA | 12 C | 13 N ) -125.629 -180.000 -54.371 0.587 0.300 3 ( 12 CB | 12 CA | 12 C | 12 O ) 53.653 180.000 126.347 0.597 0.375 1 ( 12 CB | 12 CA | 12 C | 12 O ) 53.653 90.000 36.347 0.211 0.300 2 ( 13 CB | 13 CA | 13 C | 14 N ) -155.001 -90.000 65.001 0.657 0.400 2 ( 13 CB | 13 CA | 13 C | 13 O ) 25.168 180.000 154.832 0.714 0.375 1 ( 13 CB | 13 CA | 13 C | 13 O ) 25.168 90.000 64.832 0.491 0.300 2 ( 13 CB | 13 CA | 13 C | 13 O ) 25.168 60.000 34.832 0.281 0.225 3 ( 14 C | 15 N | 15 CA | 15 C ) -61.058 -180.000 -118.942 0.556 0.375 1 ( 14 C | 15 N | 15 CA | 15 CB ) 177.018 90.000 -87.018 0.798 0.400 2 ( 14 C | 15 N | 15 CA | 15 CB ) 177.018 135.000 -42.018 0.396 0.200 4 ( 14 CB | 14 CA | 14 C | 15 N ) 169.865 90.000 -79.865 0.775 0.400 2 ( 14 CB | 14 CA | 14 C | 15 N ) 169.865 135.000 -34.865 0.352 0.200 4 ( 14 CB | 14 CA | 14 C | 14 O ) -10.426 -180.000 -169.574 0.744 0.375 1 ( 14 CB | 14 CA | 14 C | 14 O ) -10.426 -90.000 -79.574 0.580 0.300 2 ( 14 CB | 14 CA | 14 C | 14 O ) -10.426 -60.000 -49.574 0.417 0.225 3 ( 14 CB | 14 CA | 14 C | 14 O ) -10.426 -45.000 -34.574 0.262 0.150 4 ( 15 C | 16 N | 16 CA | 16 C ) -78.148 -180.000 -101.852 0.452 0.375 1 ( 15 C | 16 N | 16 CA | 16 C ) -78.148 -45.000 33.148 0.252 0.150 4 ( 15 C | 16 N | 16 CA | 16 CB ) 159.103 90.000 -69.103 0.698 0.400 2 ( 15 CB | 15 CA | 15 C | 16 N ) -139.339 -180.000 -40.661 0.121 0.500 1 ( 15 CB | 15 CA | 15 C | 16 N ) -139.339 -90.000 49.339 0.460 0.400 2 ( 15 CB | 15 CA | 15 C | 16 N ) -139.339 -180.000 -40.661 0.459 0.300 3 ( 15 CB | 15 CA | 15 C | 16 N ) -139.339 -108.000 31.339 0.192 0.100 5 ( 15 CB | 15 CA | 15 C | 15 O ) 42.186 180.000 137.814 0.653 0.375 1 ( 15 CB | 15 CA | 15 C | 15 O ) 42.186 90.000 47.814 0.329 0.300 2 ( 16 C | 17 N | 17 CA | 17 C ) -94.197 -180.000 -85.803 0.348 0.375 1 ( 16 C | 17 N | 17 CA | 17 C ) -94.197 -60.000 34.197 0.274 0.225 3 ( 16 C | 17 N | 17 CA | 17 C ) -94.197 -135.000 -40.803 0.294 0.150 4 ( 16 C | 17 N | 17 CA | 17 CB ) 143.454 180.000 36.546 0.098 0.500 1 ( 16 C | 17 N | 17 CA | 17 CB ) 143.454 90.000 -53.454 0.516 0.400 2 ( 16 C | 17 N | 17 CA | 17 CB ) 143.454 180.000 36.546 0.401 0.300 3 ( 16 C | 17 N | 17 CA | 17 CB ) 143.454 108.000 -35.454 0.200 0.100 5 ( 16 CB | 16 CA | 16 C | 17 N ) -86.683 -180.000 -93.317 0.529 0.500 1 ( 16 CB | 16 CA | 16 C | 17 N ) -86.683 -45.000 41.683 0.395 0.200 4 ( 16 CB | 16 CA | 16 C | 16 O ) 93.312 180.000 86.688 0.353 0.375 1 ( 16 CB | 16 CA | 16 C | 16 O ) 93.312 60.000 -33.312 0.264 0.225 3 ( 16 CB | 16 CA | 16 C | 16 O ) 93.312 135.000 41.688 0.296 0.150 4 ( 17 C | 18 N | 18 CA | 18 C ) -79.401 -180.000 -100.599 0.444 0.375 1 ( 17 C | 18 N | 18 CA | 18 C ) -79.401 -45.000 34.401 0.261 0.150 4 ( 17 CB | 17 CA | 17 C | 18 N ) -118.764 -180.000 -61.236 0.259 0.500 1 ( 17 CB | 17 CA | 17 C | 18 N ) -118.764 -60.000 58.764 0.599 0.300 3 ( 17 CB | 17 CA | 17 C | 17 O ) 61.232 180.000 118.768 0.555 0.375 1 ( 18 C | 19 N | 19 CA | 19 C ) -72.655 -180.000 -107.345 0.487 0.375 1 ( 18 C | 19 N | 19 CA | 19 C ) -72.655 -108.000 -35.345 0.150 0.075 5 ( 18 C | 19 N | 19 CA | 19 CB ) 165.146 90.000 -75.146 0.747 0.400 2 ( 18 C | 19 N | 19 CA | 19 CB ) 165.146 135.000 -30.146 0.302 0.200 4 ( 19 C | 20 N | 20 CA | 20 C ) -133.395 -180.000 -46.605 0.117 0.375 1 ( 19 C | 20 N | 20 CA | 20 C ) -133.395 -90.000 43.395 0.283 0.300 2 ( 19 C | 20 N | 20 CA | 20 C ) -133.395 -180.000 -46.605 0.397 0.225 3 ( 19 C | 20 N | 20 CA | 20 CB ) 102.973 180.000 77.027 0.388 0.500 1 ( 19 C | 20 N | 20 CA | 20 CB ) 102.973 60.000 -42.973 0.488 0.300 3 ( 19 C | 20 N | 20 CA | 20 CB ) 102.973 135.000 32.027 0.323 0.200 4 ( 19 CB | 19 CA | 19 C | 20 N ) -136.575 -180.000 -43.425 0.137 0.500 1 ( 19 CB | 19 CA | 19 C | 20 N ) -136.575 -90.000 46.575 0.422 0.400 2 ( 19 CB | 19 CA | 19 C | 20 N ) -136.575 -180.000 -43.425 0.494 0.300 3 ( 19 CB | 19 CA | 19 C | 19 O ) 43.740 180.000 136.260 0.646 0.375 1 ( 19 CB | 19 CA | 19 C | 19 O ) 43.740 90.000 46.260 0.313 0.300 2 ( 20 C | 21 N | 21 CA | 21 C ) -82.976 -180.000 -97.024 0.421 0.375 1 ( 20 C | 21 N | 21 CA | 21 C ) -82.976 -45.000 37.976 0.282 0.150 4 ( 20 CB | 20 CA | 20 C | 21 N ) -138.160 -180.000 -41.840 0.127 0.500 1 ( 20 CB | 20 CA | 20 C | 21 N ) -138.160 -90.000 48.160 0.444 0.400 2 ( 20 CB | 20 CA | 20 C | 21 N ) -138.160 -180.000 -41.840 0.474 0.300 3 ( 20 CB | 20 CA | 20 C | 21 N ) -138.160 -108.000 30.160 0.187 0.100 5 ( 20 CB | 20 CA | 20 C | 20 O ) 42.585 180.000 137.415 0.651 0.375 1 ( 20 CB | 20 CA | 20 C | 20 O ) 42.585 90.000 47.415 0.325 0.300 2 ( 21 C | 22 N | 22 CA | 22 C ) -67.095 -180.000 -112.905 0.521 0.375 1 ( 21 C | 22 N | 22 CA | 22 C ) -67.095 -36.000 31.095 0.143 0.075 5 ( 21 C | 22 N | 22 CA | 22 CB ) 171.130 90.000 -81.130 0.781 0.400 2 ( 21 C | 22 N | 22 CA | 22 CB ) 171.130 135.000 -36.130 0.363 0.200 4 ( 23 CZ | 23 NE | 23 CD | 23 CG ) -129.984 -180.000 -50.016 0.715 2.000 1 ( 22 C | 23 N | 23 CA | 23 C ) -63.458 -180.000 -116.542 0.543 0.375 1 ( 22 C | 23 N | 23 CA | 23 CB ) 174.378 90.000 -84.378 0.792 0.400 2 ( 22 C | 23 N | 23 CA | 23 CB ) 174.378 135.000 -39.378 0.385 0.200 4 ( 22 CB | 22 CA | 22 C | 23 N ) -68.129 -180.000 -111.871 0.686 0.500 1 ( 22 CB | 22 CA | 22 C | 23 N ) -68.129 -36.000 32.129 0.194 0.100 5 ( 22 CB | 22 CA | 22 C | 22 O ) 111.038 180.000 68.962 0.240 0.375 1 ( 22 CB | 22 CA | 22 C | 22 O ) 111.038 60.000 -51.038 0.426 0.225 3 ( 23 C | 24 N | 24 CA | 24 C ) -59.706 -180.000 -120.294 0.564 0.375 1 ( 23 C | 24 N | 24 CA | 24 C ) -59.706 -90.000 -30.294 0.153 0.300 2 ( 23 C | 24 N | 24 CA | 24 CB ) 177.296 90.000 -87.296 0.798 0.400 2 ( 23 C | 24 N | 24 CA | 24 CB ) 177.296 135.000 -42.296 0.396 0.200 4 ( 23 CB | 23 CA | 23 C | 24 N ) 77.949 180.000 102.051 0.604 0.500 1 ( 23 CB | 23 CA | 23 C | 24 N ) 77.949 45.000 -32.949 