NBONDS: found 151545 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 ========== restraint 99 ========== set-i-atoms A 41 LYS HG1 set-j-atoms A 42 THR HN R= 4.809 NOE= 4.15 (- 2.35/+ 0.42) Delta= -0.239 E(NOE)= 2.868 ========== restraint 1058 ========== set-i-atoms A 50 MET HB2 set-j-atoms A 50 MET HE1 A 50 MET HE2 A 50 MET HE3 R= 3.867 NOE= 3.24 (- 1.44/+ 0.32) Delta= -0.307 E(NOE)= 4.703 ========== restraint 2165 ========== set-i-atoms A 77 LYS HG2 set-j-atoms A 78 ALA HA R= 5.019 NOE= 4.36 (- 2.56/+ 0.44) Delta= -0.219 E(NOE)= 2.392 NOEPRI: RMS diff. = 0.013, #(violat.> 0.2)= 3 of 2918 NOEs NOEPRI: RMS diff. class DIST = 0.012, #(viol.> 0.2)= 3 of 2888 NOEs NOEPRI: RMS diff. class HBON = 0.032, #(viol.> 0.2)= 0 of 30 NOEs ======================================== A 50 MET N A 50 MET CA A 50 MET C A 51 ILE N Dihedral= 95.170 Energy= 0.013 C= 1.000 Equil= 128.600 Delta= 6.630 Range= 26.800 Exponent= 2 (atom-i |atom-j ) dist. equil. delta energy const. (A 51 CA |A 51 CB ) 1.591 1.540 0.051 2.586 1000.000 (A 73 CA |A 73 C ) 1.582 1.525 0.057 3.210 1000.000 (A 73 C |A 74 N ) 1.397 1.341 0.056 3.161 1000.000 (atom-i |atom-j |atom-k ) angle equil. delta energy const. (A 73 CA |A 73 C |A 74 N ) 122.695 116.994 5.701 4.951 500.000 (atom-i |atom-j |atom-k |atom-L ) angle equil. delta energy const. period (A 4 CA |A 4 C |A 5 N |A 5 CA ) -173.141 -180.007 -6.866 1.436 100.000 0 (A 8 CA |A 8 C |A 9 N |A 9 CA ) -171.327 -180.007 -8.680 2.295 100.000 0 (A 9 CA |A 9 C |A 10 N |A 10 CA ) 167.682 -180.007 12.311 4.617 100.000 0 (A 10 CA |A 10 C |A 11 N |A 11 CA ) 168.790 -180.007 11.203 3.823 100.000 0 (A 12 CA |A 12 C |A 13 N |A 13 CA ) 168.791 -180.007 11.203 3.823 100.000 0 (A 20 CA |A 20 C |A 21 N |A 21 CA ) -174.420 -179.992 -5.572 0.946 100.000 0 (A 26 CA |A 26 C |A 27 N |A 27 CA ) 173.753 -180.007 6.240 1.186 100.000 0 (A 33 CA |A 33 C |A 34 N |A 34 CA ) -173.434 -180.007 -6.573 1.316 100.000 0 (A 37 CA |A 37 C |A 38 N |A 38 CA ) -173.120 -180.002 -6.882 1.443 100.000 0 (A 42 CA |A 42 C |A 43 N |A 43 CA ) 169.281 -180.007 10.712 3.495 100.000 0 (A 46 CA |A 46 C |A 47 N |A 47 CA ) -174.691 -180.002 -5.311 0.859 100.000 0 (A 66 CA |A 66 C |A 67 N |A 67 CA ) 169.905 -180.007 10.088 3.100 100.000 0 (A 67 CA |A 67 C |A 68 N |A 68 CA ) -174.437 -180.007 -5.570 0.945 100.000 0 (A 69 CA |A 69 C |A 70 N |A 70 CA ) 170.435 -180.007 9.559 2.783 100.000 0 (A 72 CA |A 72 C |A 73 N |A 73 CA ) 168.801 179.987 11.186 3.812 100.000 0 (A 73 CA |A 73 C |A 74 N |A 74 CA ) 172.101 179.987 7.886 1.894 100.000 0 (A 82 CA |A 82 C |A 83 N |A 83 CA ) -170.732 -180.007 -9.275 2.620 100.000 0 (A 89 CA |A 89 C |A 90 N |A 90 CA ) -174.416 -180.002 -5.586 0.950 100.000 0 (A 91 CA |A 91 C |A 92 N |A 92 CA ) 174.058 179.987 5.929 1.071 100.000 0 (A 96 CA |A 96 C |A 97 N |A 97 CA ) 167.407 -180.007 12.586 4.825 100.000 0 (A 97 CA |A 97 C |A 98 N |A 98 CA ) 173.559 -180.007 6.434 1.261 100.000 0 (A 98 CA |A 98 C |A 99 N |A 99 CA ) -172.194 -180.007 -7.812 1.859 100.000 0 (atom-i |atom-j |atom-k |atom-L ) angle equil. delta energy const. period (A 1 C |A 2 N |A 2 CA |A 2 C ) 84.047 180.000 95.953 0.414 0.375 1 (A 1 C |A 2 N |A 2 CA |A 2 C ) 84.047 45.000 -39.047 0.287 0.150 4 (A 1 CB |A 1 CA |A 1 C |A 2 N ) 150.942 90.000 -60.942 0.611 0.400 2 (A 1 CB |A 1 CA |A 1 C |A 1 O ) -30.769 -180.000 -149.231 0.697 0.375 1 (A 1 CB |A 1 CA |A 1 C |A 1 O ) -30.769 -90.000 -59.231 0.443 0.300 2 (A 3 ND1 |A 3 CG |A 3 CB |A 3 CA ) -75.208 -180.000 -104.792 0.753 0.600 1 (A 2 C |A 3 N |A 3 CA |A 3 C ) -94.518 -180.000 -85.482 0.345 0.375 1 (A 2 C |A 3 N |A 3 CA |A 3 C ) -94.518 -60.000 34.518 0.278 0.225 3 (A 2 C |A 3 N |A 3 CA |A 3 C ) -94.518 -135.000 -40.482 0.293 0.150 4 (A 2 C |A 3 N |A 3 CA |A 3 CB ) 143.627 180.000 36.373 0.097 0.500 1 (A 2 C |A 3 N |A 3 CA |A 3 CB ) 143.627 90.000 -53.627 0.519 0.400 2 (A 2 C |A 3 N |A 3 CA |A 3 CB ) 143.627 180.000 36.373 0.398 0.300 3 (A 2 C |A 3 N |A 3 CA |A 3 CB ) 143.627 108.000 -35.627 0.200 0.100 5 (A 4 ND1 |A 4 CG |A 4 CB |A 4 CA ) 109.360 180.000 70.640 0.401 0.600 1 (A 3 C |A 4 N |A 4 CA |A 4 C ) -59.989 -180.000 -120.011 0.563 0.375 1 (A 3 C |A 4 N |A 4 CA |A 4 C ) -59.989 -90.000 -30.011 0.150 0.300 2 (A 3 C |A 4 N |A 4 CA |A 4 CB ) 176.512 90.000 -86.512 0.797 0.400 2 (A 3 C |A 4 N |A 4 CA |A 4 CB ) 176.512 135.000 -41.512 0.394 0.200 4 (A 3 CB |A 3 CA |A 3 C |A 4 N ) -98.689 -180.000 -81.311 0.424 0.500 1 (A 3 CB |A 3 CA |A 3 C |A 4 N ) -98.689 -60.000 38.689 0.432 0.300 3 (A 3 CB |A 3 CA |A 3 C |A 4 N ) -98.689 -135.000 -36.311 0.364 0.200 4 (A 3 CB |A 3 CA |A 3 C |A 3 O ) 80.797 180.000 99.203 0.435 0.375 1 (A 3 CB |A 3 CA |A 3 C |A 3 O ) 80.797 45.000 -35.797 0.270 0.150 4 (A 5 ND1 |A 5 CG |A 5 CB |A 5 CA ) 80.133 180.000 99.867 0.703 0.600 1 (A 4 C |A 5 N |A 5 CA |A 5 C ) -53.899 -180.000 -126.101 0.596 0.375 1 (A 4 C |A 5 N |A 5 CA |A 5 C ) -53.899 -90.000 -36.101 0.208 0.300 2 (A 4 C |A 5 N |A 5 CA |A 5 CB ) -178.316 -90.000 88.316 0.799 0.400 2 (A 4 C |A 5 N |A 5 CA |A 5 CB ) -178.316 -135.000 43.316 0.399 0.200 4 (A 4 CB |A 4 CA |A 4 C |A 5 N ) -118.858 -180.000 -61.142 0.259 0.500 1 (A 4 CB |A 4 CA |A 4 C |A 5 N ) -118.858 -60.000 58.858 0.599 0.300 3 (A 4 CB |A 4 CA |A 4 C |A 4 O ) 61.063 180.000 118.937 0.556 0.375 1 (A 6 ND1 |A 6 CG |A 6 CB |A 6 CA ) -98.750 -180.000 -81.250 0.509 0.600 1 (A 5 C |A 6 N |A 6 CA |A 6 C ) -82.508 -180.000 -97.492 0.424 0.375 1 (A 5 C |A 6 N |A 6 CA |A 6 C ) -82.508 -45.000 37.508 0.280 0.150 4 (A 5 C |A 6 N |A 6 CA |A 6 CB ) 151.922 90.000 -61.922 0.623 0.400 2 (A 5 CB |A 5 CA |A 5 C |A 6 N ) 56.165 180.000 123.835 0.778 0.500 1 (A 5 CB |A 5 CA |A 5 C |A 6 N ) 56.165 90.000 33.835 0.248 0.400 2 (A 5 CB |A 5 CA |A 5 C |A 5 O ) -123.284 -180.000 -56.716 0.169 0.375 1 (A 5 CB |A 5 CA |A 5 C |A 5 O ) -123.284 -90.000 33.284 0.181 0.300 2 (A 5 CB |A 5 CA |A 5 C |A 5 O ) -123.284 -180.000 -56.716 0.447 0.225 3 (A 7 ND1 |A 7 CG |A 7 CB |A 7 CA ) -90.327 -180.000 -89.673 0.597 0.600 1 (A 6 C |A 7 N |A 7 CA |A 7 C ) -149.087 -180.000 -30.913 0.053 0.375 1 (A 6 C |A 7 N |A 7 CA |A 7 C ) -149.087 -90.000 59.087 0.442 0.300 2 (A 6 C |A 7 N |A 7 CA |A 7 C ) -149.087 -180.000 -30.913 0.236 0.225 3 (A 6 C |A 7 N |A 7 CA |A 7 C ) -149.087 -180.000 -30.913 0.143 0.075 5 (A 6 C |A 7 N |A 7 CA |A 7 CB ) 86.364 180.000 93.636 0.532 0.500 1 (A 6 C |A 7 N |A 7 CA |A 7 CB ) 86.364 45.000 -41.364 0.394 0.200 4 (A 6 CB |A 6 CA |A 6 C |A 7 N ) -110.758 -180.000 -69.242 0.323 0.500 1 (A 6 CB |A 6 CA |A 6 C |A 7 N ) -110.758 -60.000 50.758 0.566 0.300 3 (A 6 CB |A 6 CA |A 6 C |A 6 O ) 71.241 180.000 108.759 0.496 0.375 1 (A 6 CB |A 6 CA |A 6 C |A 6 O ) 71.241 36.000 -35.241 0.150 0.075 5 (A 8 ND1 |A 8 CG |A 8 CB |A 8 CA ) 104.976 180.000 75.024 0.445 0.600 1 (A 7 C |A 8 N |A 8 CA |A 8 C ) -95.797 -180.000 -84.203 0.337 0.375 1 (A 7 C |A 8 N |A 8 CA |A 8 C ) -95.797 -60.000 35.797 0.292 0.225 3 (A 7 C |A 8 N |A 8 CA |A 8 C ) -95.797 -135.000 -39.203 0.288 0.150 4 (A 7 C |A 8 N |A 8 CA |A 8 CB ) 142.634 180.000 37.366 0.103 0.500 1 (A 7 C |A 8 N |A 8 CA |A 8 CB ) 142.634 90.000 -52.634 0.505 0.400 2 (A 7 C |A 8 N |A 8 CA |A 8 CB ) 142.634 180.000 37.366 0.413 0.300 3 (A 7 C |A 8 N |A 8 CA |A 8 CB ) 142.634 108.000 -34.634 0.199 0.100 5 (A 7 CB |A 7 CA |A 7 C |A 8 N ) -105.877 -180.000 -74.123 0.363 0.500 1 (A 7 CB |A 7 CA |A 7 C |A 8 N ) -105.877 -60.000 45.877 0.522 0.300 3 (A 7 CB |A 7 CA |A 7 C |A 7 O ) 75.042 180.000 104.958 0.472 0.375 1 (A 7 CB |A 7 CA |A 7 C |A 7 O ) 75.042 45.000 -30.042 0.225 0.150 4 (A 7 CB |A 7 CA |A 7 C |A 7 O ) 75.042 108.000 32.958 0.147 0.075 5 (A 8 C |A 9 N |A 9 CA |A 9 C ) -70.559 -180.000 -109.441 0.500 0.375 1 (A 8 C |A 9 N |A 9 CA |A 9 C ) -70.559 -36.000 34.559 0.149 0.075 5 (A 8 C |A 9 N |A 9 CA |A 9 CB ) 164.502 90.000 -74.502 0.743 0.400 2 (A 8 CB |A 8 CA |A 8 C |A 9 N ) 149.906 180.000 30.094 0.067 0.500 1 (A 8 CB |A 8 CA |A 8 C |A 9 N ) 149.906 90.000 -59.906 0.599 0.400 2 (A 8 CB |A 8 CA |A 8 C |A 9 N ) 149.906 180.000 30.094 0.301 0.300 3 (A 8 CB |A 8 CA |A 8 C |A 9 N ) 149.906 180.000 30.094 0.187 0.100 5 (A 8 CB |A 8 CA |A 8 C |A 8 O ) -32.467 -180.000 -147.533 0.691 0.375 1 (A 8 CB |A 8 CA |A 8 C |A 8 O ) -32.467 -90.000 -57.533 0.427 0.300 2 (A 10 ND1 |A 10 CG |A 10 CB |A 10 CA ) -87.151 -180.000 -92.849 0.630 0.600 1 (A 9 C |A 10 N |A 10 CA |A 10 C ) -108.186 -180.000 -71.814 0.258 0.375 1 (A 9 C |A 10 N |A 10 CA |A 10 C ) -108.186 -60.000 48.186 0.408 0.225 3 (A 9 C |A 10 N |A 10 CA |A 10 CB ) 128.184 180.000 51.816 0.191 0.500 1 (A 9 C |A 10 N |A 10 CA |A 10 CB ) 128.184 90.000 -38.184 0.306 0.400 2 (A 9 C |A 10 N |A 10 CA |A 10 CB ) 128.184 180.000 51.816 0.573 0.300 3 (A 9 CB |A 9 CA |A 9 C |A 10 N ) -152.339 -90.000 62.339 0.628 0.400 2 (A 9 CB |A 9 CA |A 9 C |A 9 O ) 30.169 180.000 149.831 0.699 0.375 1 (A 9 CB |A 9 CA |A 9 C |A 9 O ) 30.169 90.000 59.831 0.448 0.300 2 (A 10 C |A 11 N |A 11 CA |A 11 C ) -65.944 -180.000 -114.056 0.528 0.375 1 (A 10 C |A 11 N |A 11 CA |A 11 CB ) 172.099 90.000 -82.099 0.785 0.400 2 (A 10 C |A 11 N |A 11 CA |A 11 CB ) 172.099 135.000 -37.099 0.370 0.200 4 (A 10 CB |A 10 CA |A 10 C |A 11 N ) 54.290 180.000 125.710 0.792 0.500 1 (A 10 CB |A 10 CA |A 10 C |A 11 N ) 54.290 90.000 35.710 0.273 0.400 2 (A 10 CB |A 10 CA |A 10 C |A 10 O ) -129.669 -180.000 -50.331 0.136 0.375 1 (A 10 CB |A 10 CA |A 10 C |A 10 O ) -129.669 -90.000 39.669 0.244 0.300 2 (A 10 CB |A 10 CA |A 10 C |A 10 O ) -129.669 -180.000 -50.331 0.422 0.225 3 (A 11 C |A 12 N |A 12 CA |A 12 C ) -81.320 -180.000 -98.680 0.432 0.375 1 (A 11 C |A 12 N |A 12 CA |A 12 C ) -81.320 -45.000 36.320 0.273 0.150 4 (A 11 C |A 12 N |A 12 CA |A 12 CB ) 153.534 90.000 -63.534 0.641 0.400 2 (A 11 CB |A 11 CA |A 11 C |A 12 N ) 93.644 180.000 86.356 0.468 0.500 1 (A 11 CB |A 11 CA |A 11 C |A 12 N ) 93.644 60.000 -33.644 0.357 0.300 3 (A 11 CB |A 11 CA |A 11 C |A 12 N ) 93.644 135.000 41.356 0.394 0.200 4 (A 11 CB |A 11 CA |A 11 C |A 11 O ) -86.146 -180.000 -93.854 0.400 0.375 1 (A 11 CB |A 11 CA |A 11 C |A 11 O ) -86.146 -45.000 41.146 0.295 0.150 4 (A 12 C |A 13 N |A 13 CA |A 13 C ) -80.221 -180.000 -99.779 0.439 0.375 1 (A 12 C |A 13 N |A 13 CA |A 13 C ) -80.221 -45.000 35.221 0.266 0.150 4 (A 12 C |A 13 N |A 13 CA |A 13 CB ) 156.221 90.000 -66.221 0.670 0.400 2 (A 12 CB |A 12 CA |A 12 C |A 13 N ) 125.621 180.000 54.379 0.209 0.500 1 (A 12 CB |A 12 CA |A 12 C |A 13 N ) 125.621 90.000 -35.621 0.271 0.400 2 (A 12 CB |A 12 CA |A 12 C |A 13 N ) 125.621 180.000 54.379 0.587 0.300 3 (A 12 CB |A 12 CA |A 12 C |A 12 O ) -56.134 -180.000 -123.866 0.584 0.375 1 (A 12 CB |A 12 CA |A 12 C |A 12 O ) -56.134 -90.000 -33.866 0.186 0.300 2 (A 13 C |A 14 N |A 14 CA |A 14 C ) -92.005 -180.000 -87.995 0.362 0.375 1 (A 13 C |A 14 N |A 14 CA |A 14 C ) -92.005 -60.000 32.005 0.249 0.225 3 (A 13 C |A 14 N |A 14 CA |A 14 C ) -92.005 -135.000 -42.995 0.299 0.150 4 (A 13 C |A 14 N |A 14 CA |A 14 CB ) 144.119 180.000 35.881 0.095 0.500 1 (A 13 C |A 14 N |A 14 CA |A 14 CB ) 144.119 90.000 -54.119 0.525 0.400 2 (A 13 C |A 14 N |A 14 CA |A 14 CB ) 144.119 180.000 35.881 0.391 0.300 3 (A 13 C |A 14 N |A 14 CA |A 14 CB ) 144.119 180.000 35.881 0.200 0.100 5 (A 13 CB |A 13 CA |A 13 C |A 14 N ) -102.049 -180.000 -77.951 0.396 0.500 1 (A 13 CB |A 13 CA |A 13 C |A 14 N ) -102.049 -60.000 42.049 0.477 0.300 3 (A 13 CB |A 13 CA |A 13 C |A 14 N ) -102.049 -135.000 -32.951 0.333 0.200 4 (A 13 CB |A 13 CA |A 13 C |A 13 O ) 78.971 180.000 101.029 0.447 0.375 1 (A 13 CB |A 13 CA |A 13 C |A 13 O ) 78.971 45.000 -33.971 0.258 0.150 4 (A 14 C |A 15 N |A 15 CA |A 15 C ) -93.897 -180.000 -86.103 0.350 0.375 1 (A 14 C |A 15 N |A 15 CA |A 15 C ) -93.897 -60.000 33.897 0.271 0.225 3 (A 14 C |A 15 N |A 15 CA |A 15 C ) -93.897 -135.000 -41.103 0.294 0.150 4 (A 14 C |A 15 N |A 15 CA |A 15 CB ) 144.089 180.000 35.911 0.095 0.500 1 (A 14 C |A 15 N |A 15 CA |A 15 CB ) 144.089 90.000 -54.089 0.525 0.400 2 (A 14 C |A 15 N |A 15 CA |A 15 CB ) 144.089 180.000 35.911 0.391 0.300 3 (A 14 C |A 15 N |A 15 CA |A 15 CB ) 144.089 180.000 35.911 0.200 0.100 5 (A 14 CB |A 14 CA |A 14 C |A 15 N ) 96.787 180.000 83.213 0.441 0.500 1 (A 14 CB |A 14 CA |A 14 C |A 15 N ) 96.787 60.000 -36.787 0.404 0.300 3 (A 14 CB |A 14 CA |A 14 C |A 15 N ) 96.787 135.000 38.213 0.378 0.200 4 (A 14 CB |A 14 CA |A 14 C |A 14 O ) -81.842 -180.000 -98.158 0.428 0.375 1 (A 14 CB |A 14 CA |A 14 C |A 14 O ) -81.842 -45.000 36.842 0.276 0.150 4 (A 15 C |A 16 N |A 16 CA |A 16 C ) -113.227 -180.000 -66.773 0.227 0.375 1 (A 15 C |A 16 N |A 16 CA |A 16 C ) -113.227 -60.000 53.227 0.436 0.225 3 (A 15 C |A 16 N |A 16 CA |A 16 CB ) 123.411 180.000 56.589 0.225 0.500 1 (A 15 C |A 16 N |A 16 CA |A 16 CB ) 123.411 90.000 -33.411 0.243 0.400 2 (A 15 C |A 16 N |A 16 CA |A 16 CB ) 123.411 180.000 56.589 0.595 0.300 3 (A 15 CB |A 15 CA |A 15 C |A 16 N ) -104.745 -180.000 -75.255 0.373 0.500 1 (A 15 CB |A 15 CA |A 15 C |A 16 N ) -104.745 -60.000 44.745 0.509 0.300 3 (A 15 CB |A 15 CA |A 15 C |A 16 N ) -104.745 -135.000 -30.255 0.303 0.200 4 (A 15 CB |A 15 CA |A 15 C |A 15 O ) 75.191 180.000 104.809 0.471 0.375 1 (A 15 CB |A 15 CA |A 15 C |A 15 O ) 75.191 45.000 -30.191 0.227 0.150 4 (A 15 CB |A 15 CA |A 15 C |A 15 O ) 75.191 108.000 32.809 0.147 0.075 5 (A 17 CD1 |A 17 CG |A 17 CB |A 17 CA ) 53.923 90.000 36.077 0.694 1.000 2 (A 16 C |A 17 N |A 17 CA |A 17 C ) -108.814 -180.000 -71.186 0.254 0.375 1 (A 16 C |A 17 N |A 17 CA |A 17 C ) -108.814 -60.000 48.814 0.413 0.225 3 (A 16 C |A 17 N |A 17 CA |A 17 CB ) 129.029 180.000 50.971 0.185 0.500 1 (A 16 C |A 17 N |A 17 CA |A 17 CB ) 129.029 90.000 -39.029 0.317 0.400 2 (A 16 C |A 17 N |A 17 CA |A 17 CB ) 129.029 180.000 50.971 0.567 0.300 3 (A 16 CB |A 16 CA |A 16 C |A 17 N ) -88.530 -180.000 -91.470 0.513 0.500 1 (A 16 CB |A 16 CA |A 16 C |A 17 N ) -88.530 -45.000 43.530 0.399 0.200 4 (A 16 CB |A 16 CA |A 16 C |A 16 O ) 91.848 180.000 88.152 0.363 0.375 1 (A 16 CB |A 16 CA |A 16 C |A 16 O ) 91.848 60.000 -31.848 0.247 0.225 3 (A 16 CB |A 16 CA |A 16 C |A 16 O ) 91.848 135.000 43.152 0.299 0.150 4 (A 17 C |A 18 N |A 18 CA |A 18 C ) -111.769 -180.000 -68.231 0.236 0.375 1 (A 17 C |A 18 N |A 18 CA |A 18 C ) -111.769 -60.000 51.769 0.429 0.225 3 (A 17 C |A 18 N |A 18 CA |A 18 CB ) 127.203 180.000 52.797 0.198 0.500 1 (A 17 C |A 18 N |A 18 CA |A 18 CB ) 127.203 90.000 -37.203 0.292 0.400 2 (A 17 C |A 18 N |A 18 CA |A 18 CB ) 127.203 180.000 52.797 0.579 0.300 3 (A 17 CB |A 17 CA |A 17 C |A 18 N ) -122.186 -180.000 -57.814 0.234 0.500 1 (A 17 CB |A 17 CA |A 17 C |A 18 N ) -122.186 -90.000 32.186 0.227 0.400 2 (A 17 CB |A 17 CA |A 17 C |A 18 N ) -122.186 -180.000 -57.814 0.598 0.300 3 (A 17 CB |A 17 CA |A 17 C |A 17 O ) 55.766 180.000 124.234 0.586 0.375 1 (A 17 CB |A 17 CA |A 17 C |A 17 O ) 55.766 90.000 34.234 0.190 0.300 2 (A 18 C |A 19 N |A 19 CA |A 19 C ) -130.801 -180.000 -49.199 0.130 0.375 1 (A 18 C |A 19 N |A 19 CA |A 19 C ) -130.801 -90.000 40.801 0.256 0.300 2 (A 18 C |A 19 N |A 19 CA |A 19 C ) -130.801 -180.000 -49.199 0.415 0.225 3 (A 18 C |A 19 N |A 19 CA |A 19 CB ) 106.677 180.000 73.323 0.357 0.500 1 (A 18 C |A 19 N |A 19 CA |A 19 CB ) 106.677 60.000 -46.677 0.530 0.300 3 (A 18 CB |A 18 CA |A 18 C |A 19 N ) -94.326 -180.000 -85.674 0.462 0.500 1 (A 18 CB |A 18 CA |A 18 C |A 19 N ) -94.326 -60.000 34.326 0.367 0.300 3 (A 18 CB |A 18 CA |A 18 C |A 19 N ) -94.326 -135.000 -40.674 0.391 0.200 4 (A 18 CB |A 18 CA |A 18 C |A 18 O ) 85.762 180.000 94.238 0.403 0.375 1 (A 18 CB |A 18 CA |A 18 C |A 18 O ) 85.762 45.000 -40.762 0.293 0.150 4 (A 19 C |A 20 N |A 20 CA |A 20 C ) 86.697 180.000 93.303 0.397 0.375 1 (A 19 C |A 20 N |A 20 CA |A 20 C ) 86.697 45.000 -41.697 0.296 0.150 4 (A 19 CB |A 19 CA |A 19 C |A 20 N ) -82.498 -180.000 -97.502 0.565 