NBONDS: found 148162 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 1058 ========== set-i-atoms A 50 MET HB2 set-j-atoms A 50 MET HE1 A 50 MET HE2 A 50 MET HE3 R= 3.836 NOE= 3.24 (- 1.44/+ 0.32) Delta= -0.276 E(NOE)= 3.796 NOEPRI: RMS diff. = 0.010, #(violat.> 0.2)= 1 of 2918 NOEs NOEPRI: RMS diff. class DIST = 0.009, #(viol.> 0.2)= 1 of 2888 NOEs NOEPRI: RMS diff. class HBON = 0.030, #(viol.> 0.2)= 0 of 30 NOEs ======================================== A 50 MET N A 50 MET CA A 50 MET C A 51 ILE N Dihedral= 94.701 Energy= 0.015 C= 1.000 Equil= 128.600 Delta= 7.099 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 2.615 1000.000 (A 73 CA |A 73 C ) 1.586 1.525 0.061 3.738 1000.000 (A 73 C |A 74 N ) 1.407 1.341 0.066 4.411 1000.000 (atom-i |atom-j |atom-k ) angle equil. delta energy const. (A 73 CA |A 73 C |A 74 N ) 122.456 116.994 5.462 4.543 500.000 (atom-i |atom-j |atom-k |atom-L ) angle equil. delta energy const. period (A 2 CA |A 2 C |A 3 N |A 3 CA ) -174.633 -179.992 -5.359 0.875 100.000 0 (A 3 CA |A 3 C |A 4 N |A 4 CA ) 172.627 -180.007 7.367 1.653 100.000 0 (A 11 CA |A 11 C |A 12 N |A 12 CA ) 173.329 -180.007 6.664 1.353 100.000 0 (A 16 CA |A 16 C |A 17 N |A 17 CA ) 173.912 -180.007 6.081 1.127 100.000 0 (A 19 CA |A 19 C |A 20 N |A 20 CA ) 174.477 -180.002 5.521 0.929 100.000 0 (A 37 CA |A 37 C |A 38 N |A 38 CA ) -174.665 -180.002 -5.337 0.868 100.000 0 (A 42 CA |A 42 C |A 43 N |A 43 CA ) 172.161 -180.007 7.832 1.868 100.000 0 (A 46 CA |A 46 C |A 47 N |A 47 CA ) -174.033 -180.002 -5.969 1.085 100.000 0 (A 54 CA |A 54 C |A 55 N |A 55 CA ) 173.355 -180.007 6.638 1.342 100.000 0 (A 63 CA |A 63 C |A 64 N |A 64 CA ) -172.624 -180.002 -7.378 1.658 100.000 0 (A 66 CA |A 66 C |A 67 N |A 67 CA ) 173.382 -180.007 6.611 1.331 100.000 0 (A 67 CA |A 67 C |A 68 N |A 68 CA ) -173.724 -180.007 -6.283 1.202 100.000 0 (A 69 CA |A 69 C |A 70 N |A 70 CA ) 170.724 -180.007 9.270 2.617 100.000 0 (A 70 CA |A 70 C |A 71 N |A 71 CA ) 173.818 -180.007 6.175 1.162 100.000 0 (A 72 CA |A 72 C |A 73 N |A 73 CA ) 165.699 179.987 14.289 6.219 100.000 0 (A 73 CA |A 73 C |A 74 N |A 74 CA ) 171.567 179.987 8.420 2.160 100.000 0 (A 79 CA |A 79 C |A 80 N |A 80 CA ) 172.607 -180.007 7.387 1.662 100.000 0 (A 82 CA |A 82 C |A 83 N |A 83 CA ) -170.629 -180.007 -9.378 2.679 100.000 0 (A 90 CA |A 90 C |A 91 N |A 91 CA ) -172.698 -179.992 -7.294 1.620 100.000 0 (A 92 CA |A 92 C |A 93 N |A 93 CA ) -173.558 -180.007 -6.449 1.267 100.000 0 (A 96 CA |A 96 C |A 97 N |A 97 CA ) 170.831 -180.007 9.162 2.557 100.000 0 (A 97 CA |A 97 C |A 98 N |A 98 CA ) 173.613 -180.007 6.380 1.240 100.000 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 ) 91.551 180.000 88.449 0.365 0.375 1 (A 1 C |A 2 N |A 2 CA |A 2 C ) 91.551 60.000 -31.551 0.243 0.225 3 (A 1 C |A 2 N |A 2 CA |A 2 C ) 91.551 135.000 43.449 0.299 0.150 4 (A 1 CB |A 1 CA |A 1 C |A 2 N ) -89.695 -180.000 -90.305 0.503 0.500 1 (A 1 CB |A 1 CA |A 1 C |A 2 N ) -89.695 -45.000 44.695 0.400 0.200 4 (A 1 CB |A 1 CA |A 1 C |A 1 O ) 90.627 180.000 89.373 0.371 0.375 1 (A 1 CB |A 1 CA |A 1 C |A 1 O ) 90.627 60.000 -30.627 0.232 0.225 3 (A 1 CB |A 1 CA |A 1 C |A 1 O ) 90.627 135.000 44.373 0.300 0.150 4 (A 3 ND1 |A 3 CG |A 3 CB |A 3 CA ) 96.751 180.000 83.249 0.529 0.600 1 (A 2 C |A 3 N |A 3 CA |A 3 C ) -62.192 -180.000 -117.808 0.550 0.375 1 (A 2 C |A 3 N |A 3 CA |A 3 CB ) 174.084 90.000 -84.084 0.792 0.400 2 (A 2 C |A 3 N |A 3 CA |A 3 CB ) 174.084 135.000 -39.084 0.383 0.200 4 (A 4 ND1 |A 4 CG |A 4 CB |A 4 CA ) 106.878 180.000 73.122 0.426 0.600 1 (A 3 C |A 4 N |A 4 CA |A 4 C ) -98.433 -180.000 -81.567 0.320 0.375 1 (A 3 C |A 4 N |A 4 CA |A 4 C ) -98.433 -60.000 38.433 0.321 0.225 3 (A 3 C |A 4 N |A 4 CA |A 4 C ) -98.433 -135.000 -36.567 0.275 0.150 4 (A 3 C |A 4 N |A 4 CA |A 4 CB ) 137.847 180.000 42.153 0.129 0.500 1 (A 3 C |A 4 N |A 4 CA |A 4 CB ) 137.847 90.000 -47.847 0.440 0.400 2 (A 3 C |A 4 N |A 4 CA |A 4 CB ) 137.847 180.000 42.153 0.478 0.300 3 (A 3 CB |A 3 CA |A 3 C |A 4 N ) 67.629 180.000 112.371 0.690 0.500 1 (A 3 CB |A 3 CA |A 3 C |A 4 N ) 67.629 36.000 -31.629 0.193 0.100 5 (A 3 CB |A 3 CA |A 3 C |A 3 O ) -111.332 -180.000 -68.668 0.239 0.375 1 (A 3 CB |A 3 CA |A 3 C |A 3 O ) -111.332 -60.000 51.332 0.427 0.225 3 (A 5 ND1 |A 5 CG |A 5 CB |A 5 CA ) -111.146 -180.000 -68.854 0.384 0.600 1 (A 4 C |A 5 N |A 5 CA |A 5 C ) -92.230 -180.000 -87.770 0.360 0.375 1 (A 4 C |A 5 N |A 5 CA |A 5 C ) -92.230 -60.000 32.230 0.251 0.225 3 (A 4 C |A 5 N |A 5 CA |A 5 C ) -92.230 -135.000 -42.770 0.298 0.150 4 (A 4 C |A 5 N |A 5 CA |A 5 CB ) 144.446 180.000 35.554 0.093 0.500 1 (A 4 C |A 5 N |A 5 CA |A 5 CB ) 144.446 90.000 -54.446 0.530 0.400 2 (A 4 C |A 5 N |A 5 CA |A 5 CB ) 144.446 180.000 35.554 0.386 0.300 3 (A 4 C |A 5 N |A 5 CA |A 5 CB ) 144.446 180.000 35.554 0.200 0.100 5 (A 4 CB |A 4 CA |A 4 C |A 5 N ) -158.183 -90.000 68.183 0.690 0.400 2 (A 4 CB |A 4 CA |A 4 C |A 4 O ) 25.137 180.000 154.863 0.714 0.375 1 (A 4 CB |A 4 CA |A 4 C |A 4 O ) 25.137 90.000 64.863 0.492 0.300 2 (A 4 CB |A 4 CA |A 4 C |A 4 O ) 25.137 60.000 34.863 0.282 0.225 3 (A 6 ND1 |A 6 CG |A 6 CB |A 6 CA ) 79.568 180.000 100.432 0.709 0.600 1 (A 5 C |A 6 N |A 6 CA |A 6 C ) -126.420 -180.000 -53.580 0.152 0.375 1 (A 5 C |A 6 N |A 6 CA |A 6 C ) -126.420 -90.000 36.420 0.211 0.300 2 (A 5 C |A 6 N |A 6 CA |A 6 C ) -126.420 -180.000 -53.580 0.437 0.225 3 (A 5 C |A 6 N |A 6 CA |A 6 CB ) 110.694 180.000 69.306 0.323 0.500 1 (A 5 C |A 6 N |A 6 CA |A 6 CB ) 110.694 60.000 -50.694 0.565 0.300 3 (A 5 CB |A 5 CA |A 5 C |A 6 N ) -133.935 -180.000 -46.065 0.153 0.500 1 (A 5 CB |A 5 CA |A 5 C |A 6 N ) -133.935 -90.000 43.935 0.385 0.400 2 (A 5 CB |A 5 CA |A 5 C |A 6 N ) -133.935 -180.000 -46.065 0.524 0.300 3 (A 5 CB |A 5 CA |A 5 C |A 5 O ) 47.016 180.000 132.984 0.631 0.375 1 (A 5 CB |A 5 CA |A 5 C |A 5 O ) 47.016 90.000 42.984 0.279 0.300 2 (A 7 ND1 |A 7 CG |A 7 CB |A 7 CA ) 75.984 180.000 104.016 0.745 0.600 1 (A 6 C |A 7 N |A 7 CA |A 7 C ) -84.825 -180.000 -95.175 0.409 0.375 1 (A 6 C |A 7 N |A 7 CA |A 7 C ) -84.825 -45.000 39.825 0.290 0.150 4 (A 6 C |A 7 N |A 7 CA |A 7 CB ) 152.249 90.000 -62.249 0.627 0.400 2 (A 6 CB |A 6 CA |A 6 C |A 7 N ) -92.527 -180.000 -87.473 0.478 0.500 1 (A 6 CB |A 6 CA |A 6 C |A 7 N ) -92.527 -60.000 32.527 0.340 0.300 3 (A 6 CB |A 6 CA |A 6 C |A 7 N ) -92.527 -135.000 -42.473 0.397 0.200 4 (A 6 CB |A 6 CA |A 6 C |A 6 O ) 86.215 180.000 93.785 0.400 0.375 1 (A 6 CB |A 6 CA |A 6 C |A 6 O ) 86.215 45.000 -41.215 0.295 0.150 4 (A 8 ND1 |A 8 CG |A 8 CB |A 8 CA ) 88.077 180.000 91.923 0.620 0.600 1 (A 7 C |A 8 N |A 8 CA |A 8 C ) -89.980 -180.000 -90.020 0.375 0.375 1 (A 7 C |A 8 N |A 8 CA |A 8 C ) -89.980 -45.000 44.980 0.300 0.150 4 (A 7 C |A 8 N |A 8 CA |A 8 CB ) 147.757 180.000 32.243 0.077 0.500 1 (A 7 C |A 8 N |A 8 CA |A 8 CB ) 147.757 90.000 -57.757 0.572 0.400 2 (A 7 C |A 8 N |A 8 CA |A 8 CB ) 147.757 180.000 32.243 0.335 0.300 3 (A 7 C |A 8 N |A 8 CA |A 8 CB ) 147.757 180.000 32.243 0.195 0.100 5 (A 7 CB |A 7 CA |A 7 C |A 8 N ) -157.844 -90.000 67.844 0.686 0.400 2 (A 7 CB |A 7 CA |A 7 C |A 7 O ) 24.873 180.000 155.127 0.715 0.375 1 (A 7 CB |A 7 CA |A 7 C |A 7 O ) 24.873 90.000 65.127 0.494 0.300 2 (A 7 CB |A 7 CA |A 7 C |A 7 O ) 24.873 60.000 35.127 0.285 0.225 3 (A 8 C |A 9 N |A 9 CA |A 9 C ) -75.995 -180.000 -104.005 0.466 0.375 1 (A 8 C |A 9 N |A 9 CA |A 9 C ) -75.995 -45.000 30.995 0.234 0.150 4 (A 8 C |A 9 N |A 9 CA |A 9 C ) -75.995 -108.000 -32.005 0.145 0.075 5 (A 8 C |A 9 N |A 9 CA |A 9 CB ) 161.620 90.000 -71.620 0.720 0.400 2 (A 8 CB |A 8 CA |A 8 C |A 9 N ) -100.879 -180.000 -79.121 0.406 0.500 1 (A 8 CB |A 8 CA |A 8 C |A 9 N ) -100.879 -60.000 40.879 0.462 0.300 3 (A 8 CB |A 8 CA |A 8 C |A 9 N ) -100.879 -135.000 -34.121 0.345 0.200 4 (A 8 CB |A 8 CA |A 8 C |A 8 O ) 79.174 180.000 100.826 0.445 0.375 1 (A 8 CB |A 8 CA |A 8 C |A 8 O ) 79.174 45.000 -34.174 0.259 0.150 4 (A 10 ND1 |A 10 CG |A 10 CB |A 10 CA ) -100.468 -180.000 -79.532 0.491 0.600 1 (A 9 C |A 10 N |A 10 CA |A 10 C ) -73.301 -180.000 -106.699 