0.333 0.200 4 ( 23 CB | 23 CA | 23 C | 24 N ) 77.949 108.000 30.051 0.187 0.100 5 ( 23 CB | 23 CA | 23 C | 23 O ) -103.202 -180.000 -76.798 0.289 0.375 1 ( 23 CB | 23 CA | 23 C | 23 O ) -103.202 -60.000 43.202 0.368 0.225 3 ( 23 CB | 23 CA | 23 C | 23 O ) -103.202 -135.000 -31.798 0.241 0.150 4 ( 24 C | 25 N | 25 CA | 25 C ) -56.723 -180.000 -123.277 0.581 0.375 1 ( 24 C | 25 N | 25 CA | 25 C ) -56.723 -90.000 -33.277 0.181 0.300 2 ( 24 C | 25 N | 25 CA | 25 CB ) -179.417 -90.000 89.417 0.800 0.400 2 ( 24 C | 25 N | 25 CA | 25 CB ) -179.417 -135.000 44.417 0.400 0.200 4 ( 24 CB | 24 CA | 24 C | 25 N ) 98.544 180.000 81.456 0.426 0.500 1 ( 24 CB | 24 CA | 24 C | 25 N ) 98.544 60.000 -38.544 0.430 0.300 3 ( 24 CB | 24 CA | 24 C | 25 N ) 98.544 135.000 36.456 0.365 0.200 4 ( 24 CB | 24 CA | 24 C | 24 O ) -81.776 -180.000 -98.224 0.429 0.375 1 ( 24 CB | 24 CA | 24 C | 24 O ) -81.776 -45.000 36.776 0.276 0.150 4 ( 25 C | 26 N | 26 CA | 26 C ) -63.808 -180.000 -116.192 0.541 0.375 1 ( 25 C | 26 N | 26 CA | 26 CB ) 173.448 90.000 -83.448 0.790 0.400 2 ( 25 C | 26 N | 26 CA | 26 CB ) 173.448 135.000 -38.448 0.379 0.200 4 ( 25 CB | 25 CA | 25 C | 26 N ) 87.353 180.000 92.647 0.523 0.500 1 ( 25 CB | 25 CA | 25 C | 26 N ) 87.353 45.000 -42.353 0.397 0.200 4 ( 25 CB | 25 CA | 25 C | 25 O ) -93.626 -180.000 -86.374 0.351 0.375 1 ( 25 CB | 25 CA | 25 C | 25 O ) -93.626 -60.000 33.626 0.267 0.225 3 ( 25 CB | 25 CA | 25 C | 25 O ) -93.626 -135.000 -41.374 0.295 0.150 4 ( 27 CD | 27 CG | 27 CB | 27 CA ) 138.482 180.000 41.518 3.134 2.000 3 ( 27 CZ | 27 NE | 27 CD | 27 CG ) 98.914 180.000 81.086 1.690 2.000 1 ( 26 C | 27 N | 27 CA | 27 C ) -57.120 -180.000 -122.880 0.579 0.375 1 ( 26 C | 27 N | 27 CA | 27 C ) -57.120 -90.000 -32.880 0.177 0.300 2 ( 26 C | 27 N | 27 CA | 27 CB ) -179.694 -90.000 89.694 0.800 0.400 2 ( 26 C | 27 N | 27 CA | 27 CB ) -179.694 -135.000 44.694 0.400 0.200 4 ( 26 CB | 26 CA | 26 C | 27 N ) 76.022 180.000 103.978 0.621 0.500 1 ( 26 CB | 26 CA | 26 C | 27 N ) 76.022 45.000 -31.022 0.312 0.200 4 ( 26 CB | 26 CA | 26 C | 27 N ) 76.022 108.000 31.978 0.194 0.100 5 ( 26 CB | 26 CA | 26 C | 26 O ) -105.363 -180.000 -74.637 0.276 0.375 1 ( 26 CB | 26 CA | 26 C | 26 O ) -105.363 -60.000 45.363 0.387 0.225 3 ( 27 C | 28 N | 28 CA | 28 C ) -64.015 -180.000 -115.985 0.539 0.375 1 ( 27 C | 28 N | 28 CA | 28 CB ) 173.011 90.000 -83.011 0.788 0.400 2 ( 27 C | 28 N | 28 CA | 28 CB ) 173.011 135.000 -38.011 0.377 0.200 4 ( 27 CB | 27 CA | 27 C | 28 N ) 82.177 180.000 97.823 0.568 0.500 1 ( 27 CB | 27 CA | 27 C | 28 N ) 82.177 45.000 -37.177 0.371 0.200 4 ( 27 CB | 27 CA | 27 C | 27 O ) -98.865 -180.000 -81.135 0.317 0.375 1 ( 27 CB | 27 CA | 27 C | 27 O ) -98.865 -60.000 38.865 0.326 0.225 3 ( 27 CB | 27 CA | 27 C | 27 O ) -98.865 -135.000 -36.135 0.272 0.150 4 ( 28 C | 29 N | 29 CA | 29 C ) -74.463 -180.000 -105.537 0.475 0.375 1 ( 28 C | 29 N | 29 CA | 29 C ) -74.463 -108.000 -33.537 0.148 0.075 5 ( 28 C | 29 N | 29 CA | 29 CB ) 160.479 90.000 -70.479 0.711 0.400 2 ( 28 CB | 28 CA | 28 C | 29 N ) 70.871 180.000 109.129 0.664 0.500 1 ( 28 CB | 28 CA | 28 C | 29 N ) 70.871 36.000 -34.871 0.200 0.100 5 ( 28 CB | 28 CA | 28 C | 28 O ) -109.200 -180.000 -70.800 0.252 0.375 1 ( 28 CB | 28 CA | 28 C | 28 O ) -109.200 -60.000 49.200 0.415 0.225 3 ( 29 C | 30 N | 30 CA | 30 C ) -71.549 -180.000 -108.451 0.494 0.375 1 ( 29 C | 30 N | 30 CA | 30 C ) -71.549 -36.000 35.549 0.150 0.075 5 ( 29 C | 30 N | 30 CA | 30 CB ) 165.459 90.000 -75.459 0.750 0.400 2 ( 29 C | 30 N | 30 CA | 30 CB ) 165.459 135.000 -30.459 0.306 0.200 4 ( 29 CB | 29 CA | 29 C | 30 N ) 103.760 180.000 76.240 0.381 0.500 1 ( 29 CB | 29 CA | 29 C | 30 N ) 103.760 60.000 -43.760 0.498 0.300 3 ( 29 CB | 29 CA | 29 C | 30 N ) 103.760 135.000 31.240 0.315 0.200 4 ( 29 CB | 29 CA | 29 C | 29 O ) -75.935 -180.000 -104.065 0.466 0.375 1 ( 29 CB | 29 CA | 29 C | 29 O ) -75.935 -45.000 30.935 0.233 0.150 4 ( 29 CB | 29 CA | 29 C | 29 O ) -75.935 -108.000 -32.065 0.146 0.075 5 ( 30 C | 31 N | 31 CA | 31 C ) -99.561 -180.000 -80.439 0.313 0.375 1 ( 30 C | 31 N | 31 CA | 31 C ) -99.561 -60.000 39.561 0.333 0.225 3 ( 30 C | 31 N | 31 CA | 31 C ) -99.561 -135.000 -35.439 0.268 0.150 4 ( 30 C | 31 N | 31 CA | 31 CB ) 138.098 180.000 41.902 0.128 0.500 1 ( 30 C | 31 N | 31 CA | 31 CB ) 138.098 90.000 -48.098 0.443 0.400 2 ( 30 C | 31 N | 31 CA | 31 CB ) 138.098 180.000 41.902 0.475 0.300 3 ( 30 C | 31 N | 31 CA | 31 CB ) 138.098 108.000 -30.098 0.187 0.100 5 ( 30 CB | 30 CA | 30 C | 31 N ) 83.972 180.000 96.028 0.553 0.500 1 ( 30 CB | 30 CA | 30 C | 31 N ) 83.972 45.000 -38.972 0.383 0.200 4 ( 30 CB | 30 CA | 30 C | 30 O ) -94.990 -180.000 -85.010 0.342 0.375 1 ( 30 CB | 30 CA | 30 C | 30 O ) -94.990 -60.000 34.990 0.283 0.225 3 ( 30 CB | 30 CA | 30 C | 30 O ) -94.990 -135.000 -40.010 0.291 0.150 4 ( 31 C | 32 N | 32 CA | 32 C ) 61.656 180.000 118.344 0.553 0.375 1 ( 31 C | 32 N | 32 CA | 32 CB ) -62.899 -180.000 -117.101 0.728 0.500 1 ( 31 CB | 31 CA | 31 C | 32 N ) 121.846 180.000 58.154 0.236 0.500 1 ( 31 CB | 31 CA | 31 C | 32 N ) 121.846 90.000 -31.846 0.223 0.400 2 ( 31 CB | 31 CA | 31 C | 32 N ) 121.846 180.000 58.154 0.599 0.300 3 ( 31 CB | 31 CA | 31 C | 31 O ) -58.171 -180.000 -121.829 0.573 0.375 1 ( 31 CB | 31 CA | 31 C | 31 O ) -58.171 -90.000 -31.829 0.167 0.300 2 ( 32 C | 33 N | 33 CA | 33 C ) -92.299 -180.000 -87.701 0.360 0.375 1 ( 32 C | 33 N | 33 CA | 33 C ) -92.299 -60.000 32.299 0.252 0.225 3 ( 32 C | 33 N | 33 CA | 33 C ) -92.299 -135.000 -42.701 0.298 0.150 4 ( 32 C | 33 N | 33 CA | 33 CB ) 145.597 180.000 34.403 0.087 0.500 1 ( 32 C | 33 N | 33 CA | 33 CB ) 145.597 90.000 -55.597 0.545 0.400 2 ( 32 C | 33 N | 33 CA | 33 CB ) 145.597 180.000 34.403 0.369 0.300 3 ( 32 C | 33 N | 33 CA | 