0.500 1 (A 19 CB |A 19 CA |A 19 C |A 20 N ) -82.498 -45.000 37.498 0.373 0.200 4 (A 19 CB |A 19 CA |A 19 C |A 19 O ) 96.539 180.000 83.461 0.332 0.375 1 (A 19 CB |A 19 CA |A 19 C |A 19 O ) 96.539 60.000 -36.539 0.301 0.225 3 (A 19 CB |A 19 CA |A 19 C |A 19 O ) 96.539 135.000 38.461 0.285 0.150 4 (A 20 C |A 21 N |A 21 CA |A 21 C ) -81.692 -180.000 -98.308 0.429 0.375 1 (A 20 C |A 21 N |A 21 CA |A 21 C ) -81.692 -45.000 36.692 0.275 0.150 4 (A 20 C |A 21 N |A 21 CA |A 21 CB ) 155.428 90.000 -65.428 0.662 0.400 2 (A 21 C |A 22 N |A 22 CA |A 22 C ) 98.941 180.000 81.059 0.317 0.375 1 (A 21 C |A 22 N |A 22 CA |A 22 C ) 98.941 60.000 -38.941 0.327 0.225 3 (A 21 C |A 22 N |A 22 CA |A 22 C ) 98.941 135.000 36.059 0.272 0.150 4 (A 21 CB |A 21 CA |A 21 C |A 22 N ) 106.052 180.000 73.948 0.362 0.500 1 (A 21 CB |A 21 CA |A 21 C |A 22 N ) 106.052 60.000 -46.052 0.523 0.300 3 (A 21 CB |A 21 CA |A 21 C |A 21 O ) -73.644 -180.000 -106.356 0.481 0.375 1 (A 21 CB |A 21 CA |A 21 C |A 21 O ) -73.644 -108.000 -34.356 0.149 0.075 5 (A 22 C |A 23 N |A 23 CA |A 23 C ) -79.848 -180.000 -100.152 0.441 0.375 1 (A 22 C |A 23 N |A 23 CA |A 23 C ) -79.848 -45.000 34.848 0.264 0.150 4 (A 22 C |A 23 N |A 23 CA |A 23 CB ) 156.045 90.000 -66.045 0.668 0.400 2 (A 23 C |A 24 N |A 24 CA |A 24 C ) -111.177 -180.000 -68.823 0.240 0.375 1 (A 23 C |A 24 N |A 24 CA |A 24 C ) -111.177 -60.000 51.177 0.426 0.225 3 (A 23 C |A 24 N |A 24 CA |A 24 CB ) 126.091 180.000 53.909 0.205 0.500 1 (A 23 C |A 24 N |A 24 CA |A 24 CB ) 126.091 90.000 -36.091 0.278 0.400 2 (A 23 C |A 24 N |A 24 CA |A 24 CB ) 126.091 180.000 53.909 0.585 0.300 3 (A 23 CB |A 23 CA |A 23 C |A 24 N ) 117.670 180.000 62.330 0.268 0.500 1 (A 23 CB |A 23 CA |A 23 C |A 24 N ) 117.670 60.000 -57.670 0.598 0.300 3 (A 23 CB |A 23 CA |A 23 C |A 23 O ) -61.902 -180.000 -118.098 0.552 0.375 1 (A 24 C |A 25 N |A 25 CA |A 25 C ) -71.217 -180.000 -108.783 0.496 0.375 1 (A 24 C |A 25 N |A 25 CA |A 25 C ) -71.217 -36.000 35.217 0.150 0.075 5 (A 24 C |A 25 N |A 25 CA |A 25 CB ) 164.479 90.000 -74.479 0.743 0.400 2 (A 24 CB |A 24 CA |A 24 C |A 25 N ) 139.476 180.000 40.524 0.120 0.500 1 (A 24 CB |A 24 CA |A 24 C |A 25 N ) 139.476 90.000 -49.476 0.462 0.400 2 (A 24 CB |A 24 CA |A 24 C |A 25 N ) 139.476 180.000 40.524 0.457 0.300 3 (A 24 CB |A 24 CA |A 24 C |A 25 N ) 139.476 108.000 -31.476 0.192 0.100 5 (A 24 CB |A 24 CA |A 24 C |A 24 O ) -41.707 -180.000 -138.293 0.655 0.375 1 (A 24 CB |A 24 CA |A 24 C |A 24 O ) -41.707 -90.000 -48.293 0.334 0.300 2 (A 25 C |A 26 N |A 26 CA |A 26 C ) -124.132 -180.000 -55.868 0.165 0.375 1 (A 25 C |A 26 N |A 26 CA |A 26 C ) -124.132 -90.000 34.132 0.189 0.300 2 (A 25 C |A 26 N |A 26 CA |A 26 C ) -124.132 -180.000 -55.868 0.445 0.225 3 (A 25 C |A 26 N |A 26 CA |A 26 CB ) 114.283 180.000 65.717 0.294 0.500 1 (A 25 C |A 26 N |A 26 CA |A 26 CB ) 114.283 60.000 -54.283 0.587 0.300 3 (A 25 CB |A 25 CA |A 25 C |A 26 N ) -91.031 -180.000 -88.969 0.491 0.500 1 (A 25 CB |A 25 CA |A 25 C |A 26 N ) -91.031 -60.000 31.031 0.316 0.300 3 (A 25 CB |A 25 CA |A 25 C |A 26 N ) -91.031 -135.000 -43.969 0.399 0.200 4 (A 25 CB |A 25 CA |A 25 C |A 25 O ) 90.285 180.000 89.715 0.373 0.375 1 (A 25 CB |A 25 CA |A 25 C |A 25 O ) 90.285 60.000 -30.285 0.228 0.225 3 (A 25 CB |A 25 CA |A 25 C |A 25 O ) 90.285 135.000 44.715 0.300 0.150 4 (A 26 C |A 27 N |A 27 CA |A 27 C ) -55.394 -180.000 -124.606 0.588 0.375 1 (A 26 C |A 27 N |A 27 CA |A 27 C ) -55.394 -90.000 -34.606 0.194 0.300 2 (A 26 C |A 27 N |A 27 CA |A 27 CB ) -177.574 -90.000 87.574 0.799 0.400 2 (A 26 C |A 27 N |A 27 CA |A 27 CB ) -177.574 -135.000 42.574 0.397 0.200 4 (A 26 CB |A 26 CA |A 26 C |A 27 N ) -81.258 -180.000 -98.742 0.576 0.500 1 (A 26 CB |A 26 CA |A 26 C |A 27 N ) -81.258 -45.000 36.258 0.364 0.200 4 (A 26 CB |A 26 CA |A 26 C |A 26 O ) 98.123 180.000 81.877 0.322 0.375 1 (A 26 CB |A 26 CA |A 26 C |A 26 O ) 98.123 60.000 -38.123 0.318 0.225 3 (A 26 CB |A 26 CA |A 26 C |A 26 O ) 98.123 135.000 36.877 0.277 0.150 4 (A 27 C |A 28 N |A 28 CA |A 28 C ) -66.729 -180.000 -113.271 0.523 0.375 1 (A 27 C |A 28 N |A 28 CA |A 28 C ) -66.729 -36.000 30.729 0.142 0.075 5 (A 27 C |A 28 N |A 28 CA |A 28 CB ) 171.318 90.000 -81.318 0.782 0.400 2 (A 27 C |A 28 N |A 28 CA |A 28 CB ) 171.318 135.000 -36.318 0.364 0.200 4 (A 27 CB |A 27 CA |A 27 C |A 28 N ) 83.729 180.000 96.271 0.555 0.500 1 (A 27 CB |A 27 CA |A 27 C |A 28 N ) 83.729 45.000 -38.729 0.381 0.200 4 (A 27 CB |A 27 CA |A 27 C |A 27 O ) -97.589 -180.000 -82.411 0.325 0.375 1 (A 27 CB |A 27 CA |A 27 C |A 27 O ) -97.589 -60.000 37.589 0.312 0.225 3 (A 27 CB |A 27 CA |A 27 C |A 27 O ) -97.589 -135.000 -37.411 0.279 0.150 4 (A 28 C |A 29 N |A 29 CA |A 29 C ) -72.208 -180.000 -107.792 0.490 0.375 1 (A 28 C |A 29 N |A 29 CA |A 29 C ) -72.208 -108.000 -35.792 0.150 0.075 5 (A 28 C |A 29 N |A 29 CA |A 29 CB ) 164.548 90.000 -74.548 0.743 0.400 2 (A 28 CB |A 28 CA |A 28 C |A 29 N ) 84.241 180.000 95.759 0.550 0.500 1 (A 28 CB |A 28 CA |A 28 C |A 29 N ) 84.241 45.000 -39.241 0.384 0.200 4 (A 28 CB |A 28 CA |A 28 C |A 28 O ) -95.158 -180.000 -84.842 0.341 0.375 1 (A 28 CB |A 28 CA |A 28 C |A 28 O ) -95.158 -60.000 35.158 0.285 0.225 3 (A 28 CB |A 28 CA |A 28 C |A 28 O ) -95.158 -135.000 -39.842 0.290 0.150 4 (A 29 C |A 30 N |A 30 CA |A 30 C ) -66.094 -180.000 -113.906 0.527 0.375 1 (A 29 C |A 30 N |A 30 CA |A 30 C ) -66.094 -36.000 30.094 0.140 0.075 5 (A 29 C |A 30 N |A 30 CA |A 30 CB ) 171.175 90.000 -81.175 0.781 0.400 2 (A 29 C |A 30 N |A 30 CA |A 30 CB ) 171.175 135.000 -36.175 0.363 0.200 4 (A 29 CB |A 29 CA |A 29 C |A 30 N ) 83.233 180.000 96.767 0.559 0.500 1 (A 29 CB |A 29 CA |A 29 C |A 30 N ) 83.233 45.000 -38.233 0.378 0.200 4 (A 29 CB |A 29 CA |A 29 C |A 29 O ) -97.333 -180.000 -82.667 0.327 0.375 1 (A 29 CB |A 29 CA |A 29 C |A 29 O ) -97.333 -60.000 37.333 0.309 0.225 3 (A 29 CB |A 29 CA |A 29 C |A 29 O ) -97.333 -135.000 -37.667 0.281 0.150 4 (A 30 C |A 31 N |A 31 CA |A 31 C ) -63.312 -180.000 -116.688 0.543 0.375 1 (A 30 C |A 31 N |A 31 CA |A 31 CB ) 173.680 90.000 -83.680 0.790 0.400 2 (A 30 C |A 31 N |A 31 CA |A 31 CB ) 173.680 135.000 -38.680 0.381 0.200 4 (A 30 CB |A 30 CA |A 30 C |A 31 N ) 81.649 180.000 98.351 0.573 0.500 1 (A 30 CB |A 30 CA |A 30 C |A 31 N ) 81.649 45.000 -36.649 0.367 0.200 4 (A 30 CB |A 30 CA |A 30 C |A 30 O ) -100.113 -180.000 -79.887 0.309 0.375 1 (A 30 CB |A 30 CA |A 30 C |A 30 O ) -100.113 -60.000 40.113 0.339 0.225 3 (A 30 CB |A 30 CA |A 30 C |A 30 O ) -100.113 -135.000 -34.887 0.264 0.150 4 (A 31 C |A 32 N |A 32 CA |A 32 C ) -65.934 -180.000 -114.066 0.528 0.375 1 (A 31 C |A 32 N |A 32 CA |A 32 CB ) 171.396 90.000 -81.396 0.782 0.400 2 (A 31 C |A 32 N |A 32 CA |A 32 CB ) 171.396 135.000 -36.396 0.365 0.200 4 (A 31 CB |A 31 CA |A 31 C |A 32 N ) 77.764 180.000 102.236 0.606 0.500 1 (A 31 CB |A 31 CA |A 31 C |A 32 N ) 77.764 45.000 -32.764 0.331 0.200 4 (A 31 CB |A 31 CA |A 31 C |A 32 N ) 77.764 108.000 30.236 0.188 0.100 5 (A 31 CB |A 31 CA |A 31 C |A 31 O ) -103.833 -180.000 -76.167 0.285 0.375 1 (A 31 CB |A 31 CA |A 31 C |A 31 O ) -103.833 -60.000 43.833 0.374 0.225 3 (A 31 CB |A 31 CA |A 31 C |A 31 O ) -103.833 -135.000 -31.167 0.235 0.150 4 (A 32 C |A 33 N |A 33 CA |A 33 C ) -71.093 -180.000 -108.907 0.497 0.375 1 (A 32 C |A 33 N |A 33 CA |A 33 C ) -71.093 -36.000 35.093 0.150 0.075 5 (A 32 C |A 33 N |A 33 CA |A 33 CB ) 166.394 90.000 -76.394 0.756 0.400 2 (A 32 C |A 33 N |A 33 CA |A 33 CB ) 166.394 135.000 -31.394 0.316 0.200 4 (A 32 CB |A 32 CA |A 32 C |A 33 N ) 88.878 180.000 91.122 0.510 0.500 1 (A 32 CB |A 32 CA |A 32 C |A 33 N ) 88.878 45.000 -43.878 0.399 0.200 4 (A 32 CB |A 32 CA |A 32 C |A 32 O ) -91.407 -180.000 -88.593 0.366 0.375 1 (A 32 CB |A 32 CA |A 32 C |A 32 O ) -91.407 -60.000 31.407 0.242 0.225 3 (A 32 CB |A 32 CA |A 32 C |A 32 O ) -91.407 -135.000 -43.593 0.299 0.150 4 (A 33 C |A 34 