0.483 0.375 1 (A 9 C |A 10 N |A 10 CA |A 10 C ) -73.301 -108.000 -34.699 0.150 0.075 5 (A 9 C |A 10 N |A 10 CA |A 10 CB ) 162.310 90.000 -72.310 0.726 0.400 2 (A 9 CB |A 9 CA |A 9 C |A 10 N ) -97.885 -180.000 -82.115 0.431 0.500 1 (A 9 CB |A 9 CA |A 9 C |A 10 N ) -97.885 -60.000 37.885 0.420 0.300 3 (A 9 CB |A 9 CA |A 9 C |A 10 N ) -97.885 -135.000 -37.115 0.370 0.200 4 (A 9 CB |A 9 CA |A 9 C |A 9 O ) 82.503 180.000 97.497 0.424 0.375 1 (A 9 CB |A 9 CA |A 9 C |A 9 O ) 82.503 45.000 -37.503 0.280 0.150 4 (A 10 C |A 11 N |A 11 CA |A 11 C ) -97.758 -180.000 -82.242 0.324 0.375 1 (A 10 C |A 11 N |A 11 CA |A 11 C ) -97.758 -60.000 37.758 0.314 0.225 3 (A 10 C |A 11 N |A 11 CA |A 11 C ) -97.758 -135.000 -37.242 0.279 0.150 4 (A 10 C |A 11 N |A 11 CA |A 11 CB ) 140.734 180.000 39.266 0.113 0.500 1 (A 10 C |A 11 N |A 11 CA |A 11 CB ) 140.734 90.000 -50.734 0.480 0.400 2 (A 10 C |A 11 N |A 11 CA |A 11 CB ) 140.734 180.000 39.266 0.440 0.300 3 (A 10 C |A 11 N |A 11 CA |A 11 CB ) 140.734 108.000 -32.734 0.196 0.100 5 (A 10 CB |A 10 CA |A 10 C |A 11 N ) 97.531 180.000 82.469 0.434 0.500 1 (A 10 CB |A 10 CA |A 10 C |A 11 N ) 97.531 60.000 -37.531 0.415 0.300 3 (A 10 CB |A 10 CA |A 10 C |A 11 N ) 97.531 135.000 37.469 0.373 0.200 4 (A 10 CB |A 10 CA |A 10 C |A 10 O ) -81.445 -180.000 -98.555 0.431 0.375 1 (A 10 CB |A 10 CA |A 10 C |A 10 O ) -81.445 -45.000 36.445 0.274 0.150 4 (A 11 C |A 12 N |A 12 CA |A 12 C ) -88.300 -180.000 -91.700 0.386 0.375 1 (A 11 C |A 12 N |A 12 CA |A 12 C ) -88.300 -45.000 43.300 0.299 0.150 4 (A 11 C |A 12 N |A 12 CA |A 12 CB ) 148.382 180.000 31.618 0.074 0.500 1 (A 11 C |A 12 N |A 12 CA |A 12 CB ) 148.382 90.000 -58.382 0.580 0.400 2 (A 11 C |A 12 N |A 12 CA |A 12 CB ) 148.382 180.000 31.618 0.325 0.300 3 (A 11 C |A 12 N |A 12 CA |A 12 CB ) 148.382 180.000 31.618 0.193 0.100 5 (A 11 CB |A 11 CA |A 11 C |A 12 N ) -84.282 -180.000 -95.718 0.550 0.500 1 (A 11 CB |A 11 CA |A 11 C |A 12 N ) -84.282 -45.000 39.282 0.384 0.200 4 (A 11 CB |A 11 CA |A 11 C |A 11 O ) 95.832 180.000 84.168 0.337 0.375 1 (A 11 CB |A 11 CA |A 11 C |A 11 O ) 95.832 60.000 -35.832 0.293 0.225 3 (A 11 CB |A 11 CA |A 11 C |A 11 O ) 95.832 135.000 39.168 0.288 0.150 4 (A 12 C |A 13 N |A 13 CA |A 13 C ) -141.557 -180.000 -38.443 0.081 0.375 1 (A 12 C |A 13 N |A 13 CA |A 13 C ) -141.557 -90.000 51.557 0.368 0.300 2 (A 12 C |A 13 N |A 13 CA |A 13 C ) -141.557 -180.000 -38.443 0.321 0.225 3 (A 12 C |A 13 N |A 13 CA |A 13 C ) -141.557 -108.000 33.557 0.148 0.075 5 (A 12 C |A 13 N |A 13 CA |A 13 CB ) 95.412 180.000 84.588 0.453 0.500 1 (A 12 C |A 13 N |A 13 CA |A 13 CB ) 95.412 60.000 -35.412 0.384 0.300 3 (A 12 C |A 13 N |A 13 CA |A 13 CB ) 95.412 135.000 39.588 0.386 0.200 4 (A 12 CB |A 12 CA |A 12 C |A 13 N ) -60.896 -180.000 -119.104 0.743 0.500 1 (A 12 CB |A 12 CA |A 12 C |A 12 O ) 119.081 180.000 60.919 0.193 0.375 1 (A 12 CB |A 12 CA |A 12 C |A 12 O ) 119.081 60.000 -59.081 0.450 0.225 3 (A 13 C |A 14 N |A 14 CA |A 14 C ) -101.267 -180.000 -78.733 0.302 0.375 1 (A 13 C |A 14 N |A 14 CA |A 14 C ) -101.267 -60.000 41.267 0.350 0.225 3 (A 13 C |A 14 N |A 14 CA |A 14 C ) -101.267 -135.000 -33.733 0.256 0.150 4 (A 13 C |A 14 N |A 14 CA |A 14 CB ) 136.502 180.000 43.498 0.137 0.500 1 (A 13 C |A 14 N |A 14 CA |A 14 CB ) 136.502 90.000 -46.502 0.421 0.400 2 (A 13 C |A 14 N |A 14 CA |A 14 CB ) 136.502 180.000 43.498 0.495 0.300 3 (A 13 CB |A 13 CA |A 13 C |A 14 N ) -121.158 -180.000 -58.842 0.241 0.500 1 (A 13 CB |A 13 CA |A 13 C |A 14 N ) -121.158 -90.000 31.158 0.214 0.400 2 (A 13 CB |A 13 CA |A 13 C |A 14 N ) -121.158 -180.000 -58.842 0.599 0.300 3 (A 13 CB |A 13 CA |A 13 C |A 13 O ) 58.271 180.000 121.729 0.572 0.375 1 (A 13 CB |A 13 CA |A 13 C |A 13 O ) 58.271 90.000 31.729 0.166 0.300 2 (A 14 C |A 15 N |A 15 CA |A 15 C ) -99.468 -180.000 -80.532 0.313 0.375 1 (A 14 C |A 15 N |A 15 CA |A 15 C ) -99.468 -60.000 39.468 0.332 0.225 3 (A 14 C |A 15 N |A 15 CA |A 15 C ) -99.468 -135.000 -35.532 0.268 0.150 4 (A 14 C |A 15 N |A 15 CA |A 15 CB ) 137.959 180.000 42.041 0.129 0.500 1 (A 14 C |A 15 N |A 15 CA |A 15 CB ) 137.959 90.000 -47.959 0.441 0.400 2 (A 14 C |A 15 N |A 15 CA |A 15 CB ) 137.959 180.000 42.041 0.477 0.300 3 (A 14 CB |A 14 CA |A 14 C |A 15 N ) 116.842 180.000 63.158 0.274 0.500 1 (A 14 CB |A 14 CA |A 14 C |A 15 N ) 116.842 60.000 -56.842 0.596 0.300 3 (A 14 CB |A 14 CA |A 14 C |A 14 O ) -62.823 -180.000 -117.177 0.546 0.375 1 (A 15 C |A 16 N |A 16 CA |A 16 C ) -110.129 -180.000 -69.871 0.246 0.375 1 (A 15 C |A 16 N |A 16 CA |A 16 C ) -110.129 -60.000 50.129 0.421 0.225 3 (A 15 C |A 16 N |A 16 CA |A 16 CB ) 127.741 180.000 52.259 0.194 0.500 1 (A 15 C |A 16 N |A 16 CA |A 16 CB ) 127.741 90.000 -37.741 0.300 0.400 2 (A 15 C |A 16 N |A 16 CA |A 16 CB ) 127.741 180.000 52.259 0.576 0.300 3 (A 15 CB |A 15 CA |A 15 C |A 16 N ) -110.672 -180.000 -69.328 0.323 0.500 1 (A 15 CB |A 15 CA |A 15 C |A 16 N ) -110.672 -60.000 50.672 0.565 0.300 3 (A 15 CB |A 15 CA |A 15 C |A 15 O ) 68.751 180.000 111.249 0.511 0.375 1 (A 15 CB |A 15 CA |A 15 C |A 15 O ) 68.751 36.000 -32.751 0.147 0.075 5 (A 16 C |A 17 N |A 17 CA |A 17 C ) -107.234 -180.000 -72.766 0.264 0.375 1 (A 16 C |A 17 N |A 17 CA |A 17 C ) -107.234 -60.000 47.234 0.402 0.225 3 (A 16 C |A 17 N |A 17 CA |A 17 CB ) 130.447 180.000 49.553 0.176 0.500 1 (A 16 C |A 17 N |A 17 CA |A 17 CB ) 130.447 90.000 -40.447 0.337 0.400 2 (A 16 C |A 17 N |A 17 CA |A 17 CB ) 130.447 180.000 49.553 0.556 0.300 3 (A 16 CB |A 16 CA |A 16 C |A 17 N ) -84.380 -180.000 -95.620 0.549 0.500 1 (A 16 CB |A 16 CA |A 16 C |A 17 N ) -84.380 -45.000 39.380 0.385 0.200 4 (A 16 CB |A 16 CA |A 16 C |A 16 O ) 96.080 180.000 83.920 0.335 0.375 1 (A 16 CB |A 16 CA |A 16 C |A 16 O ) 96.080 60.000 -36.080 0.295 0.225 3 (A 16 CB |A 16 CA |A 16 C |A 16 O ) 96.080 135.000 38.920 0.287 0.150 4 (A 17 C |A 18 N |A 18 CA |A 18 C ) -122.659 -180.000 -57.341 0.173 0.375 1 (A 17 C |A 18 N |A 18 CA |A 18 C ) -122.659 -90.000 32.659 0.175 0.300 2 (A 17 C |A 18 N |A 18 CA |A 18 C ) -122.659 -180.000 -57.341 0.448 0.225 3 (A 17 C |A 18 N |A 18 CA |A 18 CB ) 115.696 180.000 64.304 0.283 0.500 1 (A 17 C |A 18 N |A 18 CA |A 18 CB ) 115.696 60.000 -55.696 0.592 0.300 3 (A 17 CB |A 17 CA |A 17 C |A 18 N ) -107.390 -180.000 -72.610 0.351 0.500 1 (A 17 CB |A 17 CA |A 17 C |A 18 N ) -107.390 -60.000 47.390 0.537 0.300 3 (A 17 CB |A 17 CA |A 17 C |A 17 O ) 72.944 180.000 107.056 0.485 0.375 1 (A 17 CB |A 17 CA |A 17 C |A 17 O ) 72.944 108.000 35.056 0.150 0.075 5 (A 18 C |A 19 N |A 19 CA |A 19 C ) -118.604 -180.000 -61.396 0.195 0.375 1 (A 18 C |A 19 N |A 19 CA |A 19 C ) -118.604 -60.000 58.604 0.449 0.225 3 (A 18 C |A 19 N |A 19 CA |A 19 CB ) 120.671 180.000 59.329 0.245 0.500 1 (A 18 C |A 19 N |A 19 CA |A 19 CB ) 120.671 90.000 -30.671 0.208 0.400 2 (A 18 C |A 19 N |A 19 CA |A 19 CB ) 120.671 180.000 59.329 0.600 0.300 3 (A 18 CB |A 18 CA |A 18 C |A 19 N ) -96.366 -180.000 -83.634 0.445 0.500 1 (A 18 CB |A 18 CA |A 18 C |A 19 N ) -96.366 -60.000 36.366 0.398 0.300 3 (A 18 CB |A 18 CA |A 18 C |A 19 N ) -96.366 -135.000 -38.634 0.381 0.200 4 (A 18 CB |A 18 CA |A 18 C |A 18 O ) 83.908 180.000 96.092 0.415 0.375 1 (A 18 CB |A 18 CA |A 18 C |A 18 O ) 83.908 45.000 -38.908 0.287 0.150 4 (A 19 C |A 20 N |A 20 CA |A 20 C ) 75.554 180.000 104.446 0.469 0.375 1 (A 19 C |A 20 N |A 20 CA |A 20 C ) 75.554 45.000 -30.554 0.230 0.150 4 (A 19 C |A 20 N |A 20 CA |A 20 C ) 75.554 108.000 32.446 0.146 0.075 5 (A 19 CB |A 19 CA |A 19 C |A 20 N ) -74.417 -180.000 -105.583 0.634 0.500 1 (A 19 CB |A 19 CA |A 19 C |A 20 N ) -74.417 -108.000 -33.583 0.198 0.100 5 (A 19 CB |A 19 CA |A 19 C |A 19 O ) 105.786 180.000 74.214 0.273 0.375 1 (A 19 CB |A 19 CA |A 19 C |A 19 O ) 105.786 60.000 -45.786 0.391 0.225 3 (A 20 C |A 21 N |A 21 CA |A 21 C ) -74.106 -180.000 -105.894 0.478 0.375 1 (A 20 C |A 21 N |A 21 CA |A 21 C ) -74.106 -108.000 -33.894 0.149 0.075 5 (A 20 C |A 21 N |A 21 CA |A 21 CB ) 163.092 90.000 -73.092 0.732 0.400 2 (A 21 C |A 22 N |A 22 CA |A 22 C ) 86.916 180.000 