33 CB ) 145.597 180.000 34.403 0.199 0.100 5 ( 32 CB | 32 CA | 32 C | 33 N ) -156.929 -90.000 66.929 0.677 0.400 2 ( 32 CB | 32 CA | 32 C | 32 O ) 24.001 180.000 155.999 0.718 0.375 1 ( 32 CB | 32 CA | 32 C | 32 O ) 24.001 90.000 65.999 0.501 0.300 2 ( 32 CB | 32 CA | 32 C | 32 O ) 24.001 60.000 35.999 0.295 0.225 3 ( 33 CB | 33 CA | 33 C | 34 N ) -119.106 -180.000 -60.894 0.257 0.500 1 ( 33 CB | 33 CA | 33 C | 34 N ) -119.106 -60.000 59.106 0.600 0.300 3 ( 33 CB | 33 CA | 33 C | 33 O ) 61.430 180.000 118.570 0.554 0.375 1 ( 34 C | 35 N | 35 CA | 35 C ) -157.891 -90.000 67.891 0.515 0.300 2 ( 34 C | 35 N | 35 CA | 35 CB ) 77.739 180.000 102.261 0.606 0.500 1 ( 34 C | 35 N | 35 CA | 35 CB ) 77.739 45.000 -32.739 0.331 0.200 4 ( 34 C | 35 N | 35 CA | 35 CB ) 77.739 108.000 30.261 0.188 0.100 5 ( 34 CB | 34 CA | 34 C | 35 N ) 143.060 180.000 36.940 0.100 0.500 1 ( 34 CB | 34 CA | 34 C | 35 N ) 143.060 90.000 -53.060 0.511 0.400 2 ( 34 CB | 34 CA | 34 C | 35 N ) 143.060 180.000 36.940 0.407 0.300 3 ( 34 CB | 34 CA | 34 C | 35 N ) 143.060 108.000 -35.060 0.200 0.100 5 ( 34 CB | 34 CA | 34 C | 34 O ) -37.772 -180.000 -142.228 0.671 0.375 1 ( 34 CB | 34 CA | 34 C | 34 O ) -37.772 -90.000 -52.228 0.375 0.300 2 ( 35 CB | 35 CA | 35 C | 36 N ) -80.400 -180.000 -99.600 0.583 0.500 1 ( 35 CB | 35 CA | 35 C | 36 N ) -80.400 -45.000 35.400 0.357 0.200 4 ( 35 CB | 35 CA | 35 C | 35 O ) 99.620 180.000 80.380 0.312 0.375 1 ( 35 CB | 35 CA | 35 C | 35 O ) 99.620 60.000 -39.620 0.334 0.225 3 ( 35 CB | 35 CA | 35 C | 35 O ) 99.620 135.000 35.380 0.267 0.150 4 ( 36 C | 37 N | 37 CA | 37 C ) -65.924 -180.000 -114.076 0.528 0.375 1 ( 36 C | 37 N | 37 CA | 37 CB ) 172.790 90.000 -82.790 0.787 0.400 2 ( 36 C | 37 N | 37 CA | 37 CB ) 172.790 135.000 -37.790 0.375 0.200 4 ( 36 CB | 36 CA | 36 C | 37 N ) -107.080 -180.000 -72.920 0.353 0.500 1 ( 36 CB | 36 CA | 36 C | 37 N ) -107.080 -60.000 47.080 0.534 0.300 3 ( 36 CB | 36 CA | 36 C | 36 O ) 71.233 180.000 108.767 0.496 0.375 1 ( 36 CB | 36 CA | 36 C | 36 O ) 71.233 36.000 -35.233 0.150 0.075 5 ( 37 C | 38 N | 38 CA | 38 C ) -54.833 -180.000 -125.167 0.591 0.375 1 ( 37 C | 38 N | 38 CA | 38 C ) -54.833 -90.000 -35.167 0.199 0.300 2 ( 37 C | 38 N | 38 CA | 38 CB ) -177.898 -90.000 87.898 0.799 0.400 2 ( 37 C | 38 N | 38 CA | 38 CB ) -177.898 -135.000 42.898 0.398 0.200 4 ( 37 CB | 37 CA | 37 C | 38 N ) 84.589 180.000 95.411 0.547 0.500 1 ( 37 CB | 37 CA | 37 C | 38 N ) 84.589 45.000 -39.589 0.386 0.200 4 ( 37 CB | 37 CA | 37 C | 37 O ) -94.700 -180.000 -85.300 0.344 0.375 1 ( 37 CB | 37 CA | 37 C | 37 O ) -94.700 -60.000 34.700 0.280 0.225 3 ( 37 CB | 37 CA | 37 C | 37 O ) -94.700 -135.000 -40.300 0.292 0.150 4 ( 38 C | 39 N | 39 CA | 39 C ) -55.611 -180.000 -124.389 0.587 0.375 1 ( 38 C | 39 N | 39 CA | 39 C ) -55.611 -90.000 -34.389 0.191 0.300 2 ( 38 C | 39 N | 39 CA | 39 CB ) -178.506 -90.000 88.506 0.799 0.400 2 ( 38 C | 39 N | 39 CA | 39 CB ) -178.506 -135.000 43.506 0.399 0.200 4 ( 38 CB | 38 CA | 38 C | 39 N ) 78.682 180.000 101.318 0.598 0.500 1 ( 38 CB | 38 CA | 38 C | 39 N ) 78.682 45.000 -33.682 0.341 0.200 4 ( 38 CB | 38 CA | 38 C | 38 O ) -102.614 -180.000 -77.386 0.293 0.375 1 ( 38 CB | 38 CA | 38 C | 38 O ) -102.614 -60.000 42.614 0.363 0.225 3 ( 38 CB | 38 CA | 38 C | 38 O ) -102.614 -135.000 -32.386 0.246 0.150 4 ( 39 C | 40 N | 40 CA | 40 C ) -52.695 -180.000 -127.305 0.602 0.375 1 ( 39 C | 40 N | 40 CA | 40 C ) -52.695 -90.000 -37.305 0.220 0.300 2 ( 39 C | 40 N | 40 CA | 40 CB ) -173.868 -90.000 83.868 0.791 0.400 2 ( 39 C | 40 N | 40 CA | 40 CB ) -173.868 -135.000 38.868 0.382 0.200 4 ( 39 CB | 39 CA | 39 C | 40 N ) 83.553 180.000 96.447 0.556 0.500 1 ( 39 CB | 39 CA | 39 C | 40 N ) 83.553 45.000 -38.553 0.380 0.200 4 ( 39 CB | 39 CA | 39 C | 39 O ) -97.773 -180.000 -82.227 0.324 0.375 1 ( 39 CB | 39 CA | 39 C | 39 O ) -97.773 -60.000 37.773 0.314 0.225 3 ( 39 CB | 39 CA | 39 C | 39 O ) -97.773 -135.000 -37.227 0.278 0.150 4 ( 40 C | 41 N | 41 CA | 41 C ) -89.368 -180.000 -90.632 0.379 0.375 1 ( 40 C | 41 N | 41 CA | 41 C ) -89.368 -45.000 44.368 0.300 0.150 4 ( 40 C | 41 N | 41 CA | 41 CB ) 148.249 180.000 31.751 0.075 0.500 1 ( 40 C | 41 N | 41 CA | 41 CB ) 148.249 90.000 -58.249 0.578 0.400 2 ( 40 C | 41 N | 41 CA | 41 CB ) 148.249 180.000 31.751 0.327 0.300 3 ( 40 C | 41 N | 41 CA | 41 CB ) 148.249 180.000 31.751 0.193 0.100 5 ( 40 CB | 40 CA | 40 C | 41 N ) 79.063 180.000 100.937 0.595 0.500 1 ( 40 CB | 40 CA | 40 C | 41 N ) 79.063 45.000 -34.063 0.344 0.200 4 ( 40 CB | 40 CA | 40 C | 40 O ) -101.055 -180.000 -78.945 0.303 0.375 1 ( 40 CB | 40 CA | 40 C | 40 O ) -101.055 -60.000 41.055 0.348 0.225 3 ( 40 CB | 40 CA | 40 C | 40 O ) -101.055 -135.000 -33.945 0.258 0.150 4 ( 41 C | 42 N | 42 CA | 42 C ) -91.696 -180.000 -88.304 0.364 0.375 1 ( 41 C | 42 N | 42 CA | 42 C ) -91.696 -60.000 31.696 0.245 0.225 3 ( 41 C | 42 N | 42 CA | 42 C ) -91.696 -135.000 -43.304 0.299 0.150 4 ( 41 C | 42 N | 42 CA | 42 CB ) 143.584 180.000 36.416 0.098 0.500 1 ( 41 C | 42 N | 42 CA | 42 CB ) 143.584 90.000 -53.584 0.518 0.400 2 ( 41 C | 42 N | 42 CA | 42 CB ) 143.584 180.000 36.416 0.399 0.300 3 ( 41 C | 42 N | 42 CA | 42 CB ) 143.584 108.000 -35.584 0.200 0.100 5 ( 41 CB | 41 CA | 41 C | 42 N ) 96.153 180.000 83.847 0.446 0.500 1 ( 41 CB | 41 CA | 41 C | 42 N ) 96.153 60.000 -36.153 0.395 0.300 3 ( 41 CB | 41 CA | 41 C | 42 N ) 96.153 135.000 38.847 0.382 0.200 4 ( 41 CB | 41 CA | 41 C | 41 O ) -84.387 -180.000 -95.613 0.412 0.375 1 ( 41 CB | 41 CA | 41 C | 41 O ) -84.387 -45.000 39.387 0.289 0.150 4 ( 42 C | 43 N | 43 CA | 43 C ) -83.287 -180.000 -96.713 0.419 0.375 1 ( 42 C | 43 N | 43 CA | 43 C ) -83.287 -45.000 38.287 0.284 0.150 4 ( 42 C | 43 N | 43 CA | 43 CB ) 154.342 90.000 -64.342 0.650 0.400 2 ( 42 CB | 