N |A 34 CA |A 34 C ) -81.574 -180.000 -98.426 0.430 0.375 1 (A 33 C |A 34 N |A 34 CA |A 34 C ) -81.574 -45.000 36.574 0.275 0.150 4 (A 33 C |A 34 N |A 34 CA |A 34 CB ) 153.254 90.000 -63.254 0.638 0.400 2 (A 33 CB |A 33 CA |A 33 C |A 34 N ) 64.877 180.000 115.123 0.712 0.500 1 (A 33 CB |A 33 CA |A 33 C |A 33 O ) -117.635 -180.000 -62.365 0.201 0.375 1 (A 33 CB |A 33 CA |A 33 C |A 33 O ) -117.635 -60.000 57.635 0.448 0.225 3 (A 34 C |A 35 N |A 35 CA |A 35 C ) -61.288 -180.000 -118.712 0.555 0.375 1 (A 34 C |A 35 N |A 35 CA |A 35 CB ) 174.382 90.000 -84.382 0.792 0.400 2 (A 34 C |A 35 N |A 35 CA |A 35 CB ) 174.382 135.000 -39.382 0.385 0.200 4 (A 34 CB |A 34 CA |A 34 C |A 35 N ) 105.338 180.000 74.662 0.368 0.500 1 (A 34 CB |A 34 CA |A 34 C |A 35 N ) 105.338 60.000 -45.338 0.516 0.300 3 (A 34 CB |A 34 CA |A 34 C |A 34 O ) -74.994 -180.000 -105.006 0.472 0.375 1 (A 34 CB |A 34 CA |A 34 C |A 34 O ) -74.994 -108.000 -33.006 0.147 0.075 5 (A 35 C |A 36 N |A 36 CA |A 36 C ) -61.745 -180.000 -118.255 0.553 0.375 1 (A 35 C |A 36 N |A 36 CA |A 36 CB ) 175.373 90.000 -85.373 0.795 0.400 2 (A 35 C |A 36 N |A 36 CA |A 36 CB ) 175.373 135.000 -40.373 0.390 0.200 4 (A 35 CB |A 35 CA |A 35 C |A 36 N ) 99.403 180.000 80.597 0.418 0.500 1 (A 35 CB |A 35 CA |A 35 C |A 36 N ) 99.403 60.000 -39.403 0.442 0.300 3 (A 35 CB |A 35 CA |A 35 C |A 36 N ) 99.403 135.000 35.597 0.358 0.200 4 (A 35 CB |A 35 CA |A 35 C |A 35 O ) -80.625 -180.000 -99.375 0.436 0.375 1 (A 35 CB |A 35 CA |A 35 C |A 35 O ) -80.625 -45.000 35.625 0.269 0.150 4 (A 36 C |A 37 N |A 37 CA |A 37 C ) -83.151 -180.000 -96.849 0.420 0.375 1 (A 36 C |A 37 N |A 37 CA |A 37 C ) -83.151 -45.000 38.151 0.283 0.150 4 (A 36 C |A 37 N |A 37 CA |A 37 CB ) 154.413 90.000 -64.413 0.651 0.400 2 (A 36 CB |A 36 CA |A 36 C |A 37 N ) 98.386 180.000 81.614 0.427 0.500 1 (A 36 CB |A 36 CA |A 36 C |A 37 N ) 98.386 60.000 -38.386 0.428 0.300 3 (A 36 CB |A 36 CA |A 36 C |A 37 N ) 98.386 135.000 36.614 0.367 0.200 4 (A 36 CB |A 36 CA |A 36 C |A 36 O ) -81.543 -180.000 -98.457 0.430 0.375 1 (A 36 CB |A 36 CA |A 36 C |A 36 O ) -81.543 -45.000 36.543 0.275 0.150 4 (A 37 C |A 38 N |A 38 CA |A 38 C ) -161.760 -90.000 71.760 0.541 0.300 2 (A 37 CB |A 37 CA |A 37 C |A 38 N ) 70.848 180.000 109.152 0.664 0.500 1 (A 37 CB |A 37 CA |A 37 C |A 38 N ) 70.848 36.000 -34.848 0.199 0.100 5 (A 37 CB |A 37 CA |A 37 C |A 37 O ) -110.582 -180.000 -69.418 0.243 0.375 1 (A 37 CB |A 37 CA |A 37 C |A 37 O ) -110.582 -60.000 50.582 0.423 0.225 3 (A 38 C |A 39 N |A 39 CA |A 39 C ) -70.650 -180.000 -109.350 0.499 0.375 1 (A 38 C |A 39 N |A 39 CA |A 39 C ) -70.650 -36.000 34.650 0.149 0.075 5 (A 38 C |A 39 N |A 39 CA |A 39 CB ) 165.988 90.000 -75.988 0.753 0.400 2 (A 38 C |A 39 N |A 39 CA |A 39 CB ) 165.988 135.000 -30.988 0.312 0.200 4 (A 39 C |A 40 N |A 40 CA |A 40 C ) -80.919 -180.000 -99.081 0.434 0.375 1 (A 39 C |A 40 N |A 40 CA |A 40 C ) -80.919 -45.000 35.919 0.271 0.150 4 (A 39 C |A 40 N |A 40 CA |A 40 CB ) 156.798 90.000 -66.798 0.676 0.400 2 (A 39 CB |A 39 CA |A 39 C |A 40 N ) -126.057 -180.000 -53.943 0.206 0.500 1 (A 39 CB |A 39 CA |A 39 C |A 40 N ) -126.057 -90.000 36.057 0.277 0.400 2 (A 39 CB |A 39 CA |A 39 C |A 40 N ) -126.057 -180.000 -53.943 0.585 0.300 3 (A 39 CB |A 39 CA |A 39 C |A 39 O ) 54.274 180.000 125.726 0.594 0.375 1 (A 39 CB |A 39 CA |A 39 C |A 39 O ) 54.274 90.000 35.726 0.205 0.300 2 (A 40 C |A 41 N |A 41 CA |A 41 C ) -52.455 -180.000 -127.545 0.604 0.375 1 (A 40 C |A 41 N |A 41 CA |A 41 C ) -52.455 -90.000 -37.545 0.223 0.300 2 (A 40 C |A 41 N |A 41 CA |A 41 CB ) -175.042 -90.000 85.042 0.794 0.400 2 (A 40 C |A 41 N |A 41 CA |A 41 CB ) -175.042 -135.000 40.042 0.388 0.200 4 (A 40 CB |A 40 CA |A 40 C |A 41 N ) -105.502 -180.000 -74.498 0.366 0.500 1 (A 40 CB |A 40 CA |A 40 C |A 41 N ) -105.502 -60.000 45.502 0.518 0.300 3 (A 40 CB |A 40 CA |A 40 C |A 40 O ) 76.973 180.000 103.027 0.460 0.375 1 (A 40 CB |A 40 CA |A 40 C |A 40 O ) 76.973 45.000 -31.973 0.242 0.150 4 (A 40 CB |A 40 CA |A 40 C |A 40 O ) 76.973 108.000 31.027 0.143 0.075 5 (A 41 C |A 42 N |A 42 CA |A 42 C ) -113.436 -180.000 -66.564 0.226 0.375 1 (A 41 C |A 42 N |A 42 CA |A 42 C ) -113.436 -60.000 53.436 0.437 0.225 3 (A 41 C |A 42 N |A 42 CA |A 42 CB ) 124.201 180.000 55.799 0.219 0.500 1 (A 41 C |A 42 N |A 42 CA |A 42 CB ) 124.201 90.000 -34.201 0.253 0.400 2 (A 41 C |A 42 N |A 42 CA |A 42 CB ) 124.201 180.000 55.799 0.593 0.300 3 (A 41 CB |A 41 CA |A 41 C |A 42 N ) -111.844 -180.000 -68.156 0.314 0.500 1 (A 41 CB |A 41 CA |A 41 C |A 42 N ) -111.844 -60.000 51.844 0.573 0.300 3 (A 41 CB |A 41 CA |A 41 C |A 41 O ) 69.522 180.000 110.478 0.506 0.375 1 (A 41 CB |A 41 CA |A 41 C |A 41 O ) 69.522 36.000 -33.522 0.148 0.075 5 (A 42 C |A 43 N |A 43 CA |A 43 C ) -60.981 -180.000 -119.019 0.557 0.375 1 (A 42 C |A 43 N |A 43 CA |A 43 CB ) 177.877 90.000 -87.877 0.799 0.400 2 (A 42 C |A 43 N |A 43 CA |A 43 CB ) 177.877 135.000 -42.877 0.398 0.200 4 (A 42 CB |A 42 CA |A 42 C |A 43 N ) -116.451 -180.000 -63.549 0.277 0.500 1 (A 42 CB |A 42 CA |A 42 C |A 43 N ) -116.451 -60.000 56.451 0.595 0.300 3 (A 42 CB |A 42 CA |A 42 C |A 42 O ) 65.572 180.000 114.428 0.530 0.375 1 (A 43 C |A 44 N |A 44 CA |A 44 C ) -72.638 -180.000 -107.362 0.487 0.375 1 (A 43 C |A 44 N |A 44 CA |A 44 C ) -72.638 -108.000 -35.362 0.150 0.075 5 (A 43 C |A 44 N |A 44 CA |A 44 CB ) 164.853 90.000 -74.853 0.745 0.400 2 (A 43 CB |A 43 CA |A 43 C |A 44 N ) -131.259 -180.000 -48.741 0.170 0.500 1 (A 43 CB |A 43 CA |A 43 C |A 44 N ) -131.259 -90.000 41.259 0.348 0.400 2 (A 43 CB |A 43 CA |A 43 C |A 44 N ) -131.259 -180.000 -48.741 0.549 0.300 3 (A 43 CB |A 43 CA |A 43 C |A 43 O ) 51.375 180.000 128.625 0.609 0.375 1 (A 43 CB |A 43 CA |A 43 C |A 43 O ) 51.375 90.000 38.625 0.234 0.300 2 (A 44 C |A 45 N |A 45 CA |A 45 C ) -62.172 -180.000 -117.828 0.550 0.375 1 (A 44 C |A 45 N |A 45 CA |A 45 CB ) 175.691 90.000 -85.691 0.795 0.400 2 (A 44 C |A 45 N |A 45 CA |A 45 CB ) 175.691 135.000 -40.691 0.391 0.200 4 (A 44 CB |A 44 CA |A 44 C |A 45 N ) 94.768 180.000 85.232 0.458 0.500 1 (A 44 CB |A 44 CA |A 44 C |A 45 N ) 94.768 60.000 -34.768 0.374 0.300 3 (A 44 CB |A 44 CA |A 44 C |A 45 N ) 94.768 135.000 40.232 0.389 0.200 4 (A 44 CB |A 44 CA |A 44 C |A 44 O ) -85.056 -180.000 -94.944 0.407 0.375 1 (A 44 CB |A 44 CA |A 44 C |A 44 O ) -85.056 -45.000 40.056 0.291 0.150 4 (A 45 C |A 46 N |A 46 CA |A 46 C ) -86.481 -180.000 -93.519 0.398 0.375 1 (A 45 C |A 46 N |A 46 CA |A 46 C ) -86.481 -45.000 41.481 0.295 0.150 4 (A 45 C |A 46 N |A 46 CA |A 46 CB ) 152.270 90.000 -62.270 0.627 0.400 2 (A 45 CB |A 45 CA |A 45 C |A 46 N ) 71.827 180.000 108.173 0.656 0.500 1 (A 45 CB |A 45 CA |A 45 C |A 46 N ) 71.827 36.000 -35.827 0.200 0.100 5 (A 45 CB |A 45 CA |A 45 C |A 45 O ) -108.533 -180.000 -71.467 0.256 0.375 1 (A 45 CB |A 45 CA |A 45 C |A 45 O ) -108.533 -60.000 48.533 0.411 0.225 3 (A 46 C |A 47 N |A 47 CA |A 47 C ) 102.539 180.000 77.461 0.294 0.375 1 (A 46 C |A 47 N |A 47 CA |A 47 C ) 102.539 60.000 -42.539 0.362 0.225 3 (A 46 C |A 47 N |A 47 CA |A 47 C ) 102.539 135.000 32.461 0.246 0.150 4 (A 46 CB |A 46 CA |A 46 C |A 47 N ) 82.133 180.000 97.867 0.568 0.500 1 (A 46 CB |A 46 CA |A 46 C |A 47 N ) 82.133 45.000 -37.133 0.371 0.200 4 (A 46 CB |A 46 CA |A 46 C |A 46 O ) -98.385 -180.000 -81.615 0.320 0.375 1 (A 46 CB |A 46 CA |A 46 C |A 46 O ) -98.385 -60.000 38.385 0.321 0.225 3 (A 46 CB |A 46 CA |A 46 C |A 46 O ) -98.385 -135.000 -36.615 0.275 0.150 4 (A 47 C |A 48 N |A 48 CA |A 48 C ) -104.880 -180.000 -75.120 0.279 0.375 1 (A 47 C |A 48 N |A 48 CA |A 48 C ) -104.880 -60.000 44.880 0.383 0.225 3 (A 47 C |A 48 N |A 48 CA |A 48 C ) -104.880 -135.000 -30.120 0.226 0.150 4 (A 47 C |A 48 N |A 48 CA |A 48 CB ) 131.789 180.000 48.211 0.167 0.500 1 (A 47 C |A 48 N |A 48 CA |A 48 CB ) 131.789 90.000 -41.789 0.355 0.400 2 (A 47 C |A 48 N |A 48 CA |A 