93.084 0.395 0.375 1 (A 21 C |A 22 N |A 22 CA |A 22 C ) 86.916 45.000 -41.916 0.297 0.150 4 (A 21 CB |A 21 CA |A 21 C |A 22 N ) 103.720 180.000 76.280 0.381 0.500 1 (A 21 CB |A 21 CA |A 21 C |A 22 N ) 103.720 60.000 -43.720 0.497 0.300 3 (A 21 CB |A 21 CA |A 21 C |A 22 N ) 103.720 135.000 31.280 0.315 0.200 4 (A 21 CB |A 21 CA |A 21 C |A 21 O ) -76.097 -180.000 -103.903 0.465 0.375 1 (A 21 CB |A 21 CA |A 21 C |A 21 O ) -76.097 -45.000 31.097 0.235 0.150 4 (A 21 CB |A 21 CA |A 21 C |A 21 O ) -76.097 -108.000 -31.903 0.145 0.075 5 (A 22 C |A 23 N |A 23 CA |A 23 C ) -72.237 -180.000 -107.763 0.489 0.375 1 (A 22 C |A 23 N |A 23 CA |A 23 C ) -72.237 -108.000 -35.763 0.150 0.075 5 (A 22 C |A 23 N |A 23 CA |A 23 CB ) 165.333 90.000 -75.333 0.749 0.400 2 (A 22 C |A 23 N |A 23 CA |A 23 CB ) 165.333 135.000 -30.333 0.304 0.200 4 (A 23 C |A 24 N |A 24 CA |A 24 C ) -95.610 -180.000 -84.390 0.338 0.375 1 (A 23 C |A 24 N |A 24 CA |A 24 C ) -95.610 -60.000 35.610 0.290 0.225 3 (A 23 C |A 24 N |A 24 CA |A 24 C ) -95.610 -135.000 -39.390 0.289 0.150 4 (A 23 C |A 24 N |A 24 CA |A 24 CB ) 140.853 180.000 39.147 0.112 0.500 1 (A 23 C |A 24 N |A 24 CA |A 24 CB ) 140.853 90.000 -50.853 0.481 0.400 2 (A 23 C |A 24 N |A 24 CA |A 24 CB ) 140.853 180.000 39.147 0.438 0.300 3 (A 23 C |A 24 N |A 24 CA |A 24 CB ) 140.853 108.000 -32.853 0.196 0.100 5 (A 23 CB |A 23 CA |A 23 C |A 24 N ) 102.663 180.000 77.337 0.390 0.500 1 (A 23 CB |A 23 CA |A 23 C |A 24 N ) 102.663 60.000 -42.663 0.485 0.300 3 (A 23 CB |A 23 CA |A 23 C |A 24 N ) 102.663 135.000 32.337 0.327 0.200 4 (A 23 CB |A 23 CA |A 23 C |A 23 O ) -77.156 -180.000 -102.844 0.458 0.375 1 (A 23 CB |A 23 CA |A 23 C |A 23 O ) -77.156 -45.000 32.156 0.244 0.150 4 (A 23 CB |A 23 CA |A 23 C |A 23 O ) -77.156 -108.000 -30.844 0.143 0.075 5 (A 24 C |A 25 N |A 25 CA |A 25 C ) -66.338 -180.000 -113.662 0.526 0.375 1 (A 24 C |A 25 N |A 25 CA |A 25 C ) -66.338 -36.000 30.338 0.141 0.075 5 (A 24 C |A 25 N |A 25 CA |A 25 CB ) 169.765 90.000 -79.765 0.775 0.400 2 (A 24 C |A 25 N |A 25 CA |A 25 CB ) 169.765 135.000 -34.765 0.351 0.200 4 (A 24 CB |A 24 CA |A 24 C |A 25 N ) 134.190 180.000 45.810 0.151 0.500 1 (A 24 CB |A 24 CA |A 24 C |A 25 N ) 134.190 90.000 -44.190 0.389 0.400 2 (A 24 CB |A 24 CA |A 24 C |A 25 N ) 134.190 180.000 45.810 0.521 0.300 3 (A 24 CB |A 24 CA |A 24 C |A 24 O ) -47.388 -180.000 -132.612 0.629 0.375 1 (A 24 CB |A 24 CA |A 24 C |A 24 O ) -47.388 -90.000 -42.612 0.275 0.300 2 (A 25 C |A 26 N |A 26 CA |A 26 C ) -122.776 -180.000 -57.224 0.172 0.375 1 (A 25 C |A 26 N |A 26 CA |A 26 C ) -122.776 -90.000 32.776 0.176 0.300 2 (A 25 C |A 26 N |A 26 CA |A 26 C ) -122.776 -180.000 -57.224 0.448 0.225 3 (A 25 C |A 26 N |A 26 CA |A 26 CB ) 115.150 180.000 64.850 0.288 0.500 1 (A 25 C |A 26 N |A 26 CA |A 26 CB ) 115.150 60.000 -55.150 0.590 0.300 3 (A 25 CB |A 25 CA |A 25 C |A 26 N ) -107.355 -180.000 -72.645 0.351 0.500 1 (A 25 CB |A 25 CA |A 25 C |A 26 N ) -107.355 -60.000 47.355 0.537 0.300 3 (A 25 CB |A 25 CA |A 25 C |A 25 O ) 74.310 180.000 105.690 0.476 0.375 1 (A 25 CB |A 25 CA |A 25 C |A 25 O ) 74.310 108.000 33.690 0.148 0.075 5 (A 26 C |A 27 N |A 27 CA |A 27 C ) -54.396 -180.000 -125.604 0.593 0.375 1 (A 26 C |A 27 N |A 27 CA |A 27 C ) -54.396 -90.000 -35.604 0.203 0.300 2 (A 26 C |A 27 N |A 27 CA |A 27 CB ) -177.633 -90.000 87.633 0.799 0.400 2 (A 26 C |A 27 N |A 27 CA |A 27 CB ) -177.633 -135.000 42.633 0.397 0.200 4 (A 26 CB |A 26 CA |A 26 C |A 27 N ) -84.617 -180.000 -95.383 0.547 0.500 1 (A 26 CB |A 26 CA |A 26 C |A 27 N ) -84.617 -45.000 39.617 0.386 0.200 4 (A 26 CB |A 26 CA |A 26 C |A 26 O ) 94.608 180.000 85.392 0.345 0.375 1 (A 26 CB |A 26 CA |A 26 C |A 26 O ) 94.608 60.000 -34.608 0.279 0.225 3 (A 26 CB |A 26 CA |A 26 C |A 26 O ) 94.608 135.000 40.392 0.292 0.150 4 (A 27 C |A 28 N |A 28 CA |A 28 C ) -68.630 -180.000 -111.370 0.512 0.375 1 (A 27 C |A 28 N |A 28 CA |A 28 C ) -68.630 -36.000 32.630 0.147 0.075 5 (A 27 C |A 28 N |A 28 CA |A 28 CB ) 168.050 90.000 -78.050 0.766 0.400 2 (A 27 C |A 28 N |A 28 CA |A 28 CB ) 168.050 135.000 -33.050 0.334 0.200 4 (A 27 CB |A 27 CA |A 27 C |A 28 N ) 79.930 180.000 100.070 0.587 0.500 1 (A 27 CB |A 27 CA |A 27 C |A 28 N ) 79.930 45.000 -34.930 0.353 0.200 4 (A 27 CB |A 27 CA |A 27 C |A 27 O ) -102.838 -180.000 -77.162 0.292 0.375 1 (A 27 CB |A 27 CA |A 27 C |A 27 O ) -102.838 -60.000 42.838 0.365 0.225 3 (A 27 CB |A 27 CA |A 27 C |A 27 O ) -102.838 -135.000 -32.162 0.244 0.150 4 (A 28 C |A 29 N |A 29 CA |A 29 C ) -64.263 -180.000 -115.737 0.538 0.375 1 (A 28 C |A 29 N |A 29 CA |A 29 CB ) 173.281 90.000 -83.281 0.789 0.400 2 (A 28 C |A 29 N |A 29 CA |A 29 CB ) 173.281 135.000 -38.281 0.378 0.200 4 (A 28 CB |A 28 CA |A 28 C |A 29 N ) 83.706 180.000 96.294 0.555 0.500 1 (A 28 CB |A 28 CA |A 28 C |A 29 N ) 83.706 45.000 -38.706 0.381 0.200 4 (A 28 CB |A 28 CA |A 28 C |A 28 O ) -96.595 -180.000 -83.405 0.332 0.375 1 (A 28 CB |A 28 CA |A 28 C |A 28 O ) -96.595 -60.000 36.595 0.301 0.225 3 (A 28 CB |A 28 CA |A 28 C |A 28 O ) -96.595 -135.000 -38.405 0.284 0.150 4 (A 29 C |A 30 N |A 30 CA |A 30 C ) -65.517 -180.000 -114.483 0.530 0.375 1 (A 29 C |A 30 N |A 30 CA |A 30 CB ) 171.922 90.000 -81.922 0.784 0.400 2 (A 29 C |A 30 N |A 30 CA |A 30 CB ) 171.922 135.000 -36.922 0.369 0.200 4 (A 29 CB |A 29 CA |A 29 C |A 30 N ) 82.125 180.000 97.875 0.569 0.500 1 (A 29 CB |A 29 CA |A 29 C |A 30 N ) 82.125 45.000 -37.125 0.371 0.200 4 (A 29 CB |A 29 CA |A 29 C |A 29 O ) -98.269 -180.000 -81.731 0.321 0.375 1 (A 29 CB |A 29 CA |A 29 C |A 29 O ) -98.269 -60.000 38.269 0.319 0.225 3 (A 29 CB |A 29 CA |A 29 C |A 29 O ) -98.269 -135.000 -36.731 0.276 0.150 4 (A 30 C |A 31 N |A 31 CA |A 31 C ) -63.008 -180.000 -116.992 0.545 0.375 1 (A 30 C |A 31 N |A 31 CA |A 31 CB ) 172.740 90.000 -82.740 0.787 0.400 2 (A 30 C |A 31 N |A 31 CA |A 31 CB ) 172.740 135.000 -37.740 0.375 0.200 4 (A 30 CB |A 30 CA |A 30 C |A 31 N ) 80.374 180.000 99.626 0.584 0.500 1 (A 30 CB |A 30 CA |A 30 C |A 31 N ) 80.374 45.000 -35.374 0.357 0.200 4 (A 30 CB |A 30 CA |A 30 C |A 30 O ) -100.827 -180.000 -79.173 0.305 0.375 1 (A 30 CB |A 30 CA |A 30 C |A 30 O ) -100.827 -60.000 40.827 0.346 0.225 3 (A 30 CB |A 30 CA |A 30 C |A 30 O ) -100.827 -135.000 -34.173 0.259 0.150 4 (A 31 C |A 32 N |A 32 CA |A 32 C ) -73.889 -180.000 -106.111 0.479 0.375 1 (A 31 C |A 32 N |A 32 CA |A 32 C ) -73.889 -108.000 -34.111 0.149 0.075 5 (A 31 C |A 32 N |A 32 CA |A 32 CB ) 163.202 90.000 -73.202 0.733 0.400 2 (A 31 CB |A 31 CA |A 31 C |A 32 N ) 83.625 180.000 96.375 0.556 0.500 1 (A 31 CB |A 31 CA |A 31 C |A 32 N ) 83.625 45.000 -38.625 0.381 0.200 4 (A 31 CB |A 31 CA |A 31 C |A 31 O ) -98.135 -180.000 -81.865 0.322 0.375 1 (A 31 CB |A 31 CA |A 31 C |A 31 O ) -98.135 -60.000 38.135 0.318 0.225 3 (A 31 CB |A 31 CA |A 31 C |A 31 O ) -98.135 -135.000 -36.865 0.276 0.150 4 (A 32 C |A 33 N |A 33 CA |A 33 C ) -74.244 -180.000 -105.756 0.477 0.375 1 (A 32 C |A 33 N |A 33 CA |A 33 C ) -74.244 -108.000 -33.756 0.149 0.075 5 (A 32 C |A 33 N |A 33 CA |A 33 CB ) 162.087 90.000 -72.087 0.724 0.400 2 (A 32 CB |A 32 CA |A 32 C |A 33 N ) 91.492 180.000 88.508 0.487 0.500 1 (A 32 CB |A 32 CA |A 32 C |A 33 N ) 91.492 60.000 -31.492 0.323 0.300 3 (A 32 CB |A 32 CA |A 32 C |A 33 N ) 91.492 135.000 43.508 0.399 0.200 4 (A 32 CB |A 32 CA |A 32 C |A 32 O ) -87.554 -180.000 -92.446 0.391 0.375 1 (A 32 CB |A 32 CA |A 32 C |A 32 O ) -87.554 -45.000 42.554 0.298 0.150 4 (A 33 C |A 34 N |A 34 CA |A 34 C ) -77.479 -180.000 -102.521 0.456 0.375 1 (A 33 C |A 34 N |A 34 CA |A 34 C ) -77.479 -45.000 32.479 0.246 0.150 4 (A 33 C |A 34 N |A 34 CA |A 34 C ) -77.479 -108.000 -30.521 0.142 0.075 5 (A 33 C |A 34 N |A 34 CA |A 34 CB ) 157.975 90.000 -67.975 0.687 0.400 2 (A 33 CB |A 33 CA |A 33 C |A 34 N ) 67.460 180.000 112.540 0.692 0.500 1 (A 33 CB |A 33 CA |A 33 C |A 34 N ) 67.460 36.000 -31.460 0.192 0.100 5 (A 33 CB |A 33 CA |A 33 C |A 33 O ) -113.858 -180.000 -66.142 0.223 0.375 1 (A 33 CB |A 33 CA |A 33 C |A 33 O ) -113.858 -60.000 53.858 0.438 0.225 3 (A 34 C |A 35 N |A 35 CA |A 35 C ) -56.195 -180.000 -123.805 0.584 0.375 1 (A 34 C |A 35 N |A 35 CA |A 35 C ) -56.195 -90.000 -33.805 0.186 0.300 2 (A 34 C |A 35 N |A 35 CA |A 35 CB ) -179.732 -90.000 89.732 0.800 0.400 2 (A 34 C |A 35 N |A 35 CA |A 35 CB ) -179.732 -135.000 44.732 0.400 0.200 4 (A 34 CB |A 34 CA |A 34 C |A 35 N ) 109.965 180.000 70.035 0.329 0.500 1 (A 34 CB |A 34 CA |A 34 C |A 35 N ) 109.965 60.000 -49.965 0.560 0.300 3 (A 34 CB |A 34 CA |A 34 C |A 34 O ) -70.121 -180.000 -109.879 0.503 0.375 1 (A 34 CB |A 34 CA |A 34 C |A 34 O ) -70.121 -36.000 34.121 0.149 0.075 5 (A 35 C |A 36 N |A 36 CA |A 36 C ) -60.649 -180.000 -119.351 0.559 0.375 1 (A 35 C |A 36 N |A 36 CA |A 36 CB ) 176.128 90.000 -86.128 0.796 0.400 2 (A 35 C |A 36 N |A 36 CA |A 36 CB ) 176.128 135.000 -41.128 0.393 0.200 4 (A 35 CB |A 35 CA |A 35 C |A 36 N ) 93.979 180.000 86.021 0.465 0.500 1 (A 35 CB |A 35 CA |A 35 C |A 36 N ) 93.979 60.000 -33.979 0.362 0.300 3 (A 35 CB |A 35 CA |A 35 C |A 36 N ) 93.979 135.000 41.021 0.392 0.200 4 (A 35 CB |A 35 CA |A 35 C |A 35 O ) -85.716 -180.000 -94.284 0.403 0.375 1 (A 35 CB |A 35 CA |A 35 C |A 35 O ) -85.716 -45.000 40.716 0.293 0.150 4 (A 36 C |A 37 N |A 37 CA |A 37 C ) -83.935 -180.000 -96.065 0.415 0.375 1 (A 36 C |A 37 N |A 37 CA |A 37 C ) -83.935 -45.000 38.935 0.287 0.150 4 (A 36 C |A 37 N |A 37 CA |A 37 CB ) 152.694 90.000 -62.694 0.632 0.400 2 (A 36 CB |A 36 CA |A 36 C |A 37 N ) 98.608 180.000 81.392 0.425 0.500 1 (A 36 CB |A 36 CA |A 36 C |A 37 N ) 98.608 60.000 -38.608 0.431 0.300 3 (A 36 CB |A 36 CA |A 36 C |A 37 N ) 98.608 135.000 36.392 0.365 0.200 4 (A 36 CB |A 36 CA |A 36 C |A 36 O ) -80.909 -180.000 -99.091 0.434 0.375 1 (A 36 CB |A 36 CA |A 36 C |A 36 O ) -80.909 -45.000 35.909 0.271 0.150 4 (A 37 C |A 38 N |A 38 CA |A 38 C ) -160.482 -90.000 70.482 0.533 0.300 2 (A 37 CB |A 37 CA |A 37 C |A 38 N ) 69.990 180.000 110.010 0.671 0.500 1 (A 37 CB |A 37 CA |A 37 C |A 38 N ) 69.990 36.000 -33.990 0.198 0.100 5 (A 37 CB |A 37 CA |A 37 C |A 37 O ) -111.281 -180.000 -68.719 0.239 0.375 1 (A 37 CB |A 37 CA |A 37 C |A 37 O ) -111.281 -60.000 51.281 0.427 0.225 3 (A 38 C |A 39 N |A 39 CA |A 39 C ) -66.257 -180.000 -113.743 0.526 0.375 1 (A 38 C |A 39 N |A 39 CA |A 39 C ) -66.257 -36.000 30.257 0.141 0.075 5 (A 38 C |A 39 N |A 39 CA |A 39 CB ) 172.289 90.000 -82.289 0.786 0.400 2 (A 38 C |A 39 N |A 39 CA |A 39 CB ) 172.289 135.000 -37.289 0.372 0.200 4 (A 39 C |A 40 N |A 40 CA |A 40 C ) -97.157 -180.000 -82.843 0.328 0.375 1 (A 39 C |A 40 N |A 40 CA |A 40 C ) -97.157 -60.000 37.157 0.307 0.225 3 (A 39 C |A 40 N |A 40 CA |A 40 C ) -97.157 -135.000 -37.843 0.282 0.150 4 (A 39 C |A 40 N |A 40 CA |A 40 CB ) 140.113 180.000 39.887 0.116 0.500 1 (A 39 C |A 40 N |A 40 CA |A 40 CB ) 140.113 90.000 -50.113 0.471 0.400 2 (A 39 C |A 40 N |A 40 CA |A 40 CB ) 140.113 180.000 39.887 0.448 0.300 3 (A 39 C |A 40 N |A 40 CA |A 40 CB ) 140.113 108.000 -32.113 0.194 0.100 5 (A 39 CB |A 39 CA |A 39 C |A 40 N ) -110.284 -180.000 -69.716 0.327 0.500 1 (A 39 CB |A 39 CA |A 39 C |A 40 N ) -110.284 -60.000 50.284 0.562 0.300 3 (A 39 CB |A 39 CA |A 39 C |A 39 O ) 72.207 180.000 107.793 0.490 0.375 1 (A 39 CB |A 39 CA |A 39 C |A 39 O ) 72.207 108.000 35.793 0.150 0.075 5 (A 40 C |A 41 N |A 41 CA |A 41 C ) -57.161 -180.000 -122.839 0.578 0.375 1 (A 40 C |A 41 N |A 41 CA |A 41 C ) -57.161 -90.000 -32.839 0.176 0.300 2 (A 40 C |A 41 N |A 41 CA |A 41 CB ) 179.041 90.000 -89.041 0.800 0.400 2 (A 40 C |A 41 N |A 41 CA |A 41 CB ) 179.041 135.000 -44.041 0.400 0.200 4 (A 40 CB |A 40 CA |A 40 C |A 41 N ) -101.400 -180.000 -78.600 0.401 0.500 1 (A 40 CB |A 40 CA |A 40 C |A 41 N ) -101.400 -60.000 41.400 0.469 0.300 3 (A 40 CB |A 40 CA |A 40 C |A 41 N ) -101.400 -135.000 -33.600 0.340 0.200 4 (A 40 CB |A 40 CA |A 40 C |A 40 O ) 80.888 180.000 99.112 0.434 0.375 1 (A 40 CB |A 40 CA |A 40 C |A 40 O ) 80.888 45.000 -35.888 0.271 0.150 4 (A 41 C |A 42 N |A 42 CA |A 42 C ) -132.651 -180.000 -47.349 0.121 0.375 1 (A 41 C |A 42 N |A 42 CA |A 42 C ) -132.651 -90.000 42.651 0.275 0.300 2 (A 41 C |A 42 N |A 42 CA |A 42 C ) -132.651 -180.000 -47.349 0.402 0.225 3 (A 41 C |A 42 N |A 42 CA |A 42 CB ) 105.016 180.000 74.984 0.370 0.500 1 (A 41 C |A 42 N |A 42 CA |A 42 CB ) 105.016 60.000 -45.016 0.512 0.300 3 (A 41 CB |A 41 CA |A 41 C |A 42 N ) -93.729 -180.000 -86.271 0.467 0.500 1 (A 41 CB |A 41 CA |A 41 C |A 42 N ) -93.729 -60.000 33.729 0.358 0.300 3 (A 41 CB |A 41 CA |A 41 C |A 42 N ) -93.729 -135.000 -41.271 0.393 0.200 4 (A 41 CB |A 41 CA |A 41 C |A 41 O ) 86.381 180.000 93.619 0.399 0.375 1 (A 41 CB |A 41 CA |A 41 C |A 41 O ) 86.381 45.000 -41.381 0.295 0.150 4 (A 42 C |A 43 N |A 43 CA |A 43 C ) -70.785 -180.000 -109.215 0.498 0.375 1 (A 42 C |A 43 N |A 43 CA |A 43 C ) -70.785 -36.000 34.785 0.150 0.075 5 (A 42 C |A 43 N |A 43 CA |A 43 CB ) 167.626 90.000 -77.626 0.763 0.400 2 (A 42 C |A 43 N |A 43 CA |A 43 CB ) 167.626 135.000 -32.626 0.330 0.200 4 (A 42 CB |A 42 CA |A 42 C |A 43 N ) -109.385 -180.000 -70.615 0.334 0.500 1 (A 42 CB |A 42 CA |A 42 C |A 43 N ) -109.385 -60.000 49.385 0.555 0.300 3 (A 42 CB |A 42 CA |A 42 C |A 42 O ) 72.343 180.000 107.657 0.489 0.375 1 (A 42 CB |A 42 CA |A 42 C |A 42 O ) 72.343 108.000 35.657 0.150 0.075 5 (A 43 C |A 44 N |A 44 CA |A 44 C ) -77.052 -180.000 -102.948 0.459 0.375 1 (A 43 C |A 44 N |A 44 CA |A 44 C ) -77.052 -45.000 32.052 0.243 0.150 4 (A 43 C |A 44 N |A 44 CA |A 44 C ) -77.052 -108.000 -30.948 0.143 0.075 5 (A 43 C |A 44 N |A 44 CA |A 44 CB ) 159.715 90.000 -69.715 0.704 0.400 2 (A 43 CB |A 43 CA |A 43 C |A 44 N ) -121.255 -180.000 -58.745 0.241 0.500 1 (A 43 CB |A 43 CA |A 43 C |A 44 N ) -121.255 -90.000 31.255 0.215 0.400 2 (A 43 CB |A 43 CA |A 43 C |A 44 N ) -121.255 -180.000 -58.745 0.599 0.300 3 (A 43 CB |A 43 CA |A 43 C |A 43 O ) 59.851 180.000 120.149 0.563 0.375 1 (A 43 CB |A 43 CA |A 43 C |A 43 O ) 59.851 90.000 30.149 0.151 0.300 2 (A 44 C |A 45 N |A 45 CA |A 45 C ) -66.893 -180.000 -113.107 0.522 0.375 1 (A 44 C |A 45 N |A 45 CA |A 45 C ) -66.893 -36.000 30.893 0.143 0.075 5 (A 44 C |A 45 N |A 45 CA |A 45 CB ) 170.242 90.000 -80.242 0.777 0.400 2 (A 44 C |A 45 N |A 45 CA |A 45 CB ) 170.242 135.000 -35.242 0.355 0.200 4 (A 44 CB |A 44 CA |A 44 C |A 45 N ) 101.366 180.000 78.634 0.401 0.500 1 (A 44 CB |A 44 CA |A 44 C |A 45 N ) 101.366 60.000 -41.366 0.468 0.300 3 (A 44 CB |A 44 CA |A 44 C |A 45 N ) 101.366 135.000 33.634 0.340 0.200 4 (A 44 CB |A 44 CA |A 44 C |A 44 O ) -78.192 -180.000 -101.808 0.452 0.375 1 (A 44 CB |A 44 CA |A 44 C |A 44 O ) -78.192 -45.000 33.192 0.252 0.150 4 (A 45 C |A 46 N |A 46 CA |A 46 C ) -84.697 -180.000 -95.303 0.410 0.375 1 (A 45 C |A 46 N |A 46 CA |A 46 C ) -84.697 -45.000 39.697 0.290 0.150 4 (A 45 C |A 46 N |A 46 CA |A 46 CB ) 154.572 90.000 -64.572 0.653 0.400 2 (A 45 CB |A 45 CA |A 45 C |A 46 N ) 70.247 180.000 109.753 0.669 0.500 1 (A 45 CB |A 45 CA |A 45 C |A 46 N ) 70.247 36.000 -34.247 0.199 0.100 5 (A 45 CB |A 45 CA |A 45 C |A 45 O ) -110.664 -180.000 -69.336 0.243 0.375 1 (A 45 CB |A 45 CA |A 45 C |A 45 O ) -110.664 -60.000 50.664 0.424 0.225 3 (A 46 C |A 47 N |A 47 CA |A 47 C ) 98.103 180.000 81.897 0.322 0.375 1 (A 46 C |A 47 N |A 47 CA |A 47 C ) 98.103 60.000 -38.103 0.318 0.225 3 (A 46 C |A 47 N |A 47 CA |A 47 C ) 98.103 135.000 36.897 0.277 0.150 4 (A 46 CB |A 46 CA |A 46 C |A 47 N ) 85.260 180.000 94.740 0.541 0.500 1 (A 46 CB |A 46 CA |A 46 C |A 47 N ) 85.260 45.000 -40.260 0.389 0.200 4 (A 46 CB |A 46 CA |A 46 C |A 46 O ) -93.219 -180.000 -86.781 0.354 0.375 1 (A 46 CB |A 46 CA |A 46 C |A 46 O ) -93.219 -60.000 33.219 0.263 0.225 3 (A 46 CB |A 46 CA |A 46 C |A 46 O ) -93.219 -135.000 -41.781 0.296 0.150 4 (A 47 C |A 48 N |A 48 CA |A 48 C ) -99.676 -180.000 -80.324 0.312 0.375 1 (A 47 C |A 48 N |A 48 CA |A 48 C ) -99.676 -60.000 39.676 0.334 0.225 3 (A 47 C |A 48 N |A 48 CA |A 48 C ) -99.676 -135.000 -35.324 0.267 0.150 4 (A 47 C |A 48 N |A 48 CA |A 48 CB ) 137.404 180.000 42.596 0.132 0.500 1 (A 47 C |A 48 N |A 48 CA |A 48 CB ) 