42 CA | 42 C | 43 N ) 110.607 180.000 69.393 0.324 0.500 1 ( 42 CB | 42 CA | 42 C | 43 N ) 110.607 60.000 -50.607 0.564 0.300 3 ( 42 CB | 42 CA | 42 C | 42 O ) -69.051 -180.000 -110.949 0.509 0.375 1 ( 42 CB | 42 CA | 42 C | 42 O ) -69.051 -36.000 33.051 0.148 0.075 5 ( 43 CB | 43 CA | 43 C | 44 N ) -91.983 -180.000 -88.017 0.483 0.500 1 ( 43 CB | 43 CA | 43 C | 44 N ) -91.983 -60.000 31.983 0.331 0.300 3 ( 43 CB | 43 CA | 43 C | 44 N ) -91.983 -135.000 -43.017 0.398 0.200 4 ( 43 CB | 43 CA | 43 C | 43 O ) 88.561 180.000 91.439 0.384 0.375 1 ( 43 CB | 43 CA | 43 C | 43 O ) 88.561 45.000 -43.561 0.299 0.150 4 ( 44 C | 45 N | 45 CA | 45 C ) -56.319 -180.000 -123.681 0.583 0.375 1 ( 44 C | 45 N | 45 CA | 45 C ) -56.319 -90.000 -33.681 0.185 0.300 2 ( 44 C | 45 N | 45 CA | 45 CB ) 179.251 90.000 -89.251 0.800 0.400 2 ( 44 C | 45 N | 45 CA | 45 CB ) 179.251 135.000 -44.251 0.400 0.200 4 ( 44 CB | 44 CA | 44 C | 45 N ) -77.065 -180.000 -102.935 0.612 0.500 1 ( 44 CB | 44 CA | 44 C | 45 N ) -77.065 -45.000 32.065 0.324 0.200 4 ( 44 CB | 44 CA | 44 C | 45 N ) -77.065 -108.000 -30.935 0.190 0.100 5 ( 44 CB | 44 CA | 44 C | 44 O ) 102.515 180.000 77.485 0.294 0.375 1 ( 44 CB | 44 CA | 44 C | 44 O ) 102.515 60.000 -42.515 0.362 0.225 3 ( 44 CB | 44 CA | 44 C | 44 O ) 102.515 135.000 32.485 0.246 0.150 4 ( 45 C | 46 N | 46 CA | 46 C ) -66.293 -180.000 -113.707 0.526 0.375 1 ( 45 C | 46 N | 46 CA | 46 C ) -66.293 -36.000 30.293 0.141 0.075 5 ( 45 C | 46 N | 46 CA | 46 CB ) 170.477 90.000 -80.477 0.778 0.400 2 ( 45 C | 46 N | 46 CA | 46 CB ) 170.477 135.000 -35.477 0.357 0.200 4 ( 45 CB | 45 CA | 45 C | 46 N ) 83.841 180.000 96.159 0.554 0.500 1 ( 45 CB | 45 CA | 45 C | 46 N ) 83.841 45.000 -38.841 0.382 0.200 4 ( 45 CB | 45 CA | 45 C | 45 O ) -97.466 -180.000 -82.534 0.326 0.375 1 ( 45 CB | 45 CA | 45 C | 45 O ) -97.466 -60.000 37.466 0.311 0.225 3 ( 45 CB | 45 CA | 45 C | 45 O ) -97.466 -135.000 -37.534 0.280 0.150 4 ( 46 C | 47 N | 47 CA | 47 C ) -53.186 -180.000 -126.814 0.600 0.375 1 ( 46 C | 47 N | 47 CA | 47 C ) -53.186 -90.000 -36.814 0.215 0.300 2 ( 46 C | 47 N | 47 CA | 47 CB ) -175.740 -90.000 85.740 0.796 0.400 2 ( 46 C | 47 N | 47 CA | 47 CB ) -175.740 -135.000 40.740 0.391 0.200 4 ( 46 CB | 46 CA | 46 C | 47 N ) 65.529 180.000 114.471 0.707 0.500 1 ( 46 CB | 46 CA | 46 C | 46 O ) -114.340 -180.000 -65.660 0.220 0.375 1 ( 46 CB | 46 CA | 46 C | 46 O ) -114.340 -60.000 54.340 0.440 0.225 3 ( 47 C | 48 N | 48 CA | 48 C ) -63.362 -180.000 -116.638 0.543 0.375 1 ( 47 C | 48 N | 48 CA | 48 CB ) 174.662 90.000 -84.662 0.793 0.400 2 ( 47 C | 48 N | 48 CA | 48 CB ) 174.662 135.000 -39.662 0.386 0.200 4 ( 47 CB | 47 CA | 47 C | 48 N ) 88.226 180.000 91.774 0.515 0.500 1 ( 47 CB | 47 CA | 47 C | 48 N ) 88.226 45.000 -43.226 0.398 0.200 4 ( 47 CB | 47 CA | 47 C | 47 O ) -92.210 -180.000 -87.790 0.361 0.375 1 ( 47 CB | 47 CA | 47 C | 47 O ) -92.210 -60.000 32.210 0.251 0.225 3 ( 47 CB | 47 CA | 47 C | 47 O ) -92.210 -135.000 -42.790 0.298 0.150 4 ( 48 C | 49 N | 49 CA | 49 C ) -57.201 -180.000 -122.799 0.578 0.375 1 ( 48 C | 49 N | 49 CA | 49 C ) -57.201 -90.000 -32.799 0.176 0.300 2 ( 48 C | 49 N | 49 CA | 49 CB ) -179.123 -90.000 89.123 0.800 0.400 2 ( 48 C | 49 N | 49 CA | 49 CB ) -179.123 -135.000 44.123 0.400 0.200 4 ( 48 CB | 48 CA | 48 C | 49 N ) 75.252 180.000 104.748 0.627 0.500 1 ( 48 CB | 48 CA | 48 C | 49 N ) 75.252 45.000 -30.252 0.303 0.200 4 ( 48 CB | 48 CA | 48 C | 49 N ) 75.252 108.000 32.748 0.196 0.100 5 ( 48 CB | 48 CA | 48 C | 48 O ) -104.454 -180.000 -75.546 0.281 0.375 1 ( 48 CB | 48 CA | 48 C | 48 O ) -104.454 -60.000 44.454 0.379 0.225 3 ( 48 CB | 48 CA | 48 C | 48 O ) -104.454 -135.000 -30.546 0.230 0.150 4 ( 49 C | 50 N | 50 CA | 50 C ) -67.966 -180.000 -112.034 0.516 0.375 1 ( 49 C | 50 N | 50 CA | 50 C ) -67.966 -36.000 31.966 0.145 0.075 5 ( 49 C | 50 N | 50 CA | 50 CB ) 169.226 90.000 -79.226 0.772 0.400 2 ( 49 C | 50 N | 50 CA | 50 CB ) 169.226 135.000 -34.226 0.346 0.200 4 ( 49 CB | 49 CA | 49 C | 50 N ) 75.707 180.000 104.293 0.623 0.500 1 ( 49 CB | 49 CA | 49 C | 50 N ) 75.707 45.000 -30.707 0.308 0.200 4 ( 49 CB | 49 CA | 49 C | 50 N ) 75.707 108.000 32.293 0.195 0.100 5 ( 49 CB | 49 CA | 49 C | 49 O ) -104.711 -180.000 -75.289 0.280 0.375 1 ( 49 CB | 49 CA | 49 C | 49 O ) -104.711 -60.000 44.711 0.382 0.225 3 ( 49 CB | 49 CA | 49 C | 49 O ) -104.711 -135.000 -30.289 0.228 0.150 4 ( 50 C | 51 N | 51 CA | 51 C ) -55.351 -180.000 -124.649 0.588 0.375 1 ( 50 C | 51 N | 51 CA | 51 C ) -55.351 -90.000 -34.649 0.194 0.300 2 ( 50 C | 51 N | 51 CA | 51 CB ) -177.398 -90.000 87.398 0.798 0.400 2 ( 50 C | 51 N | 51 CA | 51 CB ) -177.398 -135.000 42.398 0.397 0.200 4 ( 50 CB | 50 CA | 50 C | 51 N ) 88.376 180.000 91.624 0.514 0.500 1 ( 50 CB | 50 CA | 50 C | 51 N ) 88.376 45.000 -43.376 0.399 0.200 4 ( 50 CB | 50 CA | 50 C | 50 O ) -92.205 -180.000 -87.795 0.361 0.375 1 ( 50 CB | 50 CA | 50 C | 50 O ) -92.205 -60.000 32.205 0.251 0.225 3 ( 50 CB | 50 CA | 50 C | 50 O ) -92.205 -135.000 -42.795 0.298 0.150 4 ( 51 C | 52 N | 52 CA | 52 C ) -58.418 -180.000 -121.582 0.571 0.375 1 ( 51 C | 52 N | 52 CA | 52 C ) -58.418 -90.000 -31.582 0.165 0.300 2 ( 51 C | 52 N | 52 CA | 52 CB ) 179.913 90.000 -89.913 0.800 0.400 2 ( 51 C | 52 N | 52 CA | 52 CB ) 179.913 135.000 -44.913 0.400 0.200 4 ( 51 CB | 51 CA | 51 C | 52 N ) 71.837 180.000 108.163 0.656 0.500 1 ( 51 CB | 51 CA | 51 C | 52 N ) 71.837 36.000 -35.837 0.200 0.100 5 ( 51 CB | 51 CA | 51 C | 51 O ) -109.182 -180.000 -70.818 0.252 0.375 1 ( 51 CB | 51 CA | 51 C | 51 O ) -109.182 -60.000 49.182 0.415 0.225 3 ( 52 C | 53 N | 53 CA | 53 C ) -76.595 -180.000 -103.405 0.462 0.375 1 ( 52 C | 53 N | 53 CA | 53 C ) -76.595 -45.000 31.595 0.239 0.150 4 ( 52 C | 53 N | 53 CA | 53 C ) -76.595 -108.000 -31.405 0.144 0.075 5 ( 52 C | 53 N | 53 CA | 53 CB ) 160.433 90.000 -70.433 0.710 0.400 2 ( 52 CB | 52 CA | 52 C | 53 N ) 85.390 180.000 94.610 0.540 0.500 1 ( 52 CB | 52 CA | 52 C | 53 N ) 85.390 45.000 -40.390 0.390 0.200 4 ( 52 CB | 52 CA | 52 C | 52 O ) -94.735 -180.000 -85.265 0.344 0.375 1 ( 52 CB | 52 CA | 52 C | 52 O ) -94.735 -60.000 34.735 0.280 0.225 3 ( 52 CB | 52 CA | 52 C | 52 O ) -94.735 -135.000 -40.265 0.292 0.150 4 ( 53 C | 54 N | 54 CA | 54 C ) -85.205 -180.000 -94.795 0.406 0.375 1 ( 53 C | 54 N | 54 CA | 54 C ) -85.205 -45.000 40.205 0.292 0.150 4 ( 53 C | 54 N | 54 CA | 54 CB ) 151.820 90.000 -61.820 0.622 0.400 2 ( 53 CB | 53 CA | 53 C | 54 N ) 98.151 180.000 81.849 0.429 0.500 1 ( 53 CB | 53 CA | 53 C | 54 N ) 98.151 60.000 -38.151 0.424 0.300 3 ( 53 CB | 53 CA | 53 C | 54 N ) 98.151 135.000 36.849 0.368 0.200 4 ( 53 CB | 53 CA | 53 C | 53 O ) -82.009 -180.000 -97.991 0.427 0.375 1 ( 53 CB | 53 CA | 53 C | 53 O ) -82.009 -45.000 37.009 0.277 0.150 4 ( 54 C | 55 N | 55 CA | 55 C ) -125.605 -180.000 -54.395 0.157 0.375 1 ( 54 C | 55 N | 55 CA | 55 C ) -125.605 -90.000 35.605 0.203 0.300 2 ( 54 C | 55 N | 55 CA | 55 C ) -125.605 -180.000 -54.395 0.440 0.225 3 ( 54 C | 55 N | 55 CA | 55 CB ) 110.932 180.000 69.068 0.321 0.500 1 ( 54 C | 55 N | 55 CA | 55 CB ) 110.932 60.000 -50.932 0.567 0.300 3 ( 54 CB | 54 CA | 54 C | 55 N ) 119.636 180.000 60.364 0.253 0.500 1 ( 54 CB | 54 CA | 54 C | 55 N ) 119.636 60.000 -59.636 0.600 0.300 3 ( 54 CB | 54 CA | 54 C | 54 O ) -60.056 -180.000 -119.944 0.562 0.375 1 ( 55 CB | 55 CA | 55 C | 56 N ) -87.788 -180.000 -92.212 0.519 0.500 1 ( 55 CB | 55 CA | 55 C | 56 N ) -87.788 -45.000 42.788 0.398 0.200 4 ( 55 CB | 55 CA | 55 C | 55 O ) 91.974 180.000 88.026 0.362 0.375 1 ( 55 CB | 55 CA | 55 C | 55 O ) 91.974 60.000 -31.974 0.248 0.225 3 ( 55 CB | 55 CA | 55 C | 55 O ) 91.974 135.000 43.026 0.299 0.150 4 ( 56 C | 57 N | 57 CA | 57 C ) -69.618 -180.000 -110.382 0.506 0.375 1 ( 56 C | 57 N | 57 CA | 57 C ) -69.618 -36.000 33.618 0.148 0.075 5 ( 56 C | 57 N | 57 CA | 57 CB ) 168.746 90.000 -78.746 0.770 0.400 2 ( 56 C | 57 N | 57 CA | 57 CB ) 168.746 135.000 -33.746 0.341 0.200 4 ( 56 CB | 56 CA | 56 C | 57 N ) 157.853 90.000 -67.853 0.686 0.400 2 ( 56 CB | 56 CA | 56 C | 56 O ) -23.441 -180.000 -156.559 0.719 0.375 1 ( 56 CB | 56 CA | 56 C | 56 O ) -23.441 -90.000 -66.559 0.505 0.300 2 ( 56 CB | 56 CA | 56 C | 56 O ) -23.441 -60.000 -36.559 0.301 0.225 3 ( 57 C | 58 N | 58 CA | 58 C ) -72.044 -180.000 -107.956 0.491 0.375 1 ( 57 C | 58 N | 58 CA | 58 C ) -72.044 -108.000 -35.956 0.150 0.075 5 ( 57 C | 58 N | 58 CA | 58 CB ) 167.418 90.000 -77.418 0.762 0.400 2 ( 57 C | 58 N | 58 CA | 58 CB ) 167.418 135.000 -32.418 0.328 0.200 4 ( 57 CB | 57 CA | 57 C | 58 N ) -101.375 -180.000 -78.625 0.401 0.500 1 ( 57 CB | 57 CA | 57 C | 58 N ) -101.375 -60.000 41.375 0.468 0.300 3 ( 57 CB | 57 CA | 57 C | 58 N ) -101.375 -135.000 -33.625 0.340 0.200 4 ( 57 CB | 57 CA | 57 C | 57 O ) 78.999 180.000 101.001 0.447 0.375 1 ( 57 CB | 57 CA | 57 C | 57 O ) 78.999 45.000 -33.999 0.258 0.150 4 ( 58 C | 59 N | 59 CA | 59 C ) -49.248 -180.000 -130.752 0.620 0.375 1 ( 58 C | 59 N | 59 CA | 59 C ) -49.248 -90.000 -40.752 0.256 0.300 2 ( 58 C | 59 N | 59 CA | 59 CB ) -171.590 -90.000 81.590 0.783 0.400 2 ( 58 C | 59 N | 59 CA | 59 CB ) -171.590 -135.000 36.590 0.367 0.200 4 ( 58 CB | 58 CA | 58 C | 59 N ) -79.089 -180.000 -100.911 0.595 0.500 1 ( 58 CB | 58 CA | 58 C | 59 N ) -79.089 -45.000 34.089 0.345 0.200 4 ( 58 CB | 58 CA | 58 C | 58 O ) 100.395 180.000 79.605 0.307 0.375 1 ( 58 CB | 58 CA | 58 C | 58 O ) 100.395 60.000 -40.395 0.342 0.225 3 ( 58 CB | 58 CA | 58 C | 58 O ) 100.395 135.000 34.605 0.262 0.150 4 ( 59 C | 60 N | 60 CA | 60 C ) -65.724 -180.000 -114.276 0.529 0.375 1 ( 59 C | 60 N | 60 CA | 60 CB ) 172.109 90.000 -82.109 0.785 0.400 2 ( 59 C | 60 N | 60 CA | 60 CB ) 172.109 135.000 -37.109 0.370 0.200 4 ( 59 CB | 59 CA | 59 C | 60 N ) 83.574 180.000 96.426 0.556 0.500 1 ( 59 CB | 59 CA | 59 C | 60 N ) 83.574 45.000 -38.574 0.380 0.200 4 ( 59 CB | 59 CA | 59 C | 59 O ) -97.310 -180.000 -82.690 0.327 0.375 1 ( 59 CB | 59 CA | 59 C | 59 O ) -97.310 -60.000 37.310 0.309 0.225 3 ( 59 CB | 59 CA | 59 C | 59 O ) -97.310 -135.000 -37.690 0.281 0.150 4 ( 60 C | 61 N | 61 CA | 61 C ) -65.887 -180.000 -114.113 0.528 0.375 1 ( 60 C | 61 N | 61 CA | 61 CB ) 170.200 90.000 -80.200 0.777 0.400 2 ( 60 C | 61 N | 61 CA | 61 CB ) 170.200 135.000 -35.200 0.355 0.200 4 ( 60 CB | 60 CA | 60 C | 61 N ) 83.426 180.000 96.574 0.557 0.500 1 ( 60 CB | 60 CA | 60 C | 61 N ) 83.426 45.000 -38.426 0.379 0.200 4 ( 60 CB | 60 CA | 60 C | 60 O ) -97.248 -180.000 -82.752 0.328 0.375 1 ( 60 CB | 60 CA | 60 C | 60 O ) -97.248 -60.000 37.248 0.308 0.225 3 ( 60 CB | 60 CA | 60 C | 60 O ) -97.248 -135.000 -37.752 0.281 0.150 4 ( 61 C | 62 N | 62 CA | 62 C ) -57.066 -180.000 -122.934 0.579 0.375 1 ( 61 C | 62 N | 62 CA | 62 C ) -57.066 -90.000 -32.934 0.177 0.300 2 ( 61 C | 62 N | 62 CA | 62 CB ) -179.480 -90.000 89.480 0.800 0.400 2 ( 61 C | 62 N | 62 CA | 62 CB ) -179.480 -135.000 44.480 0.400 0.200 4 ( 61 CB | 61 CA | 61 C | 62 N ) 82.261 180.000 97.739 0.567 0.500 1 ( 61 CB | 61 CA | 61 C | 62 N ) 82.261 45.000 -37.261 0.372 0.200 4 ( 61 CB | 61 CA | 61 C | 61 O ) -98.121 -180.000 -81.879 0.322 0.375 1 ( 61 CB | 61 CA | 61 C | 61 O ) -98.121 -60.000 38.121 0.318 0.225 3 ( 61 CB | 61 CA | 61 C | 61 O ) -98.121 -135.000 -36.879 0.277 0.150 4 ( 62 C | 63 N | 63 CA | 63 C ) -61.555 -180.000 -118.445 0.554 0.375 1 ( 62 C | 63 N | 63 CA | 63 CB ) 175.531 90.000 -85.531 0.795 0.400 2 ( 62 C | 63 N | 63 CA | 63 CB ) 175.531 135.000 -40.531 0.390 0.200 4 ( 62 CB | 62 CA | 62 C | 63 N ) 83.148 180.000 96.852 0.560 0.500 1 ( 62 CB | 62 CA | 