48 CB ) 131.789 180.000 48.211 0.545 0.300 3 (A 48 CB |A 48 CA |A 48 C |A 49 N ) -85.964 -180.000 -94.036 0.535 0.500 1 (A 48 CB |A 48 CA |A 48 C |A 49 N ) -85.964 -45.000 40.964 0.392 0.200 4 (A 48 CB |A 48 CA |A 48 C |A 48 O ) 94.272 180.000 85.728 0.347 0.375 1 (A 48 CB |A 48 CA |A 48 C |A 48 O ) 94.272 60.000 -34.272 0.275 0.225 3 (A 48 CB |A 48 CA |A 48 C |A 48 O ) 94.272 135.000 40.728 0.293 0.150 4 (A 49 C |A 50 N |A 50 CA |A 50 C ) -83.766 -180.000 -96.234 0.416 0.375 1 (A 49 C |A 50 N |A 50 CA |A 50 C ) -83.766 -45.000 38.766 0.286 0.150 4 (A 49 C |A 50 N |A 50 CA |A 50 CB ) 154.027 90.000 -64.027 0.647 0.400 2 (A 49 CB |A 49 CA |A 49 C |A 50 N ) -89.081 -180.000 -90.919 0.508 0.500 1 (A 49 CB |A 49 CA |A 49 C |A 50 N ) -89.081 -45.000 44.081 0.400 0.200 4 (A 49 CB |A 49 CA |A 49 C |A 49 O ) 89.850 180.000 90.150 0.376 0.375 1 (A 49 CB |A 49 CA |A 49 C |A 49 O ) 89.850 45.000 -44.850 0.300 0.150 4 (A 50 C |A 51 N |A 51 CA |A 51 C ) -142.556 -180.000 -37.444 0.077 0.375 1 (A 50 C |A 51 N |A 51 CA |A 51 C ) -142.556 -90.000 52.556 0.378 0.300 2 (A 50 C |A 51 N |A 51 CA |A 51 C ) -142.556 -180.000 -37.444 0.310 0.225 3 (A 50 C |A 51 N |A 51 CA |A 51 C ) -142.556 -108.000 34.556 0.149 0.075 5 (A 50 C |A 51 N |A 51 CA |A 51 CB ) 95.714 180.000 84.286 0.450 0.500 1 (A 50 C |A 51 N |A 51 CA |A 51 CB ) 95.714 60.000 -35.714 0.388 0.300 3 (A 50 C |A 51 N |A 51 CA |A 51 CB ) 95.714 135.000 39.286 0.384 0.200 4 (A 50 CB |A 50 CA |A 50 C |A 51 N ) -143.284 -180.000 -36.716 0.099 0.500 1 (A 50 CB |A 50 CA |A 50 C |A 51 N ) -143.284 -90.000 53.284 0.514 0.400 2 (A 50 CB |A 50 CA |A 50 C |A 51 N ) -143.284 -180.000 -36.716 0.403 0.300 3 (A 50 CB |A 50 CA |A 50 C |A 51 N ) -143.284 -108.000 35.284 0.200 0.100 5 (A 50 CB |A 50 CA |A 50 C |A 50 O ) 37.293 180.000 142.707 0.673 0.375 1 (A 50 CB |A 50 CA |A 50 C |A 50 O ) 37.293 90.000 52.707 0.380 0.300 2 (A 51 C |A 52 N |A 52 CA |A 52 C ) -106.201 -180.000 -73.799 0.270 0.375 1 (A 51 C |A 52 N |A 52 CA |A 52 C ) -106.201 -60.000 46.201 0.394 0.225 3 (A 51 C |A 52 N |A 52 CA |A 52 CB ) 131.244 180.000 48.756 0.170 0.500 1 (A 51 C |A 52 N |A 52 CA |A 52 CB ) 131.244 90.000 -41.244 0.348 0.400 2 (A 51 C |A 52 N |A 52 CA |A 52 CB ) 131.244 180.000 48.756 0.549 0.300 3 (A 51 CB |A 51 CA |A 51 C |A 52 N ) -111.924 -180.000 -68.076 0.313 0.500 1 (A 51 CB |A 51 CA |A 51 C |A 52 N ) -111.924 -60.000 51.924 0.574 0.300 3 (A 51 CB |A 51 CA |A 51 C |A 51 O ) 67.882 180.000 112.118 0.516 0.375 1 (A 51 CB |A 51 CA |A 51 C |A 51 O ) 67.882 36.000 -31.882 0.145 0.075 5 (A 52 C |A 53 N |A 53 CA |A 53 C ) -83.617 -180.000 -96.383 0.417 0.375 1 (A 52 C |A 53 N |A 53 CA |A 53 C ) -83.617 -45.000 38.617 0.285 0.150 4 (A 52 C |A 53 N |A 53 CA |A 53 CB ) 156.043 90.000 -66.043 0.668 0.400 2 (A 52 CB |A 52 CA |A 52 C |A 53 N ) -127.623 -180.000 -52.377 0.195 0.500 1 (A 52 CB |A 52 CA |A 52 C |A 53 N ) -127.623 -90.000 37.623 0.298 0.400 2 (A 52 CB |A 52 CA |A 52 C |A 53 N ) -127.623 -180.000 -52.377 0.576 0.300 3 (A 52 CB |A 52 CA |A 52 C |A 52 O ) 52.931 180.000 127.069 0.601 0.375 1 (A 52 CB |A 52 CA |A 52 C |A 52 O ) 52.931 90.000 37.069 0.218 0.300 2 (A 53 C |A 54 N |A 54 CA |A 54 C ) -82.964 -180.000 -97.036 0.421 0.375 1 (A 53 C |A 54 N |A 54 CA |A 54 C ) -82.964 -45.000 37.964 0.282 0.150 4 (A 53 C |A 54 N |A 54 CA |A 54 CB ) 153.810 90.000 -63.810 0.644 0.400 2 (A 53 CB |A 53 CA |A 53 C |A 54 N ) -113.508 -180.000 -66.492 0.301 0.500 1 (A 53 CB |A 53 CA |A 53 C |A 54 N ) -113.508 -60.000 53.508 0.583 0.300 3 (A 53 CB |A 53 CA |A 53 C |A 53 O ) 66.495 180.000 113.505 0.525 0.375 1 (A 53 CB |A 53 CA |A 53 C |A 53 O ) 66.495 36.000 -30.495 0.142 0.075 5 (A 54 C |A 55 N |A 55 CA |A 55 C ) -112.222 -180.000 -67.778 0.233 0.375 1 (A 54 C |A 55 N |A 55 CA |A 55 C ) -112.222 -60.000 52.222 0.432 0.225 3 (A 54 C |A 55 N |A 55 CA |A 55 CB ) 127.192 180.000 52.808 0.198 0.500 1 (A 54 C |A 55 N |A 55 CA |A 55 CB ) 127.192 90.000 -37.192 0.292 0.400 2 (A 54 C |A 55 N |A 55 CA |A 55 CB ) 127.192 180.000 52.808 0.579 0.300 3 (A 54 CB |A 54 CA |A 54 C |A 55 N ) -111.856 -180.000 -68.144 0.314 0.500 1 (A 54 CB |A 54 CA |A 54 C |A 55 N ) -111.856 -60.000 51.856 0.573 0.300 3 (A 54 CB |A 54 CA |A 54 C |A 54 O ) 69.166 180.000 110.834 0.508 0.375 1 (A 54 CB |A 54 CA |A 54 C |A 54 O ) 69.166 36.000 -33.166 0.148 0.075 5 (A 55 C |A 56 N |A 56 CA |A 56 C ) -75.732 -180.000 -104.268 0.467 0.375 1 (A 55 C |A 56 N |A 56 CA |A 56 C ) -75.732 -45.000 30.732 0.232 0.150 4 (A 55 C |A 56 N |A 56 CA |A 56 C ) -75.732 -108.000 -32.268 0.146 0.075 5 (A 55 C |A 56 N |A 56 CA |A 56 CB ) 161.527 90.000 -71.527 0.720 0.400 2 (A 55 CB |A 55 CA |A 55 C |A 56 N ) -94.839 -180.000 -85.161 0.458 0.500 1 (A 55 CB |A 55 CA |A 55 C |A 56 N ) -94.839 -60.000 34.839 0.375 0.300 3 (A 55 CB |A 55 CA |A 55 C |A 56 N ) -94.839 -135.000 -40.161 0.389 0.200 4 (A 55 CB |A 55 CA |A 55 C |A 55 O ) 84.634 180.000 95.366 0.410 0.375 1 (A 55 CB |A 55 CA |A 55 C |A 55 O ) 84.634 45.000 -39.634 0.290 0.150 4 (A 56 C |A 57 N |A 57 CA |A 57 C ) -70.585 -180.000 -109.415 0.500 0.375 1 (A 56 C |A 57 N |A 57 CA |A 57 C ) -70.585 -36.000 34.585 0.149 0.075 5 (A 56 C |A 57 N |A 57 CA |A 57 CB ) 166.826 90.000 -76.826 0.758 0.400 2 (A 56 C |A 57 N |A 57 CA |A 57 CB ) 166.826 135.000 -31.826 0.321 0.200 4 (A 56 CB |A 56 CA |A 56 C |A 57 N ) -108.005 -180.000 -71.995 0.345 0.500 1 (A 56 CB |A 56 CA |A 56 C |A 57 N ) -108.005 -60.000 48.005 0.543 0.300 3 (A 56 CB |A 56 CA |A 56 C |A 56 O ) 70.974 180.000 109.026 0.497 0.375 1 (A 56 CB |A 56 CA |A 56 C |A 56 O ) 70.974 36.000 -34.974 0.150 0.075 5 (A 57 C |A 58 N |A 58 CA |A 58 C ) -85.908 -180.000 -94.092 0.402 0.375 1 (A 57 C |A 58 N |A 58 CA |A 58 C ) -85.908 -45.000 40.908 0.294 0.150 4 (A 57 C |A 58 N |A 58 CA |A 58 CB ) 151.591 90.000 -61.591 0.619 0.400 2 (A 57 CB |A 57 CA |A 57 C |A 58 N ) 93.428 180.000 86.572 0.470 0.500 1 (A 57 CB |A 57 CA |A 57 C |A 58 N ) 93.428 60.000 -33.428 0.354 0.300 3 (A 57 CB |A 57 CA |A 57 C |A 58 N ) 93.428 135.000 41.572 0.394 0.200 4 (A 57 CB |A 57 CA |A 57 C |A 57 O ) -86.991 -180.000 -93.009 0.395 0.375 1 (A 57 CB |A 57 CA |A 57 C |A 57 O ) -86.991 -45.000 41.991 0.297 0.150 4 (A 58 C |A 59 N |A 59 CA |A 59 C ) -83.218 -180.000 -96.782 0.419 0.375 1 (A 58 C |A 59 N |A 59 CA |A 59 C ) -83.218 -45.000 38.218 0.283 0.150 4 (A 58 C |A 59 N |A 59 CA |A 59 CB ) 155.007 90.000 -65.007 0.657 0.400 2 (A 58 CB |A 58 CA |A 58 C |A 59 N ) 71.912 180.000 108.088 0.655 0.500 1 (A 58 CB |A 58 CA |A 58 C |A 59 N ) 71.912 36.000 -35.912 0.200 0.100 5 (A 58 CB |A 58 CA |A 58 C |A 58 O ) -107.491 -180.000 -72.509 0.262 0.375 1 (A 58 CB |A 58 CA |A 58 C |A 58 O ) -107.491 -60.000 47.491 0.403 0.225 3 (A 59 C |A 60 N |A 60 CA |A 60 C ) 81.332 180.000 98.668 0.432 0.375 1 (A 59 C |A 60 N |A 60 CA |A 60 C ) 81.332 45.000 -36.332 0.273 0.150 4 (A 59 CB |A 59 CA |A 59 C |A 60 N ) 92.656 180.000 87.344 0.477 0.500 1 (A 59 CB |A 59 CA |A 59 C |A 60 N ) 92.656 60.000 -32.656 0.342 0.300 3 (A 59 CB |A 59 CA |A 59 C |A 60 N ) 92.656 135.000 42.344 0.397 0.200 4 (A 59 CB |A 59 CA |A 59 C |A 59 O ) -86.474 -180.000 -93.526 0.398 0.375 1 (A 59 CB |A 59 CA |A 59 C |A 59 O ) -86.474 -45.000 41.474 0.295 0.150 4 (A 60 C |A 61 N |A 61 CA |A 61 C ) -109.469 -180.000 -70.531 0.250 0.375 1 (A 60 C |A 61 N |A 61 CA |A 61 C ) -109.469 -60.000 49.469 0.417 0.225 3 (A 60 C |A 61 N |A 61 CA |A 61 CB ) 128.307 180.000 51.693 0.190 0.500 1 (A 60 C |A 61 N |A 61 CA |A 61 CB ) 128.307 90.000 -38.307 0.307 0.400 2 (A 60 C |A 61 N |A 61 CA |A 61 CB ) 128.307 180.000 51.693 0.572 0.300 3 (A 61 C |A 62 N |A 62 CA |A 62 C ) -62.246 -180.000 -117.754 0.550 0.375 1 (A 61 C |A 62 N |A 62 CA |A 62 CB ) 174.597 90.000 -84.597 0.793 0.400 2 (A 61 C |A 62 N |A 62 CA |A 62 CB ) 174.597 135.000 -39.597 0.386 0.200 4 (A 61 CB |A 61 CA |A 61 C |A 62 N ) -82.241 -180.000 -97.759 0.568 