137.404 90.000 -47.404 0.434 0.400 2 (A 47 C |A 48 N |A 48 CA |A 48 CB ) 137.404 180.000 42.596 0.484 0.300 3 (A 48 CB |A 48 CA |A 48 C |A 49 N ) -89.967 -180.000 -90.033 0.500 0.500 1 (A 48 CB |A 48 CA |A 48 C |A 49 N ) -89.967 -45.000 44.967 0.400 0.200 4 (A 48 CB |A 48 CA |A 48 C |A 48 O ) 89.484 180.000 90.516 0.378 0.375 1 (A 48 CB |A 48 CA |A 48 C |A 48 O ) 89.484 45.000 -44.484 0.300 0.150 4 (A 49 C |A 50 N |A 50 CA |A 50 C ) -78.280 -180.000 -101.720 0.451 0.375 1 (A 49 C |A 50 N |A 50 CA |A 50 C ) -78.280 -45.000 33.280 0.253 0.150 4 (A 49 C |A 50 N |A 50 CA |A 50 CB ) 158.683 90.000 -68.683 0.694 0.400 2 (A 49 CB |A 49 CA |A 49 C |A 50 N ) -93.996 -180.000 -86.004 0.465 0.500 1 (A 49 CB |A 49 CA |A 49 C |A 50 N ) -93.996 -60.000 33.996 0.362 0.300 3 (A 49 CB |A 49 CA |A 49 C |A 50 N ) -93.996 -135.000 -41.004 0.392 0.200 4 (A 49 CB |A 49 CA |A 49 C |A 49 O ) 86.672 180.000 93.328 0.397 0.375 1 (A 49 CB |A 49 CA |A 49 C |A 49 O ) 86.672 45.000 -41.672 0.296 0.150 4 (A 50 C |A 51 N |A 51 CA |A 51 C ) -145.950 -180.000 -34.050 0.064 0.375 1 (A 50 C |A 51 N |A 51 CA |A 51 C ) -145.950 -90.000 55.950 0.412 0.300 2 (A 50 C |A 51 N |A 51 CA |A 51 C ) -145.950 -180.000 -34.050 0.272 0.225 3 (A 50 C |A 51 N |A 51 CA |A 51 C ) -145.950 -180.000 -34.050 0.149 0.075 5 (A 50 C |A 51 N |A 51 CA |A 51 CB ) 93.396 180.000 86.604 0.470 0.500 1 (A 50 C |A 51 N |A 51 CA |A 51 CB ) 93.396 60.000 -33.396 0.353 0.300 3 (A 50 C |A 51 N |A 51 CA |A 51 CB ) 93.396 135.000 41.604 0.394 0.200 4 (A 50 CB |A 50 CA |A 50 C |A 51 N ) -143.262 -180.000 -36.738 0.099 0.500 1 (A 50 CB |A 50 CA |A 50 C |A 51 N ) -143.262 -90.000 53.262 0.514 0.400 2 (A 50 CB |A 50 CA |A 50 C |A 51 N ) -143.262 -180.000 -36.738 0.404 0.300 3 (A 50 CB |A 50 CA |A 50 C |A 51 N ) -143.262 -108.000 35.262 0.200 0.100 5 (A 50 CB |A 50 CA |A 50 C |A 50 O ) 38.099 180.000 141.901 0.670 0.375 1 (A 50 CB |A 50 CA |A 50 C |A 50 O ) 38.099 90.000 51.901 0.372 0.300 2 (A 51 C |A 52 N |A 52 CA |A 52 C ) -106.418 -180.000 -73.582 0.269 0.375 1 (A 51 C |A 52 N |A 52 CA |A 52 C ) -106.418 -60.000 46.418 0.395 0.225 3 (A 51 C |A 52 N |A 52 CA |A 52 CB ) 131.271 180.000 48.729 0.170 0.500 1 (A 51 C |A 52 N |A 52 CA |A 52 CB ) 131.271 90.000 -41.271 0.348 0.400 2 (A 51 C |A 52 N |A 52 CA |A 52 CB ) 131.271 180.000 48.729 0.549 0.300 3 (A 51 CB |A 51 CA |A 51 C |A 52 N ) -113.519 -180.000 -66.481 0.300 0.500 1 (A 51 CB |A 51 CA |A 51 C |A 52 N ) -113.519 -60.000 53.519 0.583 0.300 3 (A 51 CB |A 51 CA |A 51 C |A 51 O ) 66.386 180.000 113.614 0.525 0.375 1 (A 51 CB |A 51 CA |A 51 C |A 51 O ) 66.386 36.000 -30.386 0.141 0.075 5 (A 52 C |A 53 N |A 53 CA |A 53 C ) -83.063 -180.000 -96.937 0.420 0.375 1 (A 52 C |A 53 N |A 53 CA |A 53 C ) -83.063 -45.000 38.063 0.283 0.150 4 (A 52 C |A 53 N |A 53 CA |A 53 CB ) 155.590 90.000 -65.590 0.663 0.400 2 (A 52 CB |A 52 CA |A 52 C |A 53 N ) -129.254 -180.000 -50.746 0.184 0.500 1 (A 52 CB |A 52 CA |A 52 C |A 53 N ) -129.254 -90.000 39.254 0.320 0.400 2 (A 52 CB |A 52 CA |A 52 C |A 53 N ) -129.254 -180.000 -50.746 0.565 0.300 3 (A 52 CB |A 52 CA |A 52 C |A 52 O ) 51.227 180.000 128.773 0.610 0.375 1 (A 52 CB |A 52 CA |A 52 C |A 52 O ) 51.227 90.000 38.773 0.235 0.300 2 (A 53 C |A 54 N |A 54 CA |A 54 C ) -70.270 -180.000 -109.730 0.502 0.375 1 (A 53 C |A 54 N |A 54 CA |A 54 C ) -70.270 -36.000 34.270 0.149 0.075 5 (A 53 C |A 54 N |A 54 CA |A 54 CB ) 165.824 90.000 -75.824 0.752 0.400 2 (A 53 C |A 54 N |A 54 CA |A 54 CB ) 165.824 135.000 -30.824 0.310 0.200 4 (A 53 CB |A 53 CA |A 53 C |A 54 N ) -120.231 -180.000 -59.769 0.248 0.500 1 (A 53 CB |A 53 CA |A 53 C |A 54 N ) -120.231 -90.000 30.231 0.203 0.400 2 (A 53 CB |A 53 CA |A 53 C |A 54 N ) -120.231 -180.000 -59.769 0.600 0.300 3 (A 53 CB |A 53 CA |A 53 C |A 53 O ) 59.818 180.000 120.182 0.564 0.375 1 (A 53 CB |A 53 CA |A 53 C |A 53 O ) 59.818 90.000 30.182 0.152 0.300 2 (A 54 C |A 55 N |A 55 CA |A 55 C ) -89.719 -180.000 -90.281 0.377 0.375 1 (A 54 C |A 55 N |A 55 CA |A 55 C ) -89.719 -45.000 44.719 0.300 0.150 4 (A 54 C |A 55 N |A 55 CA |A 55 CB ) 148.935 180.000 31.065 0.072 0.500 1 (A 54 C |A 55 N |A 55 CA |A 55 CB ) 148.935 90.000 -58.935 0.587 0.400 2 (A 54 C |A 55 N |A 55 CA |A 55 CB ) 148.935 180.000 31.065 0.317 0.300 3 (A 54 C |A 55 N |A 55 CA |A 55 CB ) 148.935 180.000 31.065 0.191 0.100 5 (A 54 CB |A 54 CA |A 54 C |A 55 N ) -130.947 -180.000 -49.053 0.172 0.500 1 (A 54 CB |A 54 CA |A 54 C |A 55 N ) -130.947 -90.000 40.947 0.344 0.400 2 (A 54 CB |A 54 CA |A 54 C |A 55 N ) -130.947 -180.000 -49.053 0.552 0.300 3 (A 54 CB |A 54 CA |A 54 C |A 54 O ) 51.616 180.000 128.384 0.608 0.375 1 (A 54 CB |A 54 CA |A 54 C |A 54 O ) 51.616 90.000 38.384 0.231 0.300 2 (A 55 C |A 56 N |A 56 CA |A 56 C ) -79.864 -180.000 -100.136 0.441 0.375 1 (A 55 C |A 56 N |A 56 CA |A 56 C ) -79.864 -45.000 34.864 0.264 0.150 4 (A 55 C |A 56 N |A 56 CA |A 56 CB ) 157.720 90.000 -67.720 0.685 0.400 2 (A 55 CB |A 55 CA |A 55 C |A 56 N ) -89.769 -180.000 -90.231 0.502 0.500 1 (A 55 CB |A 55 CA |A 55 C |A 56 N ) -89.769 -45.000 44.769 0.400 0.200 4 (A 55 CB |A 55 CA |A 55 C |A 55 O ) 90.364 180.000 89.636 0.373 0.375 1 (A 55 CB |A 55 CA |A 55 C |A 55 O ) 90.364 60.000 -30.364 0.229 0.225 3 (A 55 CB |A 55 CA |A 55 C |A 55 O ) 90.364 135.000 44.636 0.300 0.150 4 (A 57 CZ |A 57 NE |A 57 CD |A 57 CG ) -144.142 -180.000 -35.858 0.379 2.000 1 (A 56 C |A 57 N |A 57 CA |A 57 C ) -70.187 -180.000 -109.813 0.502 0.375 1 (A 56 C |A 57 N |A 57 CA |A 57 C ) -70.187 -36.000 34.187 0.149 0.075 5 (A 56 C |A 57 N |A 57 CA |A 57 CB ) 164.943 90.000 -74.943 0.746 0.400 2 (A 56 CB |A 56 CA |A 56 C |A 57 N ) -112.587 -180.000 -67.413 0.308 0.500 1 (A 56 CB |A 56 CA |A 56 C |A 57 N ) -112.587 -60.000 52.587 0.578 0.300 3 (A 56 CB |A 56 CA |A 56 C |A 56 O ) 67.828 180.000 112.172 0.517 0.375 1 (A 56 CB |A 56 CA |A 56 C |A 56 O ) 67.828 36.000 -31.828 0.145 0.075 5 (A 57 C |A 58 N |A 58 CA |A 58 C ) -93.649 -180.000 -86.351 0.351 0.375 1 (A 57 C |A 58 N |A 58 CA |A 58 C ) -93.649 -60.000 33.649 0.268 0.225 3 (A 57 C |A 58 N |A 58 CA |A 58 C ) -93.649 -135.000 -41.351 0.295 0.150 4 (A 57 C |A 58 N |A 58 CA |A 58 CB ) 144.010 180.000 35.990 0.095 0.500 1 (A 57 C |A 58 N |A 58 CA |A 58 CB ) 144.010 90.000 -54.010 0.524 0.400 2 (A 57 C |A 58 N |A 58 CA |A 58 CB ) 144.010 180.000 35.990 0.393 0.300 3 (A 57 C |A 58 N |A 58 CA |A 58 CB ) 144.010 180.000 35.990 0.200 0.100 5 (A 57 CB |A 57 CA |A 57 C |A 58 N ) 102.227 180.000 77.773 0.394 0.500 1 (A 57 CB |A 57 CA |A 57 C |A 58 N ) 102.227 60.000 -42.227 0.479 0.300 3 (A 57 CB |A 57 CA |A 57 C |A 58 N ) 102.227 135.000 32.773 0.331 0.200 4 (A 57 CB |A 57 CA |A 57 C |A 57 O ) -78.777 -180.000 -101.223 0.448 0.375 1 (A 57 CB |A 57 CA |A 57 C |A 57 O ) -78.777 -45.000 33.777 0.256 0.150 4 (A 58 C |A 59 N |A 59 CA |A 59 C ) -82.692 -180.000 -97.308 0.423 0.375 1 (A 58 C |A 59 N |A 59 CA |A 59 C ) -82.692 -45.000 37.692 0.281 0.150 4 (A 58 C |A 59 N |A 59 CA |A 59 CB ) 154.686 90.000 -64.686 0.654 0.400 2 (A 58 CB |A 58 CA |A 58 C |A 59 N ) 63.547 180.000 116.453 0.723 0.500 1 (A 58 CB |A 58 CA |A 58 C |A 58 O ) -117.827 -180.000 -62.173 0.200 0.375 1 (A 58 CB |A 58 CA |A 58 C |A 58 O ) -117.827 -60.000 57.827 0.449 0.225 3 (A 59 C |A 60 N |A 60 CA |A 60 C ) 78.786 180.000 101.214 0.448 0.375 1 (A 59 C |A 60 N |A 60 CA |A 60 C ) 78.786 45.000 -33.786 0.256 0.150 4 (A 59 CB |A 59 CA |A 59 C |A 60 N ) 104.471 180.000 75.529 0.375 0.500 1 (A 59 CB |A 59 CA |A 59 C |A 60 N ) 104.471 60.000 -44.471 0.506 0.300 3 (A 59 CB |A 59 CA |A 59 C |A 60 N ) 104.471 135.000 30.529 0.306 0.200 4 (A 59 CB |A 59 CA |A 59 C |A 59 O ) -74.381 -180.000 -105.619 0.476 0.375 1 (A 59 CB |A 59 CA |A 59 C |A 59 O ) -74.381 -108.000 -33.619 0.148 0.075 5 (A 60 C |A 61 N |A 61 CA |A 61 C ) -101.858 -180.000 -78.142 0.298 0.375 1 (A 60 C |A 61 N |A 61 CA |A 61 C ) -101.858 -60.000 41.858 0.356 0.225 3 (A 60 C |A 61 N |A 61 CA |A 61 C ) -101.858 -135.000 -33.142 0.251 0.150 4 (A 60 C |A 61 N |A 61 CA |A 61 CB ) 135.694 180.000 44.306 0.142 