62 C | 63 N ) 83.148 45.000 -38.148 0.378 0.200 4 ( 62 CB | 62 CA | 62 C | 62 O ) -96.818 -180.000 -83.182 0.330 0.375 1 ( 62 CB | 62 CA | 62 C | 62 O ) -96.818 -60.000 36.818 0.304 0.225 3 ( 62 CB | 62 CA | 62 C | 62 O ) -96.818 -135.000 -38.182 0.283 0.150 4 ( 63 C | 64 N | 64 CA | 64 C ) -62.056 -180.000 -117.944 0.551 0.375 1 ( 63 C | 64 N | 64 CA | 64 CB ) 175.862 90.000 -85.862 0.796 0.400 2 ( 63 C | 64 N | 64 CA | 64 CB ) 175.862 135.000 -40.862 0.392 0.200 4 ( 63 CB | 63 CA | 63 C | 64 N ) 78.878 180.000 101.122 0.596 0.500 1 ( 63 CB | 63 CA | 63 C | 64 N ) 78.878 45.000 -33.878 0.343 0.200 4 ( 63 CB | 63 CA | 63 C | 63 O ) -101.603 -180.000 -78.397 0.300 0.375 1 ( 63 CB | 63 CA | 63 C | 63 O ) -101.603 -60.000 41.603 0.353 0.225 3 ( 63 CB | 63 CA | 63 C | 63 O ) -101.603 -135.000 -33.397 0.253 0.150 4 ( 64 C | 65 N | 65 CA | 65 C ) -56.073 -180.000 -123.927 0.584 0.375 1 ( 64 C | 65 N | 65 CA | 65 C ) -56.073 -90.000 -33.927 0.187 0.300 2 ( 64 C | 65 N | 65 CA | 65 CB ) -178.387 -90.000 88.387 0.799 0.400 2 ( 64 C | 65 N | 65 CA | 65 CB ) -178.387 -135.000 43.387 0.399 0.200 4 ( 64 CB | 64 CA | 64 C | 65 N ) 72.433 180.000 107.567 0.651 0.500 1 ( 64 CB | 64 CA | 64 C | 65 N ) 72.433 108.000 35.567 0.200 0.100 5 ( 64 CB | 64 CA | 64 C | 64 O ) -107.620 -180.000 -72.380 0.261 0.375 1 ( 64 CB | 64 CA | 64 C | 64 O ) -107.620 -60.000 47.620 0.404 0.225 3 ( 66 CZ | 66 NE | 66 CD | 66 CG ) 135.054 180.000 44.946 0.584 2.000 1 ( 65 C | 66 N | 66 CA | 66 C ) -62.190 -180.000 -117.810 0.550 0.375 1 ( 65 C | 66 N | 66 CA | 66 CB ) 175.356 90.000 -85.356 0.795 0.400 2 ( 65 C | 66 N | 66 CA | 66 CB ) 175.356 135.000 -40.356 0.390 0.200 4 ( 65 CB | 65 CA | 65 C | 66 N ) 77.297 180.000 102.703 0.610 0.500 1 ( 65 CB | 65 CA | 65 C | 66 N ) 77.297 45.000 -32.297 0.326 0.200 4 ( 65 CB | 65 CA | 65 C | 66 N ) 77.297 108.000 30.703 0.190 0.100 5 ( 65 CB | 65 CA | 65 C | 65 O ) -103.464 -180.000 -76.536 0.288 0.375 1 ( 65 CB | 65 CA | 65 C | 65 O ) -103.464 -60.000 43.464 0.371 0.225 3 ( 65 CB | 65 CA | 65 C | 65 O ) -103.464 -135.000 -31.536 0.238 0.150 4 ( 66 C | 67 N | 67 CA | 67 C ) -67.763 -180.000 -112.237 0.517 0.375 1 ( 66 C | 67 N | 67 CA | 67 C ) -67.763 -36.000 31.763 0.145 0.075 5 ( 66 C | 67 N | 67 CA | 67 CB ) 169.616 90.000 -79.616 0.774 0.400 2 ( 66 C | 67 N | 67 CA | 67 CB ) 169.616 135.000 -34.616 0.350 0.200 4 ( 66 CB | 66 CA | 66 C | 67 N ) 85.435 180.000 94.565 0.540 0.500 1 ( 66 CB | 66 CA | 66 C | 67 N ) 85.435 45.000 -40.435 0.390 0.200 4 ( 66 CB | 66 CA | 66 C | 66 O ) -94.878 -180.000 -85.122 0.343 0.375 1 ( 66 CB | 66 CA | 66 C | 66 O ) -94.878 -60.000 34.878 0.282 0.225 3 ( 66 CB | 66 CA | 66 C | 66 O ) -94.878 -135.000 -40.122 0.291 0.150 4 ( 67 C | 68 N | 68 CA | 68 C ) -54.372 -180.000 -125.628 0.593 0.375 1 ( 67 C | 68 N | 68 CA | 68 C ) -54.372 -90.000 -35.628 0.204 0.300 2 ( 67 C | 68 N | 68 CA | 68 CB ) -176.574 -90.000 86.574 0.797 0.400 2 ( 67 C | 68 N | 68 CA | 68 CB ) -176.574 -135.000 41.574 0.394 0.200 4 ( 67 CB | 67 CA | 67 C | 68 N ) 77.047 180.000 102.953 0.612 0.500 1 ( 67 CB | 67 CA | 67 C | 68 N ) 77.047 45.000 -32.047 0.324 0.200 4 ( 67 CB | 67 CA | 67 C | 68 N ) 77.047 108.000 30.953 0.190 0.100 5 ( 67 CB | 67 CA | 67 C | 67 O ) -103.497 -180.000 -76.503 0.287 0.375 1 ( 67 CB | 67 CA | 67 C | 67 O ) -103.497 -60.000 43.497 0.371 0.225 3 ( 67 CB | 67 CA | 67 C | 67 O ) -103.497 -135.000 -31.503 0.238 0.150 4 ( 68 C | 69 N | 69 CA | 69 C ) -61.652 -180.000 -118.348 0.553 0.375 1 ( 68 C | 69 N | 69 CA | 69 CB ) 176.856 90.000 -86.856 0.798 0.400 2 ( 68 C | 69 N | 69 CA | 69 CB ) 176.856 135.000 -41.856 0.395 0.200 4 ( 68 CB | 68 CA | 68 C | 69 N ) 75.091 180.000 104.909 0.629 0.500 1 ( 68 CB | 68 CA | 68 C | 69 N ) 75.091 45.000 -30.091 0.301 0.200 4 ( 68 CB | 68 CA | 68 C | 69 N ) 75.091 108.000 32.909 0.196 0.100 5 ( 68 CB | 68 CA | 68 C | 68 O ) -105.477 -180.000 -74.523 0.275 0.375 1 ( 68 CB | 68 CA | 68 C | 68 O ) -105.477 -60.000 45.477 0.388 0.225 3 ( 70 CZ | 70 NE | 70 CD | 70 CG ) -143.090 -180.000 -36.910 0.401 2.000 1 ( 69 C | 70 N | 70 CA | 70 C ) -60.480 -180.000 -119.520 0.560 0.375 1 ( 69 C | 70 N | 70 CA | 70 CB ) 177.722 90.000 -87.722 0.799 0.400 2 ( 69 C | 70 N | 70 CA | 70 CB ) 177.722 135.000 -42.722 0.397 0.200 4 ( 69 CB | 69 CA | 69 C | 70 N ) 80.951 180.000 99.049 0.579 0.500 1 ( 69 CB | 69 CA | 69 C | 70 N ) 80.951 45.000 -35.951 0.361 0.200 4 ( 69 CB | 69 CA | 69 C | 69 O ) -99.582 -180.000 -80.418 0.313 0.375 1 ( 69 CB | 69 CA | 69 C | 69 O ) -99.582 -60.000 39.582 0.333 0.225 3 ( 69 CB | 69 CA | 69 C | 69 O ) -99.582 -135.000 -35.418 0.268 0.150 4 ( 70 C | 71 N | 71 CA | 71 C ) -64.982 -180.000 -115.018 0.534 0.375 1 ( 70 C | 71 N | 71 CA | 71 CB ) 173.200 90.000 -83.200 0.789 0.400 2 ( 70 C | 71 N | 71 CA | 71 CB ) 173.200 135.000 -38.200 0.378 0.200 4 ( 70 CB | 70 CA | 70 C | 71 N ) 76.180 180.000 103.820 0.619 0.500 1 ( 70 CB | 70 CA | 70 C | 71 N ) 76.180 45.000 -31.180 0.314 0.200 4 ( 70 CB | 70 CA | 70 C | 71 N ) 76.180 108.000 31.820 0.193 0.100 5 ( 70 CB | 70 CA | 70 C | 70 O ) -104.354 -180.000 -75.646 0.282 0.375 1 ( 70 CB | 70 CA | 70 C | 70 O ) -104.354 -60.000 44.354 0.379 0.225 3 ( 70 CB | 70 CA | 70 C | 70 O ) -104.354 -135.000 -30.646 0.231 0.150 4 ( 71 C | 72 N | 72 CA | 72 C ) -62.635 -180.000 -117.365 0.547 0.375 1 ( 71 CB | 71 CA | 71 C | 72 N ) 76.003 180.000 103.997 0.621 0.500 1 ( 71 CB | 71 CA | 71 C | 72 N ) 76.003 45.000 -31.003 0.312 0.200 4 ( 71 CB | 71 CA | 71 C | 72 N ) 76.003 108.000 31.997 0.194 0.100 5 ( 71 CB | 71 CA | 71 C | 71 O ) -104.778 -180.000 -75.222 0.279 0.375 1 ( 71 CB | 71 CA | 71 C | 71 O ) -104.778 -60.000 44.778 0.382 0.225 3 ( 71 CB | 71 CA | 71 C | 71 O ) -104.778 -135.000 -30.222 0.227 0.150 4 ( 72 C | 73 N | 73 CA | 73 C ) -85.753 -180.000 -94.247 0.403 0.375 1 ( 72 C | 73 N | 73 CA | 73 C ) -85.753 -45.000 40.753 0.293 0.150 4 ( 72 C | 73 N | 73 CA | 73 CB ) 150.816 90.000 -60.816 0.610 0.400 2 ( 73 C | 74 N | 74 CA | 74 C ) -58.914 -180.000 -121.086 0.569 0.375 1 ( 73 C | 74 N | 74 CA | 74 C ) -58.914 -90.000 -31.086 0.160 0.300 2 ( 73 C | 74 N | 74 CA | 74 CB ) 178.449 90.000 -88.449 0.799 0.400 2 ( 73 C | 74 N | 74 CA | 74 CB ) 178.449 135.000 -43.449 0.399 0.200 4 ( 73 CB | 73 CA | 73 C | 74 N ) 108.600 180.000 71.400 0.341 0.500 1 ( 73 CB | 73 CA | 73 C | 74 N ) 108.600 60.000 -48.600 0.548 0.300 3 ( 73 CB | 73 CA | 73 C | 73 O ) -71.660 -180.000 -108.340 0.493 0.375 1 ( 73 CB | 73 CA | 73 C | 73 O ) -71.660 -36.000 35.660 0.150 0.075 5 ( 74 C | 75 N | 75 CA | 75 C ) -61.946 -180.000 -118.054 0.551 0.375 1 ( 74 C | 75 N | 75 CA | 75 CB ) 174.679 90.000 -84.679 0.793 0.400 2 ( 74 C | 75 N | 75 CA | 75 CB ) 174.679 135.000 -39.679 0.386 0.200 4 ( 74 CB | 74 CA | 74 C | 75 N ) 90.661 180.000 89.339 0.494 0.500 1 ( 74 CB | 74 CA | 74 C | 75 N ) 90.661 60.000 -30.661 0.310 0.300 3 ( 74 CB | 74 CA | 74 C | 75 N ) 90.661 135.000 44.339 0.400 0.200 4 ( 74 CB | 74 CA | 74 C | 74 O ) -89.850 -180.000 -90.150 0.376 0.375 1 ( 74 CB | 74 CA | 74 C | 74 O ) -89.850 -45.000 44.850 0.300 0.150 4 ( 75 C | 76 N | 76 CA | 76 C ) -67.082 -180.000 -112.918 0.521 0.375 1 ( 75 C | 76 N | 76 CA | 76 C ) -67.082 -36.000 31.082 0.143 0.075 5 ( 75 C | 76 N | 76 CA | 76 CB ) 171.176 90.000 -81.176 0.781 0.400 2 ( 75 C | 76 N | 76 CA | 76 CB ) 171.176 135.000 -36.176 0.363 0.200 4 ( 75 CB | 75 CA | 75 C | 76 N ) 83.571 180.000 96.429 0.556 0.500 1 ( 75 CB | 75 CA | 75 C | 76 N ) 83.571 45.000 -38.571 0.380 0.200 4 ( 75 CB | 75 CA | 75 C | 75 O ) -97.659 -180.000 -82.341 0.325 0.375 1 ( 75 CB | 75 CA | 75 C | 75 O ) -97.659 -60.000 37.659 0.313 0.225 3 ( 75 CB | 75 CA | 75 C | 75 O ) -97.659 -135.000 -37.341 0.279 0.150 4 ( 76 C | 77 N | 77 CA | 77 C ) -57.065 -180.000 -122.935 0.579 0.375 1 ( 76 C | 77 N | 77 CA | 77 C ) -57.065 -90.000 -32.935 0.177 0.300 2 ( 76 C | 77 N | 77 CA | 77 CB ) 179.868 90.000 -89.868 0.800 0.400 2 ( 76 C | 77 N | 77 CA | 77 CB ) 179.868 135.000 -44.868 0.400 0.200 4 ( 76 CB | 76 CA | 76 C | 77 N ) 80.645 180.000 99.355 0.581 0.500 1 ( 76 CB | 76 CA | 76 C | 77 N ) 80.645 45.000 -35.645 0.359 0.200 4 ( 76 CB | 76 CA | 76 C | 76 O ) -100.126 -180.000 -79.874 0.309 0.375 1 ( 76 CB | 76 CA | 76 C | 76 O ) -100.126 -60.000 40.126 0.339 0.225 3 ( 76 CB | 76 CA | 76 C | 76 O ) -100.126 -135.000 -34.874 0.264 0.150 4 ( 77 C | 78 N | 78 CA | 78 C ) -70.158 -180.000 -109.842 0.502 0.375 1 ( 77 C | 78 N | 78 CA | 78 C ) -70.158 -36.000 34.158 0.149 0.075 5 ( 77 C | 78 N | 78 CA | 78 CB ) 167.139 90.000 -77.139 0.760 0.400 2 ( 77 C | 78 N | 78 CA | 78 CB ) 167.139 135.000 -32.139 0.325 0.200 4 ( 77 CB | 77 CA | 77 C | 78 N ) 89.909 180.000 90.091 0.501 0.500 1 ( 77 CB | 77 CA | 77 C | 78 N ) 89.909 45.000 -44.909 0.400 0.200 4 ( 77 CB | 77 CA | 77 C | 77 O ) -89.749 -180.000 -90.251 0.377 0.375 1 ( 77 CB | 77 CA | 77 C | 77 O ) -89.749 -45.000 44.749 0.300 0.150 4 ( 78 C | 79 N | 79 CA | 79 C ) -68.920 -180.000 -111.080 0.510 0.375 1 ( 78 C | 79 N | 79 CA | 79 C ) -68.920 -36.000 32.920 0.147 0.075 5 ( 78 C | 79 N | 79 CA | 79 CB ) 167.821 90.000 -77.821 0.764 0.400 2 ( 78 C | 79 N | 79 CA | 79 CB ) 167.821 135.000 -32.821 0.332 0.200 4 ( 78 CB | 78 CA | 78 C | 79 N ) 85.481 180.000 94.519 0.539 0.500 1 ( 78 CB | 78 CA | 78 C | 79 N ) 85.481 45.000 -40.481 0.390 0.200 4 ( 78 CB | 78 CA | 78 C | 78 O ) -95.111 -180.000 -84.889 0.342 0.375 1 ( 78 CB | 78 CA | 78 C | 78 O ) -95.111 -60.000 35.111 0.284 0.225 3 ( 78 CB | 78 CA | 78 C | 78 O ) -95.111 -135.000 -39.889 0.291 0.150 4 ( 79 C | 80 N | 80 CA | 80 C ) -104.957 -180.000 -75.043 0.278 0.375 1 ( 79 C | 80 N | 80 CA | 80 C ) -104.957 -60.000 44.957 0.384 0.225 3 ( 79 C | 80 N | 80 CA | 80 C ) -104.957 -135.000 -30.043 0.225 0.150 4 ( 79 C | 80 N | 80 CA | 80 CB ) 131.027 180.000 48.973 0.172 0.500 1 ( 79 C | 80 N | 80 CA | 80 CB ) 131.027 90.000 -41.027 0.345 0.400 2 ( 79 C | 80 N | 80 CA | 80 CB ) 131.027 180.000 48.973 0.551 0.300 3 ( 79 CB | 79 CA | 79 C | 80 N ) 86.678 180.000 93.322 0.529 0.500 1 ( 79 CB | 79 CA | 79 C | 80 N ) 86.678 45.000 -41.678 0.395 0.200 4 ( 79 CB | 79 CA | 79 C | 79 O ) -92.979 -180.000 -87.021 0.356 0.375 1 ( 79 CB | 79 CA | 79 C | 79 O ) -92.979 -60.000 32.979 0.260 0.225 3 ( 79 CB | 79 CA | 79 C | 79 O ) -92.979 -135.000 -42.021 0.297 0.150 4 ( 80 C | 81 N | 81 CA | 81 C ) -62.587 -180.000 -117.413 0.548 0.375 1 ( 80 C | 81 N | 81 CA | 81 CB ) 174.857 90.000 -84.857 0.794 0.400 2 ( 80 C | 81 N | 81 CA | 81 CB ) 174.857 135.000 -39.857 0.387 0.200 4 ( 80 CB | 80 CA | 80 C | 81 N ) 153.109 90.000 -63.109 0.636 0.400 2 ( 80 CB | 80 CA | 80 C | 80 O ) -28.214 -180.000 -151.786 0.705 0.375 1 ( 80 CB | 80 CA | 80 C | 80 O ) -28.214 -90.000 -61.786 0.466 0.300 2 ( 80 CB | 80 CA | 80 C | 80 O ) -28.214 -60.000 -31.786 0.246 0.225 3 ( 81 C | 82 N | 82 CA | 82 C ) 67.611 180.000 112.389 0.518 0.375 1 ( 81 C | 82 N | 82 CA | 82 C ) 67.611 36.000 -31.611 0.145 0.075 5 ( 81 C | 82 N | 82 CA | 82 CB ) -56.434 -180.000 -123.566 0.776 0.500 1 ( 81 C | 82 N | 82 CA | 82 CB ) -56.434 -90.000 -33.566 0.245 0.400 2 ( 81 CB | 81 CA | 81 C | 82 N ) -107.753 -180.000 -72.247 0.348 0.500 1 ( 81 CB | 81 CA | 81 C | 82 N ) -107.753 -60.000 47.753 0.540 0.300 3 ( 81 CB | 81 CA | 81 C | 81 O ) 72.688 180.000 107.312 0.487 0.375 1 ( 81 CB | 81 CA | 81 C | 81 O ) 72.688 108.000 35.312 0.150 0.075 5 ( 82 C | 83 N | 83 CA | 83 C ) -61.570 -180.000 -118.430 0.554 0.375 1 ( 82 C | 83 N | 83 CA | 83 CB ) 177.421 90.000 -87.421 0.798 0.400 2 ( 82 C | 83 N | 83 CA | 83 CB ) 177.421 135.000 -42.421 0.397 0.200 4 ( 82 CB | 82 CA | 