0.500 1 (A 61 CB |A 61 CA |A 61 C |A 62 N ) -82.241 -45.000 37.241 0.371 0.200 4 (A 61 CB |A 61 CA |A 61 C |A 61 O ) 96.384 180.000 83.616 0.333 0.375 1 (A 61 CB |A 61 CA |A 61 C |A 61 O ) 96.384 60.000 -36.384 0.299 0.225 3 (A 61 CB |A 61 CA |A 61 C |A 61 O ) 96.384 135.000 38.616 0.285 0.150 4 (A 62 C |A 63 N |A 63 CA |A 63 C ) -73.342 -180.000 -106.658 0.482 0.375 1 (A 62 C |A 63 N |A 63 CA |A 63 C ) -73.342 -108.000 -34.658 0.149 0.075 5 (A 62 C |A 63 N |A 63 CA |A 63 CB ) 165.158 90.000 -75.158 0.748 0.400 2 (A 62 C |A 63 N |A 63 CA |A 63 CB ) 165.158 135.000 -30.158 0.302 0.200 4 (A 62 CB |A 62 CA |A 62 C |A 63 N ) -100.782 -180.000 -79.218 0.406 0.500 1 (A 62 CB |A 62 CA |A 62 C |A 63 N ) -100.782 -60.000 40.782 0.461 0.300 3 (A 62 CB |A 62 CA |A 62 C |A 63 N ) -100.782 -135.000 -34.218 0.346 0.200 4 (A 62 CB |A 62 CA |A 62 C |A 62 O ) 78.849 180.000 101.151 0.448 0.375 1 (A 62 CB |A 62 CA |A 62 C |A 62 O ) 78.849 45.000 -33.849 0.257 0.150 4 (A 63 C |A 64 N |A 64 CA |A 64 C ) 76.693 180.000 103.307 0.461 0.375 1 (A 63 C |A 64 N |A 64 CA |A 64 C ) 76.693 45.000 -31.693 0.240 0.150 4 (A 63 C |A 64 N |A 64 CA |A 64 C ) 76.693 108.000 31.307 0.144 0.075 5 (A 63 CB |A 63 CA |A 63 C |A 64 N ) 108.820 180.000 71.180 0.339 0.500 1 (A 63 CB |A 63 CA |A 63 C |A 64 N ) 108.820 60.000 -48.820 0.550 0.300 3 (A 63 CB |A 63 CA |A 63 C |A 63 O ) -71.597 -180.000 -108.403 0.493 0.375 1 (A 63 CB |A 63 CA |A 63 C |A 63 O ) -71.597 -36.000 35.597 0.150 0.075 5 (A 65 OE1 |A 65 CD |A 65 CG |A 65 CB ) 129.715 90.000 -39.715 0.817 1.000 2 (A 64 C |A 65 N |A 65 CA |A 65 C ) -131.846 -180.000 -48.154 0.125 0.375 1 (A 64 C |A 65 N |A 65 CA |A 65 C ) -131.846 -90.000 41.846 0.267 0.300 2 (A 64 C |A 65 N |A 65 CA |A 65 C ) -131.846 -180.000 -48.154 0.408 0.225 3 (A 64 C |A 65 N |A 65 CA |A 65 CB ) 106.512 180.000 73.488 0.358 0.500 1 (A 64 C |A 65 N |A 65 CA |A 65 CB ) 106.512 60.000 -46.512 0.528 0.300 3 (A 65 C |A 66 N |A 66 CA |A 66 C ) -153.111 -90.000 63.111 0.477 0.300 2 (A 65 C |A 66 N |A 66 CA |A 66 CB ) 83.738 180.000 96.262 0.555 0.500 1 (A 65 C |A 66 N |A 66 CA |A 66 CB ) 83.738 45.000 -38.738 0.381 0.200 4 (A 65 CB |A 65 CA |A 65 C |A 66 N ) -90.292 -180.000 -89.708 0.497 0.500 1 (A 65 CB |A 65 CA |A 65 C |A 66 N ) -90.292 -60.000 30.292 0.305 0.300 3 (A 65 CB |A 65 CA |A 65 C |A 66 N ) -90.292 -135.000 -44.708 0.400 0.200 4 (A 65 CB |A 65 CA |A 65 C |A 65 O ) 89.530 180.000 90.470 0.378 0.375 1 (A 65 CB |A 65 CA |A 65 C |A 65 O ) 89.530 45.000 -44.530 0.300 0.150 4 (A 66 C |A 67 N |A 67 CA |A 67 C ) -101.273 -180.000 -78.727 0.302 0.375 1 (A 66 C |A 67 N |A 67 CA |A 67 C ) -101.273 -60.000 41.273 0.350 0.225 3 (A 66 C |A 67 N |A 67 CA |A 67 C ) -101.273 -135.000 -33.727 0.256 0.150 4 (A 66 C |A 67 N |A 67 CA |A 67 CB ) 135.647 180.000 44.353 0.142 0.500 1 (A 66 C |A 67 N |A 67 CA |A 67 CB ) 135.647 90.000 -45.647 0.409 0.400 2 (A 66 C |A 67 N |A 67 CA |A 67 CB ) 135.647 180.000 44.353 0.505 0.300 3 (A 66 CB |A 66 CA |A 66 C |A 67 N ) -96.491 -180.000 -83.509 0.443 0.500 1 (A 66 CB |A 66 CA |A 66 C |A 67 N ) -96.491 -60.000 36.491 0.400 0.300 3 (A 66 CB |A 66 CA |A 66 C |A 67 N ) -96.491 -135.000 -38.509 0.380 0.200 4 (A 66 CB |A 66 CA |A 66 C |A 66 O ) 83.062 180.000 96.938 0.420 0.375 1 (A 66 CB |A 66 CA |A 66 C |A 66 O ) 83.062 45.000 -38.062 0.283 0.150 4 (A 67 C |A 68 N |A 68 CA |A 68 C ) -109.243 -180.000 -70.757 0.251 0.375 1 (A 67 C |A 68 N |A 68 CA |A 68 C ) -109.243 -60.000 49.243 0.415 0.225 3 (A 67 C |A 68 N |A 68 CA |A 68 CB ) 129.616 180.000 50.384 0.181 0.500 1 (A 67 C |A 68 N |A 68 CA |A 68 CB ) 129.616 90.000 -39.616 0.325 0.400 2 (A 67 C |A 68 N |A 68 CA |A 68 CB ) 129.616 180.000 50.384 0.563 0.300 3 (A 67 CB |A 67 CA |A 67 C |A 68 N ) -116.110 -180.000 -63.890 0.280 0.500 1 (A 67 CB |A 67 CA |A 67 C |A 68 N ) -116.110 -60.000 56.110 0.594 0.300 3 (A 67 CB |A 67 CA |A 67 C |A 67 O ) 64.233 180.000 115.767 0.538 0.375 1 (A 68 C |A 69 N |A 69 CA |A 69 C ) -81.019 -180.000 -98.981 0.434 0.375 1 (A 68 C |A 69 N |A 69 CA |A 69 C ) -81.019 -45.000 36.019 0.271 0.150 4 (A 68 C |A 69 N |A 69 CA |A 69 CB ) 156.046 90.000 -66.046 0.668 0.400 2 (A 68 CB |A 68 CA |A 68 C |A 69 N ) -129.510 -180.000 -50.490 0.182 0.500 1 (A 68 CB |A 68 CA |A 68 C |A 69 N ) -129.510 -90.000 39.510 0.324 0.400 2 (A 68 CB |A 68 CA |A 68 C |A 69 N ) -129.510 -180.000 -50.490 0.564 0.300 3 (A 68 CB |A 68 CA |A 68 C |A 68 O ) 51.514 180.000 128.486 0.608 0.375 1 (A 68 CB |A 68 CA |A 68 C |A 68 O ) 51.514 90.000 38.486 0.232 0.300 2 (A 69 C |A 70 N |A 70 CA |A 70 C ) -82.056 -180.000 -97.944 0.427 0.375 1 (A 69 C |A 70 N |A 70 CA |A 70 C ) -82.056 -45.000 37.056 0.278 0.150 4 (A 69 C |A 70 N |A 70 CA |A 70 CB ) 155.535 90.000 -65.535 0.663 0.400 2 (A 69 CB |A 69 CA |A 69 C |A 70 N ) -131.730 -180.000 -48.270 0.167 0.500 1 (A 69 CB |A 69 CA |A 69 C |A 70 N ) -131.730 -90.000 41.730 0.354 0.400 2 (A 69 CB |A 69 CA |A 69 C |A 70 N ) -131.730 -180.000 -48.270 0.545 0.300 3 (A 69 CB |A 69 CA |A 69 C |A 69 O ) 50.081 180.000 129.919 0.616 0.375 1 (A 69 CB |A 69 CA |A 69 C |A 69 O ) 50.081 90.000 39.919 0.247 0.300 2 (A 70 C |A 71 N |A 71 CA |A 71 C ) -75.397 -180.000 -104.603 0.470 0.375 1 (A 70 C |A 71 N |A 71 CA |A 71 C ) -75.397 -45.000 30.397 0.229 0.150 4 (A 70 C |A 71 N |A 71 CA |A 71 C ) -75.397 -108.000 -32.603 0.147 0.075 5 (A 70 C |A 71 N |A 71 CA |A 71 CB ) 162.038 90.000 -72.038 0.724 0.400 2 (A 70 CB |A 70 CA |A 70 C |A 71 N ) -79.181 -180.000 -100.819 0.594 0.500 1 (A 70 CB |A 70 CA |A 70 C |A 71 N ) -79.181 -45.000 34.181 0.346 0.200 4 (A 70 CB |A 70 CA |A 70 C |A 70 O ) 101.151 180.000 78.849 0.302 0.375 1 (A 70 CB |A 70 CA |A 70 C |A 70 O ) 101.151 60.000 -41.151 0.349 0.225 3 (A 70 CB |A 70 CA |A 70 C |A 70 O ) 101.151 135.000 33.849 0.257 0.150 4 (A 71 C |A 72 N |A 72 CA |A 72 C ) -111.940 -180.000 -68.060 0.235 0.375 1 (A 71 C |A 72 N |A 72 CA |A 72 C ) -111.940 -60.000 51.940 0.430 0.225 3 (A 71 C |A 72 N |A 72 CA |A 72 CB ) 127.011 180.000 52.989 0.199 0.500 1 (A 71 C |A 72 N |A 72 CA |A 72 CB ) 127.011 90.000 -37.011 0.290 0.400 2 (A 71 C |A 72 N |A 72 CA |A 72 CB ) 127.011 180.000 52.989 0.580 0.300 3 (A 71 CB |A 71 CA |A 71 C |A 72 N ) 84.385 180.000 95.615 0.549 0.500 1 (A 71 CB |A 71 CA |A 71 C |A 72 N ) 84.385 45.000 -39.385 0.385 0.200 4 (A 71 CB |A 71 CA |A 71 C |A 71 O ) -96.191 -180.000 -83.809 0.335 0.375 1 (A 71 CB |A 71 CA |A 71 C |A 71 O ) -96.191 -60.000 36.191 0.297 0.225 3 (A 71 CB |A 71 CA |A 71 C |A 71 O ) -96.191 -135.000 -38.809 0.286 0.150 4 (A 72 CB |A 72 CA |A 72 C |A 73 N ) -116.245 -180.000 -63.755 0.279 0.500 1 (A 72 CB |A 72 CA |A 72 C |A 73 N ) -116.245 -60.000 56.245 0.594 0.300 3 (A 72 CB |A 72 CA |A 72 C |A 72 O ) 64.854 180.000 115.146 0.534 0.375 1 (A 73 CB |A 73 CA |A 73 C |A 74 N ) 84.562 180.000 95.438 0.547 0.500 1 (A 73 CB |A 73 CA |A 73 C |A 74 N ) 84.562 45.000 -39.562 0.386 0.200 4 (A 73 CB |A 73 CA |A 73 C |A 73 O ) -94.826 -180.000 -85.174 0.343 0.375 1 (A 73 CB |A 73 CA |A 73 C |A 73 O ) -94.826 -60.000 34.826 0.281 0.225 3 (A 73 CB |A 73 CA |A 73 C |A 73 O ) -94.826 -135.000 -40.174 0.292 0.150 4 (A 74 C |A 75 N |A 75 CA |A 75 C ) -73.841 -180.000 -106.159 0.479 0.375 1 (A 74 C |A 75 N |A 75 CA |A 75 C ) -73.841 -108.000 -34.159 0.149 0.075 5 (A 74 C |A 75 N |A 75 CA |A 75 CB ) 165.154 90.000 -75.154 0.747 0.400 2 (A 74 C |A 75 N |A 75 CA |A 75 CB ) 165.154 135.000 -30.154 0.302 0.200 4 (A 74 CB |A 74 CA |A 74 C |A 75 N ) 86.834 180.000 93.166 0.528 0.500 1 (A 74 CB |A 74 CA |A 74 C |A 75 N ) 86.834 45.000 -41.834 0.395 0.200 4 (A 74 CB |A 74 CA |A 74 C |A 74 O ) -94.247 -180.000 -85.753 0.347 0.375 1 (A 74 CB |A 74 CA |A 74 C |A 74 O ) -94.247 -60.000 34.247 0.275 0.225 3 (A 74 CB |A 74 CA |A 74 C |A 74 O ) -94.247 -135.000 -40.753 0.293 0.150 4 (A 75 C |A 76 N |A 76 CA |A 76 C ) -61.305 -180.000 -118.695 0.555 0.375 1 (A 75 