0.500 1 (A 60 C |A 61 N |A 61 CA |A 61 CB ) 135.694 90.000 -45.694 0.410 0.400 2 (A 60 C |A 61 N |A 61 CA |A 61 CB ) 135.694 180.000 44.306 0.504 0.300 3 (A 61 C |A 62 N |A 62 CA |A 62 C ) -65.831 -180.000 -114.169 0.529 0.375 1 (A 61 C |A 62 N |A 62 CA |A 62 CB ) 170.253 90.000 -80.253 0.777 0.400 2 (A 61 C |A 62 N |A 62 CA |A 62 CB ) 170.253 135.000 -35.253 0.355 0.200 4 (A 61 CB |A 61 CA |A 61 C |A 62 N ) -77.176 -180.000 -102.824 0.611 0.500 1 (A 61 CB |A 61 CA |A 61 C |A 62 N ) -77.176 -45.000 32.176 0.325 0.200 4 (A 61 CB |A 61 CA |A 61 C |A 62 N ) -77.176 -108.000 -30.824 0.190 0.100 5 (A 61 CB |A 61 CA |A 61 C |A 61 O ) 101.486 180.000 78.514 0.300 0.375 1 (A 61 CB |A 61 CA |A 61 C |A 61 O ) 101.486 60.000 -41.486 0.352 0.225 3 (A 61 CB |A 61 CA |A 61 C |A 61 O ) 101.486 135.000 33.514 0.254 0.150 4 (A 62 C |A 63 N |A 63 CA |A 63 C ) -66.843 -180.000 -113.157 0.522 0.375 1 (A 62 C |A 63 N |A 63 CA |A 63 C ) -66.843 -36.000 30.843 0.143 0.075 5 (A 62 C |A 63 N |A 63 CA |A 63 CB ) 171.191 90.000 -81.191 0.781 0.400 2 (A 62 C |A 63 N |A 63 CA |A 63 CB ) 171.191 135.000 -36.191 0.363 0.200 4 (A 62 CB |A 62 CA |A 62 C |A 63 N ) -110.466 -180.000 -69.534 0.325 0.500 1 (A 62 CB |A 62 CA |A 62 C |A 63 N ) -110.466 -60.000 50.466 0.563 0.300 3 (A 62 CB |A 62 CA |A 62 C |A 62 O ) 69.271 180.000 110.729 0.508 0.375 1 (A 62 CB |A 62 CA |A 62 C |A 62 O ) 69.271 36.000 -33.271 0.148 0.075 5 (A 63 C |A 64 N |A 64 CA |A 64 C ) 85.379 180.000 94.621 0.405 0.375 1 (A 63 C |A 64 N |A 64 CA |A 64 C ) 85.379 45.000 -40.379 0.292 0.150 4 (A 63 CB |A 63 CA |A 63 C |A 64 N ) 105.638 180.000 74.362 0.365 0.500 1 (A 63 CB |A 63 CA |A 63 C |A 64 N ) 105.638 60.000 -45.638 0.519 0.300 3 (A 63 CB |A 63 CA |A 63 C |A 63 O ) -74.874 -180.000 -105.126 0.473 0.375 1 (A 63 CB |A 63 CA |A 63 C |A 63 O ) -74.874 -108.000 -33.126 0.148 0.075 5 (A 64 C |A 65 N |A 65 CA |A 65 C ) -133.199 -180.000 -46.801 0.118 0.375 1 (A 64 C |A 65 N |A 65 CA |A 65 C ) -133.199 -90.000 43.199 0.281 0.300 2 (A 64 C |A 65 N |A 65 CA |A 65 C ) -133.199 -180.000 -46.801 0.398 0.225 3 (A 64 C |A 65 N |A 65 CA |A 65 CB ) 103.955 180.000 76.045 0.379 0.500 1 (A 64 C |A 65 N |A 65 CA |A 65 CB ) 103.955 60.000 -43.955 0.500 0.300 3 (A 64 C |A 65 N |A 65 CA |A 65 CB ) 103.955 135.000 31.045 0.312 0.200 4 (A 65 C |A 66 N |A 66 CA |A 66 C ) -163.758 -90.000 73.758 0.553 0.300 2 (A 65 C |A 66 N |A 66 CA |A 66 CB ) 73.367 180.000 106.633 0.643 0.500 1 (A 65 C |A 66 N |A 66 CA |A 66 CB ) 73.367 108.000 34.633 0.199 0.100 5 (A 65 CB |A 65 CA |A 65 C |A 66 N ) -87.668 -180.000 -92.332 0.520 0.500 1 (A 65 CB |A 65 CA |A 65 C |A 66 N ) -87.668 -45.000 42.668 0.397 0.200 4 (A 65 CB |A 65 CA |A 65 C |A 65 O ) 93.667 180.000 86.333 0.351 0.375 1 (A 65 CB |A 65 CA |A 65 C |A 65 O ) 93.667 60.000 -33.667 0.268 0.225 3 (A 65 CB |A 65 CA |A 65 C |A 65 O ) 93.667 135.000 41.333 0.295 0.150 4 (A 66 C |A 67 N |A 67 CA |A 67 C ) -117.170 -180.000 -62.830 0.204 0.375 1 (A 66 C |A 67 N |A 67 CA |A 67 C ) -117.170 -60.000 57.170 0.448 0.225 3 (A 66 C |A 67 N |A 67 CA |A 67 CB ) 119.199 180.000 60.801 0.256 0.500 1 (A 66 C |A 67 N |A 67 CA |A 67 CB ) 119.199 60.000 -59.199 0.600 0.300 3 (A 66 CB |A 66 CA |A 66 C |A 67 N ) -78.913 -180.000 -101.087 0.596 0.500 1 (A 66 CB |A 66 CA |A 66 C |A 67 N ) -78.913 -45.000 33.913 0.343 0.200 4 (A 66 CB |A 66 CA |A 66 C |A 66 O ) 100.190 180.000 79.810 0.309 0.375 1 (A 66 CB |A 66 CA |A 66 C |A 66 O ) 100.190 60.000 -40.190 0.339 0.225 3 (A 66 CB |A 66 CA |A 66 C |A 66 O ) 100.190 135.000 34.810 0.264 0.150 4 (A 67 C |A 68 N |A 68 CA |A 68 C ) -103.504 -180.000 -76.496 0.287 0.375 1 (A 67 C |A 68 N |A 68 CA |A 68 C ) -103.504 -60.000 43.504 0.371 0.225 3 (A 67 C |A 68 N |A 68 CA |A 68 C ) -103.504 -135.000 -31.496 0.238 0.150 4 (A 67 C |A 68 N |A 68 CA |A 68 CB ) 135.664 180.000 44.336 0.142 0.500 1 (A 67 C |A 68 N |A 68 CA |A 68 CB ) 135.664 90.000 -45.664 0.409 0.400 2 (A 67 C |A 68 N |A 68 CA |A 68 CB ) 135.664 180.000 44.336 0.505 0.300 3 (A 67 CB |A 67 CA |A 67 C |A 68 N ) -117.979 -180.000 -62.021 0.265 0.500 1 (A 67 CB |A 67 CA |A 67 C |A 68 N ) -117.979 -60.000 57.979 0.598 0.300 3 (A 67 CB |A 67 CA |A 67 C |A 67 O ) 61.010 180.000 118.990 0.557 0.375 1 (A 68 C |A 69 N |A 69 CA |A 69 C ) -85.873 -180.000 -94.127 0.402 0.375 1 (A 68 C |A 69 N |A 69 CA |A 69 C ) -85.873 -45.000 40.873 0.294 0.150 4 (A 68 C |A 69 N |A 69 CA |A 69 CB ) 151.739 90.000 -61.739 0.621 0.400 2 (A 68 CB |A 68 CA |A 68 C |A 69 N ) -126.496 -180.000 -53.504 0.203 0.500 1 (A 68 CB |A 68 CA |A 68 C |A 69 N ) -126.496 -90.000 36.496 0.283 0.400 2 (A 68 CB |A 68 CA |A 68 C |A 69 N ) -126.496 -180.000 -53.504 0.583 0.300 3 (A 68 CB |A 68 CA |A 68 C |A 68 O ) 53.547 180.000 126.453 0.598 0.375 1 (A 68 CB |A 68 CA |A 68 C |A 68 O ) 53.547 90.000 36.453 0.212 0.300 2 (A 69 C |A 70 N |A 70 CA |A 70 C ) -76.366 -180.000 -103.634 0.463 0.375 1 (A 69 C |A 70 N |A 70 CA |A 70 C ) -76.366 -45.000 31.366 0.237 0.150 4 (A 69 C |A 70 N |A 70 CA |A 70 C ) -76.366 -108.000 -31.634 0.145 0.075 5 (A 69 C |A 70 N |A 70 CA |A 70 CB ) 161.670 90.000 -71.670 0.721 0.400 2 (A 69 CB |A 69 CA |A 69 C |A 70 N ) -134.120 -180.000 -45.880 0.152 0.500 1 (A 69 CB |A 69 CA |A 69 C |A 70 N ) -134.120 -90.000 44.120 0.388 0.400 2 (A 69 CB |A 69 CA |A 69 C |A 70 N ) -134.120 -180.000 -45.880 0.522 0.300 3 (A 69 CB |A 69 CA |A 69 C |A 69 O ) 47.790 180.000 132.210 0.627 0.375 1 (A 69 CB |A 69 CA |A 69 C |A 69 O ) 47.790 90.000 42.210 0.271 0.300 2 (A 70 C |A 71 N |A 71 CA |A 71 C ) -74.698 -180.000 -105.302 0.474 0.375 1 (A 70 C |A 71 N |A 71 CA |A 71 C ) -74.698 -108.000 -33.302 0.148 0.075 5 (A 70 C |A 71 N |A 71 CA |A 71 CB ) 162.639 90.000 -72.639 0.729 0.400 2 (A 70 CB |A 70 CA |A 70 C |A 71 N ) -72.434 -180.000 -107.566 0.651 0.500 1 (A 70 CB |A 70 CA |A 70 C |A 71 N ) -72.434 -108.000 -35.566 0.200 0.100 5 (A 70 CB |A 70 CA |A 70 C |A 70 O ) 108.196 180.000 71.804 0.258 0.375 1 (A 70 CB |A 70 CA |A 70 C |A 70 O ) 108.196 60.000 -48.196 0.408 0.225 3 (A 71 C |A 72 N |A 72 CA |A 72 C ) -107.902 -180.000 -72.098 0.260 0.375 1 (A 71 C |A 72 N |A 72 CA |A 72 C ) -107.902 -60.000 47.902 0.406 0.225 3 (A 71 C |A 72 N |A 72 CA |A 72 CB ) 130.904 180.000 49.096 0.173 0.500 1 (A 71 C |A 72 N |A 72 CA |A 72 CB ) 130.904 90.000 -40.904 0.343 0.400 2 (A 71 C |A 72 N |A 72 CA |A 72 CB ) 130.904 180.000 49.096 0.552 0.300 3 (A 71 CB |A 71 CA |A 71 C |A 72 N ) 81.245 180.000 98.755 0.576 0.500 1 (A 71 CB |A 71 CA |A 71 C |A 72 N ) 81.245 45.000 -36.245 0.364 0.200 4 (A 71 CB |A 71 CA |A 71 C |A 71 O ) -100.105 -180.000 -79.895 0.309 0.375 1 (A 71 CB |A 71 CA |A 71 C |A 71 O ) -100.105 -60.000 40.105 0.339 0.225 3 (A 71 CB |A 71 CA |A 71 C |A 71 O ) -100.105 -135.000 -34.895 0.264 0.150 4 (A 72 CB |A 72 CA |A 72 C |A 73 N ) -108.755 -180.000 -71.245 0.339 0.500 1 (A 72 CB |A 72 CA |A 72 C |A 73 N ) -108.755 -60.000 48.755 0.549 0.300 3 (A 72 CB |A 72 CA |A 72 C |A 72 O ) 71.687 180.000 108.313 0.493 0.375 1 (A 72 CB |A 72 CA |A 72 C |A 72 O ) 71.687 36.000 -35.687 0.150 0.075 5 (A 73 CB |A 73 CA |A 73 C |A 74 N ) 81.917 180.000 98.083 0.570 0.500 1 (A 73 CB |A 73 CA |A 73 C |A 74 N ) 81.917 45.000 -36.917 0.369 0.200 4 (A 73 CB |A 73 CA |A 73 C |A 73 O ) -96.734 -180.000 -83.266 0.331 0.375 1 (A 73 CB |A 73 CA |A 73 C |A 73 O ) -96.734 -60.000 36.734 0.303 0.225 3 (A 73 CB |A 73 CA |A 73 C |A 73 O ) -96.734 -135.000 -38.266 0.284 0.150 4 (A 74 C |A 75 N |A 75 CA |A 75 C ) -72.851 -180.000 -107.149 0.486 0.375 1 (A 74 C |A 75 N |A 75 CA |A 75 C ) -72.851 -108.000 -35.149 0.150 0.075 5 (A 74 C |A 75 N |A 75 CA |A 75 CB ) 165.345 90.000 -75.345 0.749 0.400 2 (A 74 C |A 75 N |A 75 CA |A 75 CB ) 165.345 135.000 -30.345 0.304 0.200 4 (A 74 CB |A 74 CA |A 74 C |A 75 N ) 89.740 180.000 90.260 0.502 0.500 1 (A 74 CB |A 74 CA |A 74 C |A 75 N ) 89.740 45.000 -44.740 0.400 0.200 4 (A 74 CB |A 74 CA |A 74 C |A 74 O ) -91.257 -180.000 -88.743 0.367 0.375 1 (A 74 CB |A 74 CA |A 74 C |A 74 O ) -91.257 -60.000 31.257 0.240 0.225 3 (A 74 CB |A 74 CA |A 74 C |A 74 O ) -91.257 -135.000 -43.743 0.299 0.150 4 (A 75 C |A 76 N |A 76 CA |A 76 C ) -59.529 -180.000 -120.471 0.565 0.375 1 (A 75 C |A 76 N |A 76 CA |A 76 C ) -59.529 -90.000 -30.471 0.154 0.300 2 (A 75 C |A 76 N |A 76 CA |A 76 CB ) 177.796 90.000 -87.796 0.799 0.400 2 (A 75 C |A 76 N |A 76 CA |A 76 CB ) 177.796 135.000 -42.796 0.398 0.200 4 (A 75 CB |A 75 CA |A 75 C |A 76 N ) 83.764 180.000 96.236 0.554 0.500 1 (A 75 CB |A 75 CA |A 75 C |A 76 N ) 83.764 45.000 -38.764 0.381 0.200 4 (A 75 CB |A 75 CA |A 75 C |A 75 O ) -97.247 -180.000 -82.753 0.328 0.375 1 (A 75 CB |A 75 CA |A 75 C |A 75 O ) -97.247 -60.000 37.247 0.308 0.225 3 (A 75 CB |A 75 CA |A 75 C |A 75 O ) -97.247 -135.000 -37.753 0.281 0.150 4 (A 77 CD |A 77 CG |A 77 CB |A 77 CA ) -93.952 -60.000 33.952 2.411 2.000 3 (A 76 C |A 77 N |A 77 CA |A 77 C ) -64.191 -180.000 -115.809 0.538 0.375 1 (A 76 C |A 77 N |A 77 CA |A 77 CB ) 171.825 90.000 -81.825 0.784 0.400 2 (A 76 C |A 77 N |A 77 CA |A 77 CB ) 171.825 135.000 -36.825 0.368 0.200 4 (A 76 CB |A 76 CA |A 76 C |A 77 N ) 69.709 180.000 110.291 0.673 0.500 1 (A 76 CB |A 76 CA |A 76 C |A 77 N ) 69.709 36.000 -33.709 0.198 0.100 5 (A 76 CB |A 76 CA |A 76 C |A 76 O ) -113.459 -180.000 -66.541 0.226 0.375 1 (A 76 CB |A 76 CA |A 76 C |A 76 O ) -113.459 -60.000 53.459 0.437 0.225 3 (A 77 C |A 78 N |A 78 CA |A 78 C ) -61.266 -180.000 -118.734 0.555 0.375 1 (A 77 C |A 78 N |A 78 CA |A 78 CB ) 174.478 90.000 -84.478 0.793 0.400 2 (A 77 C |A 78 N |A 78 CA |A 78 CB ) 174.478 135.000 -39.478 0.385 0.200 4 (A 77 CB |A 77 CA |A 77 C |A 78 N ) 79.801 180.000 100.199 0.589 0.500 1 (A 77 CB |A 77 CA |A 77 C |A 78 N ) 79.801 45.000 -34.801 0.351 0.200 4 (A 77 CB |A 77 CA |A 77 C |A 77 O ) -99.123 -180.000 -80.877 0.316 0.375 1 (A 77 CB |A 77 CA |A 77 C |A 77 O ) -99.123 -60.000 39.123 0.328 0.225 3 (A 77 CB |A 77 CA |A 77 C |A 77 O ) -99.123 -135.000 -35.877 0.271 0.150 4 (A 78 C |A 79 N |A 79 CA |A 79 C ) -63.515 -180.000 -116.485 0.542 0.375 1 (A 78 C |A 79 N |A 79 CA |A 79 CB ) 172.573 90.000 -82.573 0.787 0.400 2 (A 78 C |A 79 N |A 79 CA |A 79 CB ) 172.573 135.000 -37.573 0.374 0.200 4 (A 78 CB |A 78 CA |A 78 C |A 79 N ) 82.933 180.000 97.067 0.562 0.500 1 (A 78 CB |A 78 CA |A 78 C |A 79 N ) 82.933 45.000 -37.933 0.376 0.200 4 (A 78 CB |A 78 CA |A 78 C |A 78 O ) -99.048 -180.000 -80.952 0.316 0.375 1 (A 78 CB |A 78 CA |A 78 C |A 78 O ) -99.048 -60.000 39.048 0.328 0.225 3 (A 78 CB |A 78 CA |A 78 C |A 78 O ) -99.048 -135.000 -35.952 0.271 0.150 4 (A 79 C |A 80 N |A 80 CA |A 80 C ) -62.291 -180.000 -117.709 0.549 0.375 1 (A 79 C |A 80 N |A 80 CA |A 80 CB ) 174.946 90.000 -84.946 0.794 0.400 2 (A 79 C |A 80 N |A 80 CA |A 80 CB ) 174.946 135.000 -39.946 0.388 0.200 4 (A 79 CB |A 79 CA |A 79 C |A 80 N ) 93.377 180.000 86.623 0.471 0.500 1 (A 79 CB |A 79 CA |A 79 C |A 80 N ) 93.377 60.000 -33.377 0.353 0.300 3 (A 79 CB |A 79 CA |A 79 C |A 80 N ) 93.377 135.000 41.623 0.394 0.200 4 (A 79 CB |A 79 CA |A 79 C |A 79 O ) -86.293 -180.000 -93.707 0.399 0.375 1 (A 79 CB |A 79 CA |A 79 C |A 79 O ) -86.293 -45.000 41.293 0.295 0.150 4 (A 80 C |A 81 N |A 81 CA |A 81 C ) -57.062 -180.000 -122.938 0.579 0.375 1 (A 80 C |A 81 N |A 81 CA |A 81 C ) -57.062 -90.000 -32.938 0.177 0.300 2 (A 80 C |A 81 N |A 81 CA |A 81 CB ) 179.820 90.000 -89.820 0.800 0.400 2 (A 80 C |A 81 N |A 81 CA |A 81 CB ) 179.820 135.000 -44.820 0.400 0.200 4 (A 80 CB |A 80 CA |A 80 C |A 81 N ) 61.949 180.000 118.051 0.735 0.500 1 (A 80 CB |A 80 CA |A 80 C |A 80 O ) -120.740 -180.000 -59.260 0.183 0.375 1 (A 80 CB |A 80 CA |A 80 C |A 80 O ) -120.740 -90.000 30.740 0.157 0.300 2 (A 80 CB |A 80 CA |A 80 C |A 80 O ) -120.740 -180.000 -59.260 0.450 0.225 3 (A 81 C |A 82 N |A 82 CA |A 82 C ) -77.935 -180.000 -102.065 0.453 0.375 1 (A 81 C |A 82 N |A 82 CA |A 82 C ) -77.935 -45.000 32.935 0.250 0.150 4 (A 81 C |A 82 N |A 82 CA |A 82 C ) -77.935 -108.000 -30.065 0.140 0.075 5 (A 81 C |A 82 N |A 82 CA |A 82 CB ) 159.598 90.000 -69.598 0.703 0.400 2 (A 81 CB |A 81 CA |A 81 C |A 82 N ) 87.889 180.000 92.111 0.518 0.500 1 (A 81 CB |A 81 CA |A 81 C |A 82 N ) 87.889 45.000 -42.889 0.398 0.200 4 (A 81 CB |A 81 CA |A 81 C |A 81 O ) -93.688 -180.000 -86.312 0.351 0.375 1 (A 81 CB |A 81 CA |A 81 C |A 81 O ) -93.688 -60.000 33.688 0.268 0.225 3 (A 81 CB |A 81 CA |A 81 C |A 81 O ) -93.688 -135.000 -41.312 0.295 0.150 4 (A 82 C |A 83 N |A 83 CA |A 83 C ) -92.589 -180.000 -87.411 0.358 0.375 1 (A 82 C |A 83 N |A 83 CA |A 83 C ) -92.589 -60.000 32.589 0.255 0.225 3 (A 82 C |A 83 N |A 83 CA |A 83 C ) -92.589 -135.000 -42.411 0.298 0.150 4 (A 82 C |A 83 N |A 83 CA |A 83 CB ) 143.349 180.000 36.651 0.099 0.500 1 (A 82 C |A 83 N |A 83 CA |A 83 CB ) 143.349 90.000 -53.349 0.515 0.400 2 (A 82 C |A 83 N |A 83 CA |A 83 CB ) 143.349 180.000 36.651 0.402 0.300 3 (A 82 C |A 83 N |A 83 CA |A 83 CB ) 143.349 108.000 -35.349 0.200 0.100 5 (A 82 CB |A 82 CA |A 82 C |A 83 N ) 66.783 180.000 113.217 0.697 0.500 1 (A 82 CB |A 82 CA |A 82 C |A 83 N ) 66.783 36.000 -30.783 0.190 0.100 5 (A 82 CB |A 82 CA |A 82 C |A 82 O ) -112.894 -180.000 -67.106 0.229 0.375 1 (A 82 CB |A 82 CA |A 82 C |A 82 O ) -112.894 -60.000 52.894 0.435 0.225 3 (A 83 C |A 84 N |A 84 CA |A 84 C ) -64.501 -180.000 -115.499 0.536 0.375 1 (A 83 C |A 84 N |A 84 CA |A 84 CB ) 171.616 90.000 -81.616 0.783 0.400 2 (A 83 C |A 84 N |A 84 CA |A 84 CB ) 171.616 135.000 -36.616 0.367 0.200 4 (A 83 CB |A 83 CA |A 83 C |A 84 N ) 111.433 180.000 68.567 0.317 0.500 1 (A 83 CB |A 83 CA |A 83 C |A 84 N ) 111.433 60.000 -51.433 0.570 0.300 3 (A 83 CB |A 83 CA |A 83 C |A 83 O ) -67.234 -180.000 -112.766 0.520 0.375 1 (A 83 CB |A 83 CA |A 83 C |A 83 O ) -67.234 -36.000 31.234 0.144 0.075 5 (A 84 C |A 85 N |A 85 CA |A 85 C ) 82.289 180.000 97.711 0.425 0.375 1 (A 84 C |A 85 N |A 85 CA |A 85 C ) 82.289 45.000 -37.289 0.279 0.150 4 (A 84 CB |A 84 CA |A 84 C |A 85 N ) -110.050 -180.000 -69.950 0.329 0.500 1 (A 84 CB |A 84 CA |A 84 C |A 85 N ) -110.050 -60.000 50.050 0.560 0.300 3 (A 84 CB |A 84 CA |A 84 C |A 84 O ) 71.406 180.000 108.594 0.495 0.375 1 (A 84 CB |A 84 CA |A 84 C |A 84 O ) 71.406 36.000 -35.406 0.150 0.075 5 (A 85 C |A 86 N |A 86 CA |A 86 C ) -92.040 -180.000 -87.960 0.362 0.375 1 (A 85 C |A 86 N |A 86 CA |A 86 C ) -92.040 -60.000 32.040 0.249 0.225 3 (A 85 C |A 86 N |A 86 CA |A 86 C ) -92.040 -135.000 -42.960 0.298 0.150 4 (A 85 C |A 86 N |A 86 CA |A 86 CB ) 144.686 180.000 35.314 0.092 0.500 1 (A 85 C |A 86 N |A 86 CA |A 86 CB ) 144.686 90.000 -54.686 0.533 0.400 2 (A 85 C |A 86 N |A 86 CA |A 86 CB ) 144.686 180.000 35.314 0.382 0.300 3 (A 85 C |A 86 N |A 86 CA |A 86 CB ) 144.686 180.000 35.314 0.200 0.100 5 (A 86 C |A 87 N |A 87 CA |A 87 C ) -125.185 -180.000 -54.815 0.159 0.375 1 (A 86 C |A 87 N |A 87 CA |A 87 C ) -125.185 -90.000 35.185 0.199 0.300 2 (A 86 C |A 87 N |A 87 CA |A 87 C ) -125.185 -180.000 -54.815 0.442 0.225 3 (A 86 C |A 87 N |A 87 CA |A 87 CB ) 112.405 180.000 67.595 0.309 0.500 1 (A 86 C |A 87 N |A 87 CA |A 87 CB ) 112.405 60.000 -52.405 0.577 0.300 3 (A 86 CB |A 86 CA |A 86 C |A 87 N ) -44.877 -180.000 -135.123 0.854 0.500 1 (A 86 CB |A 86 CA |A 86 C |A 87 N ) -44.877 -90.000 -45.123 0.402 0.400 2 (A 86 CB |A 86 CA |A 86 C |A 86 O ) 136.915 180.000 43.085 0.101 0.375 1 (A 86 CB |A 86 CA |A 86 C |A 86 O ) 136.915 90.000 -46.915 0.320 0.300 2 (A 86 CB |A 86 CA |A 86 C |A 86 O ) 136.915 180.000 43.085 0.367 0.225 3 (A 87 C |A 88 N |A 88 CA |A 88 C ) -77.371 -180.000 -102.629 0.457 0.375 1 (A 87 C |A 88 N |A 88 CA |A 88 C ) -77.371 -45.000 32.371 0.245 0.150 4 (A 87 C |A 88 N |A 88 CA |A 88 C ) -77.371 -108.000 -30.629 0.142 0.075 5 (A 87 C |A 88 N |A 88 CA |A 88 CB ) 159.425 90.000 -69.425 0.701 0.400 2 (A 87 CB |A 87 CA |A 87 C |A 88 N ) -110.910 -180.000 -69.090 0.322 0.500 1 (A 87 CB |A 87 CA |A 87 C |A 88 N ) -110.910 -60.000 50.910 0.567 0.300 3 (A 87 CB |A 87 CA |A 87 C |A 87 O ) 66.594 180.000 113.406 0.524 0.375 1 (A 87 CB |A 87 CA |A 87 C |A 87 O ) 66.594 36.000 -30.594 0.142 0.075 5 (A 88 C |A 89 N |A 89 CA |A 89 C ) -133.844 -180.000 -46.156 0.115 0.375 1 (A 88 C |A 89 N |A 89 CA |A 89 C ) -133.844 -90.000 43.844 0.288 0.300 2 (A 88 C |A 89 N |A 89 CA |A 89 C ) -133.844 -180.000 -46.156 0.393 0.225 3 (A 88 C |A 89 N |A 89 CA |A 89 CB ) 102.636 180.000 77.364 0.391 0.500 1 (A 88 C |A 89 N |A 89 CA |A 89 CB ) 102.636 60.000 -42.636 0.484 0.300 3 (A 88 C |A 89 N |A 89 CA |A 89 CB ) 102.636 135.000 32.364 0.327 0.200 4 (A 88 CB |A 88 CA |A 88 C |A 89 N ) 52.677 180.000 127.323 0.803 0.500 1 (A 88 CB |A 88 CA |A 88 C |A 89 N ) 52.677 90.000 37.323 0.294 0.400 2 (A 88 CB |A 88 CA |A 88 C |A 88 O ) -126.796 -180.000 -53.204 0.150 0.375 1 (A 88 CB |A 88 CA |A 88 C |A 88 O ) -126.796 -90.000 36.796 0.215 0.300 2 (A 88 CB |A 88 CA |A 88 C |A 88 O ) -126.796 -180.000 -53.204 0.436 0.225 3 (A 89 C |A 90 N |A 90 CA |A 90 C ) 72.415 180.000 107.585 0.488 0.375 1 (A 89 C |A 90 N |A 90 CA |A 90 C ) 72.415 108.000 35.585 0.150 0.075 5 (A 89 CB |A 89 CA |A 89 C |A 90 N ) -161.761 -90.000 71.761 0.722 0.400 2 (A 89 CB |A 89 CA |A 89 C |A 89 O ) 21.873 180.000 158.127 0.723 0.375 1 (A 89 CB |A 89 CA |A 89 C |A 89 O ) 21.873 90.000 68.127 0.517 0.300 2 (A 89 CB |A 89 CA |A 89 C |A 89 O ) 21.873 60.000 38.127 0.318 0.225 3 (A 90 C |A 91 N |A 91 CA |A 91 C ) -128.120 -180.000 -51.880 0.144 0.375 1 (A 90 C |A 91 N |A 91 CA |A 91 C ) -128.120 -90.000 38.120 0.229 0.300 2 (A 90 C |A 91 N |A 91 CA |A 91 C ) -128.120 -180.000 -51.880 0.430 0.225 3 (A 90 C |A 91 N |A 91 CA |A 91 CB ) 108.064 180.000 71.936 0.345 0.500 1 (A 90 C |A 91 N |A 91 CA |A 91 CB ) 108.064 60.000 -48.064 0.543 0.300 3 (A 91 CB |A 91 CA |A 91 C |A 92 N ) -102.124 -180.000 -77.876 0.395 0.500 1 (A 91 CB |A 91 CA |A 91 C |A 92 N ) -102.124 -60.000 42.124 0.478 0.300 3 (A 91 CB |A 91 CA |A 91 C |A 92 N ) -102.124 -135.000 -32.876 0.333 0.200 4 (A 91 CB |A 91 CA |A 91 C |A 91 O ) 78.418 180.000 101.582 0.450 0.375 1 (A 91 CB |A 91 CA |A 91 C |A 91 O ) 78.418 45.000 -33.418 0.254 0.150 4 (A 92 C |A 93 N |A 93 CA |A 93 C ) -123.388 -180.000 -56.612 0.169 0.375 1 (A 92 C |A 93 N |A 93 CA |A 93 C ) -123.388 -90.000 33.388 0.182 0.300 2 (A 92 C |A 93 N |A 93 CA |A 93 C ) -123.388 -180.000 -56.612 0.446 0.225 3 (A 92 C |A 93 N |A 93 CA |A 93 CB ) 113.942 180.000 66.058 0.297 0.500 1 (A 92 C |A 93 N |A 93 CA |A 93 CB ) 113.942 60.000 -53.942 0.585 0.300 3 (A 92 CB |A 92 CA |A 92 C |A 93 N ) -103.263 -180.000 -76.737 0.385 0.500 1 (A 92 CB |A 92 CA |A 92 C |A 93 N ) -103.263 -60.000 43.263 0.492 0.300 3 (A 92 CB |A 92 CA |A 92 C |A 93 N ) -103.263 -135.000 -31.737 0.320 0.200 4 (A 92 CB |A 92 CA |A 92 C |A 92 O ) 75.764 180.000 104.236 0.467 0.375 1 (A 92 CB |A 92 CA |A 92 C |A 92 O ) 75.764 45.000 -30.764 0.232 0.150 4 (A 92 CB |A 92 CA |A 92 C |A 92 O ) 75.764 108.000 32.236 0.146 0.075 5 (A 93 C |A 94 N |A 94 CA |A 94 C ) -118.780 -180.000 -61.220 0.194 0.375 1 (A 93 C |A 94 N |A 94 CA |A 94 C ) -118.780 -60.000 58.780 0.450 0.225 3 (A 93 C |A 94 N |A 94 CA |A 94 CB ) 119.615 180.000 60.385 0.253 0.500 1 (A 93 C |A 94 N |A 94 CA |A 94 CB ) 119.615 60.000 -59.615 0.600 0.300 3 (A 93 CB |A 93 CA |A 93 C |A 94 N ) -84.189 -180.000 -95.811 0.551 0.500 1 (A 93 CB |A 93 CA |A 93 C |A 94 N ) -84.189 -45.000 39.189 0.384 0.200 4 (A 93 CB |A 93 CA |A 93 C |A 93 O ) 95.703 180.000 84.297 0.338 0.375 1 (A 93 CB |A 93 CA |A 93 C |A 93 O ) 95.703 60.000 -35.703 0.291 0.225 3 (A 93 CB |A 93 CA |A 93 C |A 93 O ) 95.703 135.000 39.297 0.288 0.150 4 (A 94 C |A 95 N |A 95 CA |A 95 C ) -112.279 -180.000 -67.721 0.233 0.375 1 (A 94 C |A 95 N |A 95 CA |A 95 C ) -112.279 -60.000 52.279 0.432 0.225 3 (A 94 C |A 95 N |A 95 CA |A 95 CB ) 124.453 180.000 55.547 0.217 0.500 1 (A 94 C |A 95 N |A 95 CA |A 95 CB ) 124.453 90.000 -34.453 0.256 0.400 2 (A 94 C |A 95 N |A 95 CA |A 95 CB ) 124.453 180.000 55.547 0.592 0.300 3 (A 94 CB |A 94 CA |A 94 C |A 95 N ) -116.873 -180.000 -63.127 0.274 0.500 1 (A 94 CB |A 94 CA |A 94 C |A 95 N ) -116.873 -60.000 56.873 0.596 0.300 3 (A 94 CB |A 94 CA |A 94 C |A 94 O ) 62.070 180.000 117.930 0.551 0.375 1 (A 95 C |A 96 N |A 96 CA |A 96 C ) -152.280 -90.000 62.280 0.470 0.300 2 (A 95 C |A 96 N |A 96 CA |A 96 CB ) 86.581 180.000 93.419 0.530 0.500 1 (A 95 C |A 96 N |A 96 CA |A 96 CB ) 86.581 45.000 -41.581 0.394 0.200 4 (A 95 CB |A 95 CA |A 95 C |A 96 N ) -94.778 -180.000 -85.222 0.458 0.500 1 (A 95 CB |A 95 CA |A 95 C |A 96 N ) -94.778 -60.000 34.778 0.374 0.300 3 (A 95 CB |A 95 CA |A 95 C |A 96 N ) -94.778 -135.000 -40.222 0.389 0.200 4 (A 95 CB |A 95 CA |A 95 C |A 95 O ) 86.449 180.000 93.551 0.398 0.375 1 (A 95 CB |A 95 CA |A 95 C |A 95 O ) 86.449 45.000 -41.449 0.295 0.150 4 (A 96 C |A 97 N |A 97 CA |A 97 C ) -73.717 -180.000 -106.283 0.480 0.375 1 (A 96 C |A 97 N |A 97 CA |A 97 C ) -73.717 -108.000 -34.283 0.149 0.075 5 (A 96 C |A 97 N |A 97 CA |A 97 CB ) 164.201 90.000 -74.201 0.741 0.400 2 (A 96 CB |A 96 CA |A 96 C |A 97 N ) -58.482 -180.000 -121.518 0.761 0.500 1 (A 96 CB |A 96 CA |A 96 C |A 97 N ) -58.482 -90.000 -31.518 0.219 0.400 2 (A 96 CB |A 96 CA |A 96 C |A 96 O ) 122.913 180.000 57.087 0.171 0.375 1 (A 96 CB |A 96 CA |A 96 C |A 96 O ) 122.913 90.000 -32.913 0.177 0.300 2 (A 96 CB |A 96 CA |A 96 C |A 96 O ) 122.913 180.000 57.087 0.447 0.225 3 (A 97 C |A 98 N |A 98 CA |A 98 C ) -83.728 -180.000 -96.272 0.416 0.375 1 (A 97 C |A 98 N |A 98 CA |A 98 C ) -83.728 -45.000 38.728 0.286 0.150 4 (A 97 C |A 98 N |A 98 CA |A 98 CB ) 152.619 90.000 -62.619 0.631 0.400 2 (A 97 CB |A 97 CA |A 97 C |A 98 N ) -85.820 -180.000 -94.180 0.536 0.500 1 (A 97 CB |A 97 CA |A 97 C |A 98 N ) -85.820 -45.000 40.820 0.392 0.200 4 (A 97 CB |A 97 CA |A 97 C |A 97 O ) 93.943 180.000 86.057 0.349 0.375 1 (A 97 CB |A 97 CA |A 97 C |A 97 O ) 93.943 60.000 -33.943 0.271 0.225 3 (A 97 CB |A 97 CA |A 97 C |A 97 O ) 93.943 135.000 41.057 0.294 0.150 4 (A 98 C |A 99 N |A 99 CA |A 99 C ) -159.504 -90.000 69.504 0.526 0.300 2 (A 98 C |A 99 N |A 99 CA |A 99 CB ) 75.353 180.000 104.647 0.626 0.500 1 (A 98 C |A 99 N |A 99 CA |A 99 CB ) 75.353 45.000 -30.353 0.304 0.200 4 (A 98 C |A 99 N |A 99 CA |A 99 CB ) 75.353 108.000 32.647 0.196 0.100 5 (A 98 CB |A 98 CA |A 98 C |A 99 N ) -148.049 -180.000 -31.951 0.076 0.500 1 (A 98 CB |A 98 CA |A 98 C |A 99 N ) -148.049 -90.000 58.049 0.576 0.400 2 (A 98 CB |A 98 CA |A 98 C |A 99 N ) -148.049 -180.000 -31.951 0.331 0.300 3 (A 98 CB |A 98 CA |A 98 C |A 99 N ) -148.049 -180.000 -31.951 0.194 0.100 5 (A 98 CB |A 98 CA |A 98 C |A 98 O ) 35.237 180.000 144.763 0.681 0.375 1 (A 98 CB |A 98 CA |A 98 C |A 98 O ) 35.237 90.000 54.763 0.400 0.300 2 The following anisotropies have delta SANI greater than the cutoff: (calc Anis) (obs Anis) (delta Anis) class RDC1 A 17 PHE N A 17 PHE HN -1.702 -4.101 2.399 A 20 GLY N A 20 GLY HN -13.334 -16.496 3.162 A 22 GLY N A 22 GLY HN -5.999 -9.047 3.048 A 25 VAL N A 25 VAL HN -6.642 -9.681 3.039 A 26 THR N A 26 THR HN -12.514 -14.515 2.001 A 37 ILE N A 37 ILE HN -4.082 -6.446 2.364 A 41 LYS N A 41 LYS HN -4.836 -1.378 -3.458 A 46 THR N A 46 THR HN -1.401 -3.977 2.576 A 48 GLN N A 48 GLN HN -9.673 -12.096 2.423 A 58 GLU N A 58 GLU HN -8.225 -6.200 -2.025 A 62 LEU N A 62 LEU HN -2.335 -0.119 -2.216 A 76 ALA N A 76 ALA HN 15.712 19.110 -3.398 A 80 ILE N A 80 ILE HN 16.897 19.766 -2.869 A 84 ASP N A 84 ASP HN 15.117 19.295 -4.178 A 85 GLY N A 85 GLY HN -12.542 -15.636 3.094 The following anisotropies have delta SANI greater than the cutoff: (calc Anis) (obs Anis) (delta Anis) class RDC2 A 20 GLY N A 20 GLY HN 3.706 1.280 2.426 A 21 LEU N A 21 LEU HN -9.999 -7.420 -2.579 A 25 VAL N A 25 VAL HN 6.843 3.831 3.012 A 33 TYR N A 33 TYR HN 5.979 8.169 -2.190 A 35 LYS N A 35 LYS HN 9.492 12.251 -2.759 A 52 ASN N A 52 ASN HN 5.718 3.211 2.507 A 58 GLU N A 58 GLU HN 4.452 0.454 3.998 A 61 LYS N A 61 LYS HN 3.571 6.661 -3.090 A 63 LYS N A 63 LYS HN -15.378 -12.945 -2.433 A 84 ASP N A 84 ASP HN 6.342 8.528 -2.186 overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,sani energies: 491.557, 333.03, 295.176, 83.9795, 437.182, -705.338, -30.1345, 14.5896, 3.76258, 59.3099