82 C | 83 N ) -171.068 -90.000 81.068 0.781 0.400 2 ( 82 CB | 82 CA | 82 C | 83 N ) -171.068 -135.000 36.068 0.362 0.200 4 ( 82 CB | 82 CA | 82 C | 82 O ) 9.783 180.000 170.217 0.745 0.375 1 ( 82 CB | 82 CA | 82 C | 82 O ) 9.783 90.000 80.217 0.583 0.300 2 ( 82 CB | 82 CA | 82 C | 82 O ) 9.783 60.000 50.217 0.421 0.225 3 ( 82 CB | 82 CA | 82 C | 82 O ) 9.783 45.000 35.217 0.266 0.150 4 ( 84 CZ | 84 NE | 84 CD | 84 CG ) 101.227 180.000 78.773 1.611 2.000 1 ( 83 C | 84 N | 84 CA | 84 C ) -66.048 -180.000 -113.952 0.527 0.375 1 ( 83 C | 84 N | 84 CA | 84 C ) -66.048 -36.000 30.048 0.140 0.075 5 ( 83 C | 84 N | 84 CA | 84 CB ) 169.527 90.000 -79.527 0.774 0.400 2 ( 83 C | 84 N | 84 CA | 84 CB ) 169.527 135.000 -34.527 0.349 0.200 4 ( 83 CB | 83 CA | 83 C | 84 N ) -72.004 -180.000 -107.996 0.654 0.500 1 ( 83 CB | 83 CA | 83 C | 84 N ) -72.004 -108.000 -35.996 0.200 0.100 5 ( 83 CB | 83 CA | 83 C | 83 O ) 108.049 180.000 71.951 0.259 0.375 1 ( 83 CB | 83 CA | 83 C | 83 O ) 108.049 60.000 -48.049 0.407 0.225 3 ( 84 C | 85 N | 85 CA | 85 C ) -78.490 -180.000 -101.510 0.450 0.375 1 ( 84 C | 85 N | 85 CA | 85 C ) -78.490 -45.000 33.490 0.254 0.150 4 ( 84 C | 85 N | 85 CA | 85 CB ) 157.645 90.000 -67.645 0.684 0.400 2 ( 84 CB | 84 CA | 84 C | 85 N ) -128.703 -180.000 -51.297 0.187 0.500 1 ( 84 CB | 84 CA | 84 C | 85 N ) -128.703 -90.000 38.703 0.313 0.400 2 ( 84 CB | 84 CA | 84 C | 85 N ) -128.703 -180.000 -51.297 0.569 0.300 3 ( 84 CB | 84 CA | 84 C | 84 O ) 52.257 180.000 127.743 0.605 0.375 1 ( 84 CB | 84 CA | 84 C | 84 O ) 52.257 90.000 37.743 0.225 0.300 2 ( 85 C | 86 N | 86 CA | 86 C ) -94.383 -180.000 -85.617 0.346 0.375 1 ( 85 C | 86 N | 86 CA | 86 C ) -94.383 -60.000 34.383 0.276 0.225 3 ( 85 C | 86 N | 86 CA | 86 C ) -94.383 -135.000 -40.617 0.293 0.150 4 ( 85 C | 86 N | 86 CA | 86 CB ) 143.304 180.000 36.696 0.099 0.500 1 ( 85 C | 86 N | 86 CA | 86 CB ) 143.304 90.000 -53.304 0.514 0.400 2 ( 85 C | 86 N | 86 CA | 86 CB ) 143.304 180.000 36.696 0.403 0.300 3 ( 85 C | 86 N | 86 CA | 86 CB ) 143.304 108.000 -35.304 0.200 0.100 5 ( 85 CB | 85 CA | 85 C | 86 N ) -96.333 -180.000 -83.667 0.445 0.500 1 ( 85 CB | 85 CA | 85 C | 86 N ) -96.333 -60.000 36.333 0.398 0.300 3 ( 85 CB | 85 CA | 85 C | 86 N ) -96.333 -135.000 -38.667 0.381 0.200 4 ( 85 CB | 85 CA | 85 C | 85 O ) 84.963 180.000 95.037 0.408 0.375 1 ( 85 CB | 85 CA | 85 C | 85 O ) 84.963 45.000 -39.963 0.291 0.150 4 ( 86 C | 87 N | 87 CA | 87 C ) -83.587 -180.000 -96.413 0.417 0.375 1 ( 86 C | 87 N | 87 CA | 87 C ) -83.587 -45.000 38.587 0.285 0.150 4 ( 86 C | 87 N | 87 CA | 87 CB ) 154.508 90.000 -64.508 0.652 0.400 2 ( 86 CB | 86 CA | 86 C | 87 N ) -132.781 -180.000 -47.219 0.160 0.500 1 ( 86 CB | 86 CA | 86 C | 87 N ) -132.781 -90.000 42.781 0.369 0.400 2 ( 86 CB | 86 CA | 86 C | 87 N ) -132.781 -180.000 -47.219 0.535 0.300 3 ( 86 CB | 86 CA | 86 C | 86 O ) 47.115 180.000 132.885 0.630 0.375 1 ( 86 CB | 86 CA | 86 C | 86 O ) 47.115 90.000 42.885 0.278 0.300 2 ( 87 C | 88 N | 88 CA | 88 C ) -86.417 -180.000 -93.583 0.398 0.375 1 ( 87 C | 88 N | 88 CA | 88 C ) -86.417 -45.000 41.417 0.295 0.150 4 ( 87 C | 88 N | 88 CA | 88 CB ) 152.163 90.000 -62.163 0.626 0.400 2 ( 87 CB | 87 CA | 87 C | 88 N ) -104.697 -180.000 -75.303 0.373 0.500 1 ( 87 CB | 87 CA | 87 C | 88 N ) -104.697 -60.000 44.697 0.509 0.300 3 ( 87 CB | 87 CA | 87 C | 88 N ) -104.697 -135.000 -30.303 0.304 0.200 4 ( 87 CB | 87 CA | 87 C | 87 O ) 75.749 180.000 104.251 0.467 0.375 1 ( 87 CB | 87 CA | 87 C | 87 O ) 75.749 45.000 -30.749 0.232 0.150 4 ( 87 CB | 87 CA | 87 C | 87 O ) 75.749 108.000 32.251 0.146 0.075 5 ( 88 C | 89 N | 89 CA | 89 C ) -64.910 -180.000 -115.090 0.534 0.375 1 ( 88 C | 89 N | 89 CA | 89 CB ) 171.945 90.000 -81.945 0.784 0.400 2 ( 88 C | 89 N | 89 CA | 89 CB ) 171.945 135.000 -36.945 0.369 0.200 4 ( 88 CB | 88 CA | 88 C | 89 N ) -108.705 -180.000 -71.295 0.340 0.500 1 ( 88 CB | 88 CA | 88 C | 89 N ) -108.705 -60.000 48.705 0.549 0.300 3 ( 88 CB | 88 CA | 88 C | 88 O ) 71.152 180.000 108.848 0.496 0.375 1 ( 88 CB | 88 CA | 88 C | 88 O ) 71.152 36.000 -35.152 0.150 0.075 5 ( 89 C | 90 N | 90 CA | 90 C ) -103.512 -180.000 -76.488 0.287 0.375 1 ( 89 C | 90 N | 90 CA | 90 C ) -103.512 -60.000 43.512 0.371 0.225 3 ( 89 C | 90 N | 90 CA | 90 C ) -103.512 -135.000 -31.488 0.238 0.150 4 ( 89 C | 90 N | 90 CA | 90 CB ) 134.501 180.000 45.499 0.150 0.500 1 ( 89 C | 90 N | 90 CA | 90 CB ) 134.501 90.000 -44.501 0.393 0.400 2 ( 89 C | 90 N | 90 CA | 90 CB ) 134.501 180.000 45.499 0.518 0.300 3 ( 89 CB | 89 CA | 89 C | 90 N ) -135.576 -180.000 -44.424 0.143 0.500 1 ( 89 CB | 89 CA | 89 C | 90 N ) -135.576 -90.000 45.576 0.408 0.400 2 ( 89 CB | 89 CA | 89 C | 90 N ) -135.576 -180.000 -44.424 0.506 0.300 3 ( 89 CB | 89 CA | 89 C | 89 O ) 44.817 180.000 135.183 0.641 0.375 1 ( 89 CB | 89 CA | 89 C | 89 O ) 44.817 90.000 45.183 0.302 0.300 2 ( 90 C | 91 N | 91 CA | 91 C ) -72.865 -180.000 -107.135 0.485 0.375 1 ( 90 C | 91 N | 91 CA | 91 C ) -72.865 -108.000 -35.135 0.150 0.075 5 ( 90 C | 91 N | 91 CA | 91 CB ) 163.159 90.000 -73.159 0.733 0.400 2 ( 90 CB | 90 CA | 90 C | 91 N ) -78.816 -180.000 -101.184 0.597 0.500 1 ( 90 CB | 90 CA | 90 C | 91 N ) -78.816 -45.000 33.816 0.342 0.200 4 ( 90 CB | 90 CA | 90 C | 90 O ) 101.962 180.000 78.038 0.297 0.375 1 ( 90 CB | 90 CA | 90 C | 90 O ) 101.962 60.000 -41.962 0.357 0.225 3 ( 90 CB | 90 CA | 90 C | 90 O ) 101.962 135.000 33.038 0.251 0.150 4 The following couplings have delta J greater than the cutoff: (calculated J) (observed J) (delta J) RMS diff. = 0.000, #(violat.> 1.00)= 0. of 0 J-couplings overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,coup,sani,vean energies: -1692.71, 79.9152, 96.3629, 40.9709, 426.635, -270.818, -2066.26, 0.451483, 3.32525E-02, $coup, $sani, $vean