C |A 76 N |A 76 CA |A 76 CB ) 175.410 90.000 -85.410 0.795 0.400 2 (A 75 C |A 76 N |A 76 CA |A 76 CB ) 175.410 135.000 -40.410 0.390 0.200 4 (A 75 CB |A 75 CA |A 75 C |A 76 N ) 85.950 180.000 94.050 0.535 0.500 1 (A 75 CB |A 75 CA |A 75 C |A 76 N ) 85.950 45.000 -40.950 0.392 0.200 4 (A 75 CB |A 75 CA |A 75 C |A 75 O ) -94.124 -180.000 -85.876 0.348 0.375 1 (A 75 CB |A 75 CA |A 75 C |A 75 O ) -94.124 -60.000 34.124 0.273 0.225 3 (A 75 CB |A 75 CA |A 75 C |A 75 O ) -94.124 -135.000 -40.876 0.294 0.150 4 (A 76 C |A 77 N |A 77 CA |A 77 C ) -63.154 -180.000 -116.846 0.544 0.375 1 (A 76 C |A 77 N |A 77 CA |A 77 CB ) 173.187 90.000 -83.187 0.789 0.400 2 (A 76 C |A 77 N |A 77 CA |A 77 CB ) 173.187 135.000 -38.187 0.378 0.200 4 (A 76 CB |A 76 CA |A 76 C |A 77 N ) 72.575 180.000 107.425 0.650 0.500 1 (A 76 CB |A 76 CA |A 76 C |A 77 N ) 72.575 108.000 35.425 0.200 0.100 5 (A 76 CB |A 76 CA |A 76 C |A 76 O ) -109.991 -180.000 -70.009 0.247 0.375 1 (A 76 CB |A 76 CA |A 76 C |A 76 O ) -109.991 -60.000 49.991 0.420 0.225 3 (A 77 C |A 78 N |A 78 CA |A 78 C ) -63.200 -180.000 -116.800 0.544 0.375 1 (A 77 C |A 78 N |A 78 CA |A 78 CB ) 172.774 90.000 -82.774 0.787 0.400 2 (A 77 C |A 78 N |A 78 CA |A 78 CB ) 172.774 135.000 -37.774 0.375 0.200 4 (A 77 CB |A 77 CA |A 77 C |A 78 N ) 81.822 180.000 98.178 0.571 0.500 1 (A 77 CB |A 77 CA |A 77 C |A 78 N ) 81.822 45.000 -36.822 0.368 0.200 4 (A 77 CB |A 77 CA |A 77 C |A 77 O ) -97.488 -180.000 -82.512 0.326 0.375 1 (A 77 CB |A 77 CA |A 77 C |A 77 O ) -97.488 -60.000 37.488 0.311 0.225 3 (A 77 CB |A 77 CA |A 77 C |A 77 O ) -97.488 -135.000 -37.512 0.280 0.150 4 (A 78 C |A 79 N |A 79 CA |A 79 C ) -61.488 -180.000 -118.512 0.554 0.375 1 (A 78 C |A 79 N |A 79 CA |A 79 CB ) 175.642 90.000 -85.642 0.795 0.400 2 (A 78 C |A 79 N |A 79 CA |A 79 CB ) 175.642 135.000 -40.642 0.391 0.200 4 (A 78 CB |A 78 CA |A 78 C |A 79 N ) 82.218 180.000 97.782 0.568 0.500 1 (A 78 CB |A 78 CA |A 78 C |A 79 N ) 82.218 45.000 -37.218 0.371 0.200 4 (A 78 CB |A 78 CA |A 78 C |A 78 O ) -99.416 -180.000 -80.584 0.314 0.375 1 (A 78 CB |A 78 CA |A 78 C |A 78 O ) -99.416 -60.000 39.416 0.331 0.225 3 (A 78 CB |A 78 CA |A 78 C |A 78 O ) -99.416 -135.000 -35.584 0.269 0.150 4 (A 79 C |A 80 N |A 80 CA |A 80 C ) -66.815 -180.000 -113.185 0.523 0.375 1 (A 79 C |A 80 N |A 80 CA |A 80 C ) -66.815 -36.000 30.815 0.142 0.075 5 (A 79 C |A 80 N |A 80 CA |A 80 CB ) 170.654 90.000 -80.654 0.779 0.400 2 (A 79 C |A 80 N |A 80 CA |A 80 CB ) 170.654 135.000 -35.654 0.359 0.200 4 (A 79 CB |A 79 CA |A 79 C |A 80 N ) 88.340 180.000 91.660 0.514 0.500 1 (A 79 CB |A 79 CA |A 79 C |A 80 N ) 88.340 45.000 -43.340 0.399 0.200 4 (A 79 CB |A 79 CA |A 79 C |A 79 O ) -91.266 -180.000 -88.734 0.367 0.375 1 (A 79 CB |A 79 CA |A 79 C |A 79 O ) -91.266 -60.000 31.266 0.240 0.225 3 (A 79 CB |A 79 CA |A 79 C |A 79 O ) -91.266 -135.000 -43.734 0.299 0.150 4 (A 80 C |A 81 N |A 81 CA |A 81 C ) -58.395 -180.000 -121.605 0.572 0.375 1 (A 80 C |A 81 N |A 81 CA |A 81 C ) -58.395 -90.000 -31.605 0.165 0.300 2 (A 80 C |A 81 N |A 81 CA |A 81 CB ) 178.686 90.000 -88.686 0.800 0.400 2 (A 80 C |A 81 N |A 81 CA |A 81 CB ) 178.686 135.000 -43.686 0.399 0.200 4 (A 80 CB |A 80 CA |A 80 C |A 81 N ) 66.240 180.000 113.760 0.701 0.500 1 (A 80 CB |A 80 CA |A 80 C |A 81 N ) 66.240 36.000 -30.240 0.188 0.100 5 (A 80 CB |A 80 CA |A 80 C |A 80 O ) -116.033 -180.000 -63.967 0.210 0.375 1 (A 80 CB |A 80 CA |A 80 C |A 80 O ) -116.033 -60.000 56.033 0.445 0.225 3 (A 81 C |A 82 N |A 82 CA |A 82 C ) -80.559 -180.000 -99.441 0.437 0.375 1 (A 81 C |A 82 N |A 82 CA |A 82 C ) -80.559 -45.000 35.559 0.269 0.150 4 (A 81 C |A 82 N |A 82 CA |A 82 CB ) 156.969 90.000 -66.969 0.678 0.400 2 (A 81 CB |A 81 CA |A 81 C |A 82 N ) 90.833 180.000 89.167 0.493 0.500 1 (A 81 CB |A 81 CA |A 81 C |A 82 N ) 90.833 60.000 -30.833 0.313 0.300 3 (A 81 CB |A 81 CA |A 81 C |A 82 N ) 90.833 135.000 44.167 0.400 0.200 4 (A 81 CB |A 81 CA |A 81 C |A 81 O ) -90.153 -180.000 -89.847 0.374 0.375 1 (A 81 CB |A 81 CA |A 81 C |A 81 O ) -90.153 -60.000 30.153 0.227 0.225 3 (A 81 CB |A 81 CA |A 81 C |A 81 O ) -90.153 -135.000 -44.847 0.300 0.150 4 (A 82 C |A 83 N |A 83 CA |A 83 C ) -85.273 -180.000 -94.727 0.406 0.375 1 (A 82 C |A 83 N |A 83 CA |A 83 C ) -85.273 -45.000 40.273 0.292 0.150 4 (A 82 C |A 83 N |A 83 CA |A 83 CB ) 150.127 90.000 -60.127 0.602 0.400 2 (A 82 CB |A 82 CA |A 82 C |A 83 N ) 63.875 180.000 116.125 0.720 0.500 1 (A 82 CB |A 82 CA |A 82 C |A 82 O ) -116.025 -180.000 -63.975 0.210 0.375 1 (A 82 CB |A 82 CA |A 82 C |A 82 O ) -116.025 -60.000 56.025 0.445 0.225 3 (A 83 C |A 84 N |A 84 CA |A 84 C ) -67.143 -180.000 -112.857 0.521 0.375 1 (A 83 C |A 84 N |A 84 CA |A 84 C ) -67.143 -36.000 31.143 0.143 0.075 5 (A 83 C |A 84 N |A 84 CA |A 84 CB ) 168.570 90.000 -78.570 0.769 0.400 2 (A 83 C |A 84 N |A 84 CA |A 84 CB ) 168.570 135.000 -33.570 0.340 0.200 4 (A 83 CB |A 83 CA |A 83 C |A 84 N ) 115.098 180.000 64.902 0.288 0.500 1 (A 83 CB |A 83 CA |A 83 C |A 84 N ) 115.098 60.000 -55.098 0.590 0.300 3 (A 83 CB |A 83 CA |A 83 C |A 83 O ) -63.495 -180.000 -116.505 0.542 0.375 1 (A 84 C |A 85 N |A 85 CA |A 85 C ) 87.048 180.000 92.952 0.394 0.375 1 (A 84 C |A 85 N |A 85 CA |A 85 C ) 87.048 45.000 -42.048 0.297 0.150 4 (A 84 CB |A 84 CA |A 84 C |A 85 N ) -116.876 -180.000 -63.124 0.274 0.500 1 (A 84 CB |A 84 CA |A 84 C |A 85 N ) -116.876 -60.000 56.876 0.596 0.300 3 (A 84 CB |A 84 CA |A 84 C |A 84 O ) 64.221 180.000 115.779 0.538 0.375 1 (A 85 C |A 86 N |A 86 CA |A 86 C ) -88.851 -180.000 -91.149 0.383 0.375 1 (A 85 C |A 86 N |A 86 CA |A 86 C ) -88.851 -45.000 43.851 0.300 0.150 4 (A 85 C |A 86 N |A 86 CA |A 86 CB ) 149.477 180.000 30.523 0.069 0.500 1 (A 85 C |A 86 N |A 86 CA |A 86 CB ) 149.477 90.000 -59.477 0.594 0.400 2 (A 85 C |A 86 N |A 86 CA |A 86 CB ) 149.477 180.000 30.523 0.308 0.300 3 (A 85 C |A 86 N |A 86 CA |A 86 CB ) 149.477 180.000 30.523 0.189 0.100 5 (A 86 C |A 87 N |A 87 CA |A 87 C ) -108.312 -180.000 -71.688 0.257 0.375 1 (A 86 C |A 87 N |A 87 CA |A 87 C ) -108.312 -60.000 48.312 0.409 0.225 3 (A 86 C |A 87 N |A 87 CA |A 87 CB ) 128.061 180.000 51.939 0.192 0.500 1 (A 86 C |A 87 N |A 87 CA |A 87 CB ) 128.061 90.000 -38.061 0.304 0.400 2 (A 86 C |A 87 N |A 87 CA |A 87 CB ) 128.061 180.000 51.939 0.574 0.300 3 (A 86 CB |A 86 CA |A 86 C |A 87 N ) -64.352 -180.000 -115.648 0.716 0.500 1 (A 86 CB |A 86 CA |A 86 C |A 86 O ) 114.948 180.000 65.052 0.217 0.375 1 (A 86 CB |A 86 CA |A 86 C |A 86 O ) 114.948 60.000 -54.948 0.442 0.225 3 (A 87 C |A 88 N |A 88 CA |A 88 C ) -93.052 -180.000 -86.948 0.355 0.375 1 (A 87 C |A 88 N |A 88 CA |A 88 C ) -93.052 -60.000 33.052 0.261 0.225 3 (A 87 C |A 88 N |A 88 CA |A 88 C ) -93.052 -135.000 -41.948 0.297 0.150 4 (A 87 C |A 88 N |A 88 CA |A 88 CB ) 144.545 180.000 35.455 0.093 0.500 1 (A 87 C |A 88 N |A 88 CA |A 88 CB ) 144.545 90.000 -54.545 0.531 0.400 2 (A 87 C |A 88 N |A 88 CA |A 88 CB ) 144.545 180.000 35.455 0.385 0.300 3 (A 87 C |A 88 N |A 88 CA |A 88 CB ) 144.545 180.000 35.455 0.200 0.100 5 (A 87 CB |A 87 CA |A 87 C |A 88 N ) -113.790 -180.000 -66.210 0.298 0.500 1 (A 87 CB |A 87 CA |A 87 C |A 88 N ) -113.790 -60.000 53.790 0.584 0.300 3 (A 87 CB |A 87 CA |A 87 C |A 87 O ) 67.138 180.000 112.862 0.521 0.375 1 (A 87 CB |A 87 CA |A 87 C |A 87 O ) 67.138 36.000 -31.138 0.143 0.075 5 (A 88 C |A 89 N |A 89 CA |A 89 C ) -112.952 -180.000 -67.048 0.229 0.375 1 (A 88 C |A 89 N |A 89 CA |A 89 C ) -112.952 -60.000 52.952 0.435 0.225 3 (A 88 C |A 89 N |A 89 CA |A 89 CB ) 123.972 180.000 56.028 0.221 0.500 1 (A 88 C |A 89 N |A 89 CA |A 89 CB ) 123.972 90.000 -33.972 0.250 0.400 2 (A 88 C |A 89 N |A 89 CA |A 89 CB ) 123.972 180.000 56.028 0.594 0.300 3 (A 88 CB |A 88 CA |A 88 C |A 89 N ) 53.717 180.000 126.283 0.796 0.500 1 (A 88 CB |A 88 CA |A 88 C |A 89 N ) 53.717 90.000 36.283 0.280 0.400 2 (A 88 CB |A 88 CA |A 88 C |A 88 O ) -126.736 -180.000 -53.264 0.151 0.375 1 (A 88 CB |A 88 CA |A 88 C |A 88 O ) -126.736 -90.000 36.736 0.215 0.300 2 (A 88 CB |A 88 CA |A 88 C |A 88 O ) -126.736 -180.000 -53.264 0.436 0.225 3 (A 89 C |A 90 N |A 90 CA |A 90 C ) 70.744 180.000 109.256 0.499 0.375 1 (A 89 C |A 90 N |A 90 CA |A 90 C ) 70.744 36.000 -34.744 0.150 0.075 5 (A 89 CB |A 89 CA |A 89 C |A 90 N ) 171.607 90.000 -81.607 0.783 0.400 2 (A 89 CB |A 89 CA |A 89 C |A 90 N ) 171.607 135.000 -36.607 0.367 0.200 4 (A 89 CB |A 89 CA |A 89 C |A 89 O ) -7.838 -180.000 -172.162 0.746 0.375 1 (A 89 CB |A 89 CA |A 89 C |A 89 O ) -7.838 -90.000 -82.162 0.589 0.300 2 (A 89 CB |A 89 CA |A 89 C |A 89 O ) -7.838 -60.000 -52.162 0.431 0.225 3 (A 89 CB |A 89 CA |A 89 C |A 89 O ) -7.838 -45.000 -37.162 0.278 0.150 4 (A 90 C |A 91 N |A 91 CA |A 91 C ) -122.268 -180.000 -57.732 0.175 0.375 1 (A 90 C |A 91 N |A 91 CA |A 91 C ) -122.268 -90.000 32.268 0.171 0.300 2 (A 90 C |A 91 N |A 91 CA |A 91 C ) -122.268 -180.000 -57.732 0.448 0.225 3 (A 90 C |A 91 N |A 91 CA |A 91 CB ) 117.197 180.000 62.803 0.271 0.500 1 (A 90 C |A 91 N |A 91 CA |A 91 CB ) 117.197 60.000 -57.197 0.597 0.300 3 (A 91 CB |A 91 CA |A 91 C |A 92 N ) -108.963 -180.000 -71.037 0.338 0.500 1 (A 91 CB |A 91 CA |A 91 C |A 92 N ) -108.963 -60.000 48.963 0.551 0.300 3 (A 91 CB |A 91 CA |A 91 C |A 91 O ) 70.923 180.000 109.077 0.498 0.375 1 (A 91 CB |A 91 CA |A 91 C |A 91 O ) 70.923 36.000 -34.923 0.150 0.075 5 (A 92 C |A 93 N |A 93 CA |A 93 C ) -71.445 -180.000 -108.555 0.494 0.375 1 (A 92 C |A 93 N |A 93 CA |A 93 C ) -71.445 -36.000 35.445 0.150 0.075 5 (A 92 C |A 93 N |A 93 CA |A 93 CB ) 164.823 90.000 -74.823 0.745 0.400 2 (A 92 CB |A 92 CA |A 92 C |A 93 N ) -149.821 -180.000 -30.179 0.068 0.500 1 (A 92 CB |A 92 CA |A 92 C |A 93 N ) -149.821 -90.000 59.821 0.598 0.400 2 (A 92 CB |A 92 CA |A 92 C |A 93 N ) -149.821 -180.000 -30.179 0.303 0.300 3 (A 92 CB |A 92 CA |A 92 C |A 93 N ) -149.821 -180.000 -30.179 0.187 0.100 5 (A 92 CB |A 92 CA |A 92 C |A 92 O ) 32.698 180.000 147.302 0.691 0.375 1 (A 92 CB |A 92 CA |A 92 C |A 92 O ) 32.698 90.000 57.302 0.425 0.300 2 (A 93 C |A 94 N |A 94 CA |A 94 C ) -118.829 -180.000 -61.171 0.194 0.375 1 (A 93 C |A 94 N |A 94 CA |A 94 C ) -118.829 -60.000 58.829 0.450 0.225 3 (A 93 C |A 94 N |A 94 CA |A 94 CB ) 120.905 180.000 59.095 0.243 0.500 1 (A 93 C |A 94 N |A 94 CA |A 94 CB ) 120.905 90.000 -30.905 0.211 0.400 2 (A 93 C |A 94 N |A 94 CA |A 94 CB ) 120.905 180.000 59.095 0.600 0.300 3 (A 93 CB |A 93 CA |A 93 C |A 94 N ) -79.577 -180.000 -100.423 0.590 0.500 1 (A 93 CB |A 93 CA |A 93 C |A 94 N ) -79.577 -45.000 34.577 0.349 0.200 4 (A 93 CB |A 93 CA |A 93 C |A 93 O ) 100.095 180.000 79.905 0.309 0.375 1 (A 93 CB |A 93 CA |A 93 C |A 93 O ) 100.095 60.000 -40.095 0.338 0.225 3 (A 93 CB |A 93 CA |A 93 C |A 93 O ) 100.095 135.000 34.905 0.264 0.150 4 (A 94 C |A 95 N |A 95 CA |A 95 C ) -109.265 -180.000 -70.735 0.251 0.375 1 (A 94 C |A 95 N |A 95 CA |A 95 C ) -109.265 -60.000 49.265 0.415 0.225 3 (A 94 C |A 95 N |A 95 CA |A 95 CB ) 127.100 180.000 52.900 0.198 0.500 1 (A 94 C |A 95 N |A 95 CA |A 95 CB ) 127.100 90.000 -37.100 0.291 0.400 2 (A 94 C |A 95 N |A 95 CA |A 95 CB ) 127.100 180.000 52.900 0.580 0.300 3 (A 94 CB |A 94 CA |A 94 C |A 95 N ) -117.264 -180.000 -62.736 0.271 0.500 1 (A 94 CB |A 94 CA |A 94 C |A 95 N ) -117.264 -60.000 57.264 0.597 0.300 3 (A 94 CB |A 94 CA |A 94 C |A 94 O ) 62.578 180.000 117.422 0.548 0.375 1 (A 95 C |A 96 N |A 96 CA |A 96 C ) -132.997 -180.000 -47.003 0.119 0.375 1 (A 95 C |A 96 N |A 96 CA |A 96 C ) -132.997 -90.000 42.997 0.279 0.300 2 (A 95 C |A 96 N |A 96 CA |A 96 C ) -132.997 -180.000 -47.003 0.400 0.225 3 (A 95 C |A 96 N |A 96 CA |A 96 CB ) 106.880 180.000 73.120 0.355 0.500 1 (A 95 C |A 96 N |A 96 CA |A 96 CB ) 106.880 60.000 -46.880 0.532 0.300 3 (A 95 CB |A 95 CA |A 95 C |A 96 N ) -102.629 -180.000 -77.371 0.391 0.500 1 (A 95 CB |A 95 CA |A 95 C |A 96 N ) -102.629 -60.000 42.629 0.484 0.300 3 (A 95 CB |A 95 CA |A 95 C |A 96 N ) -102.629 -135.000 -32.371 0.327 0.200 4 (A 95 CB |A 95 CA |A 95 C |A 95 O ) 78.522 180.000 101.478 0.450 0.375 1 (A 95 CB |A 95 CA |A 95 C |A 95 O ) 78.522 45.000 -33.522 0.254 0.150 4 (A 96 C |A 97 N |A 97 CA |A 97 C ) -90.740 -180.000 -89.260 0.370 0.375 1 (A 96 C |A 97 N |A 97 CA |A 97 C ) -90.740 -60.000 30.740 0.234 0.225 3 (A 96 C |A 97 N |A 97 CA |A 97 C ) -90.740 -135.000 -44.260 0.300 0.150 4 (A 96 C |A 97 N |A 97 CA |A 97 CB ) 146.399 180.000 33.601 0.084 0.500 1 (A 96 C |A 97 N |A 97 CA |A 97 CB ) 146.399 90.000 -56.399 0.555 0.400 2 (A 96 C |A 97 N |A 97 CA |A 97 CB ) 146.399 180.000 33.601 0.356 0.300 3 (A 96 C |A 97 N |A 97 CA |A 97 CB ) 146.399 180.000 33.601 0.198 0.100 5 (A 96 CB |A 96 CA |A 96 C |A 97 N ) -57.531 -180.000 -122.469 0.768 0.500 1 (A 96 CB |A 96 CA |A 96 C |A 97 N ) -57.531 -90.000 -32.469 0.231 0.400 2 (A 96 CB |A 96 CA |A 96 C |A 96 O ) 124.366 180.000 55.634 0.163 0.375 1 (A 96 CB |A 96 CA |A 96 C |A 96 O ) 124.366 90.000 -34.366 0.191 0.300 2 (A 96 CB |A 96 CA |A 96 C |A 96 O ) 124.366 180.000 55.634 0.444 0.225 3 (A 97 C |A 98 N |A 98 CA |A 98 C ) -100.138 -180.000 -79.862 0.309 0.375 1 (A 97 C |A 98 N |A 98 CA |A 98 C ) -100.138 -60.000 40.138 0.339 0.225 3 (A 97 C |A 98 N |A 98 CA |A 98 C ) -100.138 -135.000 -34.862 0.264 0.150 4 (A 97 C |A 98 N |A 98 CA |A 98 CB ) 136.798 180.000 43.202 0.136 0.500 1 (A 97 C |A 98 N |A 98 CA |A 98 CB ) 136.798 90.000 -46.798 0.425 0.400 2 (A 97 C |A 98 N |A 98 CA |A 98 CB ) 136.798 180.000 43.202 0.491 0.300 3 (A 97 CB |A 97 CA |A 97 C |A 98 N ) -85.322 -180.000 -94.678 0.541 0.500 1 (A 97 CB |A 97 CA |A 97 C |A 98 N ) -85.322 -45.000 40.322 0.389 0.200 4 (A 97 CB |A 97 CA |A 97 C |A 97 O ) 95.122 180.000 84.878 0.342 0.375 1 (A 97 CB |A 97 CA |A 97 C |A 97 O ) 95.122 60.000 -35.122 0.285 0.225 3 (A 97 CB |A 97 CA |A 97 C |A 97 O ) 95.122 135.000 39.878 0.291 0.150 4 (A 98 C |A 99 N |A 99 CA |A 99 C ) -136.036 -180.000 -43.964 0.105 0.375 1 (A 98 C |A 99 N |A 99 CA |A 99 C ) -136.036 -90.000 46.036 0.311 0.300 2 (A 98 C |A 99 N |A 99 CA |A 99 C ) -136.036 -180.000 -43.964 0.375 0.225 3 (A 98 C |A 99 N |A 99 CA |A 99 CB ) 97.533 180.000 82.467 0.434 0.500 1 (A 98 C |A 99 N |A 99 CA |A 99 CB ) 97.533 60.000 -37.533 0.415 0.300 3 (A 98 C |A 99 N |A 99 CA |A 99 CB ) 97.533 135.000 37.467 0.373 0.200 4 (A 98 CB |A 98 CA |A 98 C |A 99 N ) -155.028 -90.000 65.028 0.657 0.400 2 (A 98 CB |A 98 CA |A 98 C |A 98 O ) 28.009 180.000 151.991 0.706 0.375 1 (A 98 CB |A 98 CA |A 98 C |A 98 O ) 28.009 90.000 61.991 0.468 0.300 2 (A 98 CB |A 98 CA |A 98 C |A 98 O ) 28.009 60.000 31.991 0.248 0.225 3 The following anisotropies have delta SANI greater than the cutoff: (calc Anis) (obs Anis) (delta Anis) class RDC1 A 14 ASN N A 14 ASN HN -8.515 -5.573 -2.942 A 20 GLY N A 20 GLY HN -13.402 -16.496 3.094 A 22 GLY N A 22 GLY HN -6.855 -9.047 2.192 A 24 ASN N A 24 ASN HN -7.116 -5.019 -2.097 A 40 ILE N A 40 ILE HN -2.089 -4.461 2.372 A 41 LYS N A 41 LYS HN -4.208 -1.378 -2.830 A 62 LEU N A 62 LEU HN -3.582 -0.119 -3.463 A 64 GLY N A 64 GLY HN -3.958 -1.762 -2.196 A 67 THR N A 67 THR HN -6.991 -3.888 -3.103 A 76 ALA N A 76 ALA HN 16.294 19.110 -2.816 A 80 ILE N A 80 ILE HN 17.327 19.766 -2.439 A 84 ASP N A 84 ASP HN 15.578 19.295 -3.717 A 85 GLY N A 85 GLY HN -12.502 -15.636 3.134 The following anisotropies have delta SANI greater than the cutoff: (calc Anis) (obs Anis) (delta Anis) class RDC2 A 14 ASN N A 14 ASN HN -11.781 -8.780 -3.001 A 25 VAL N A 25 VAL HN 6.727 3.831 2.896 A 35 LYS N A 35 LYS HN 9.375 12.251 -2.876 A 58 GLU N A 58 GLU HN 4.657 0.454 4.203 A 63 LYS N A 63 LYS HN -15.258 -12.945 -2.313 A 72 ASP N A 72 ASP HN -8.686 -11.138 2.452 overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,sani energies: 573.385, 328.898, 292.548, 93.857, 434.47, -709.333, 50.8955, 24.5102, 2.80007, 54.7398