NBONDS: found 117521 intra-atom interactions ++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ +++++++++++++++++++++++++++++++ CLASS DIST +++++++++++++++++++++++++++++++++++ for this class: SCALe= 50.000 AVERage=sum POTEntial=soft-square SQCOnstant= 1.000 SQEXponent= 2 SQOFfsets(+/-)= 0.000 0.000 SOEXponent= 1 RSWItch= 0.500 ASYMptote= 0.100 ========== spectrum 1 restraint 375 ========== set-i-atoms 41 VAL HG21 41 VAL HG22 41 VAL HG23 set-j-atoms 42 ASN HD21 R= 5.339 NOE= 4.62 (- 2.82/+ 0.69) Delta= -0.029 E(NOE)= 0.043 ========== spectrum 1 restraint 620 ========== set-i-atoms 78 ALA HA set-j-atoms 81 TYR HN R= 5.549 NOE= 4.79 (- 2.99/+ 0.72) Delta= -0.039 E(NOE)= 0.075 ========== spectrum 1 restraint 748 ========== set-i-atoms 57 LEU HB2 set-j-atoms 62 LEU HG R= 3.126 NOE= 2.68 (- 0.88/+ 0.40) Delta= -0.046 E(NOE)= 0.108 ========== spectrum 1 restraint 857 ========== set-i-atoms 28 ALA HB1 28 ALA HB2 28 ALA HB3 set-j-atoms 29 LEU HD21 29 LEU HD22 29 LEU HD23 R= 4.092 NOE= 3.53 (- 1.73/+ 0.53) Delta= -0.032 E(NOE)= 0.050 ========== spectrum 1 restraint 869 ========== set-i-atoms 31 MET HG1 set-j-atoms 64 LEU HD21 64 LEU HD22 64 LEU HD23 R= 1.787 NOE= 3.83 (- 2.03/+ 0.57) Delta= 0.013 E(NOE)= 0.009 ========== spectrum 1 restraint 925 ========== set-i-atoms 40 ILE HG21 40 ILE HG22 40 ILE HG23 set-j-atoms 68 ILE HG21 68 ILE HG22 68 ILE HG23 R= 3.646 NOE= 3.15 (- 1.35/+ 0.47) Delta= -0.026 E(NOE)= 0.033 ========== spectrum 1 restraint 933 ========== set-i-atoms 40 ILE HG21 40 ILE HG22 40 ILE HG23 set-j-atoms 48 PHE HE1 48 PHE HE2 R= 1.769 NOE= 3.80 (- 2.00/+ 0.57) Delta= 0.031 E(NOE)= 0.047 ========== spectrum 1 restraint 965 ========== set-i-atoms 43 LEU HB2 set-j-atoms 47 ASP HB1 R= 5.973 NOE= 5.18 (- 3.38/+ 0.78) Delta= -0.013 E(NOE)= 0.008 ========== spectrum 1 restraint 1048 ========== set-i-atoms 54 ARG HD2 set-j-atoms 55 TYR HE1 55 TYR HE2 R= 5.753 NOE= 5.00 (- 3.20/+ 0.75) Delta= -0.003 E(NOE)= 0.001 ========== spectrum 1 restraint 1363 ========== set-i-atoms 46 ASP HA set-j-atoms 49 ASN HB1 R= 5.537 NOE= 4.80 (- 3.00/+ 0.72) Delta= -0.017 E(NOE)= 0.014 ========== spectrum 1 restraint 1510 ========== set-i-atoms 77 ALA HA set-j-atoms 80 ASN HB2 R= 5.286 NOE= 4.57 (- 2.77/+ 0.69) Delta= -0.026 E(NOE)= 0.035 ========== spectrum 1 restraint 1713 ========== set-i-atoms 22 SER HB1 22 SER HB2 set-j-atoms 25 GLU HG1 25 GLU HG2 R= 1.776 NOE= 5.03 (- 3.23/+ 0.75) Delta= 0.024 E(NOE)= 0.029 ========== spectrum 1 restraint 2016 ========== set-i-atoms 81 TYR HD1 81 TYR HD2 set-j-atoms 82 ARG HG1 82 ARG HG2 R= 5.589 NOE= 4.80 (- 3.00/+ 0.72) Delta= -0.069 E(NOE)= 0.238 ========== spectrum 1 restraint 2036 ========== set-i-atoms 86 LEU HN set-j-atoms 86 LEU HD11 86 LEU HD12 86 LEU HD13 86 LEU HD21 86 LEU HD22 86 LEU HD23 R= 1.797 NOE= 5.04 (- 3.24/+ 0.76) Delta= 0.003 E(NOE)= 0.001 NOEPRI: RMS diff. = 0.003, #(violat.> 0.0)= 14 of 2047 NOEs NOEPRI: RMS diff. class DIST = 0.003, #(viol.> 0.0)= 14 of 2047 NOEs ======================================== 46 ASP N 46 ASP CA 46 ASP C 47 ASP N Dihedral= -63.272 Energy= 0.000 C= 1.000 Equil= -42.400 Delta= 0.872 Range= 20.000 Exponent= 2 ======================================== 72 GLY N 72 GLY CA 72 GLY C 73 LYS N Dihedral= -48.991 Energy= 0.000 C= 1.000 Equil= -23.650 Delta= 0.091 Range= 25.250 Exponent= 2 (atom-i |atom-j ) dist. equil. delta energy const. (atom-i |atom-j |atom-k ) angle equil. delta energy const. (atom-i |atom-j |atom-k |atom-L ) angle equil. delta energy const. period ( 15 CA | 15 C | 16 N | 16 CA ) -174.177 180.000 -5.823 1.033 100.000 0 ( 17 CA | 17 C | 18 N | 18 CA ) -173.093 180.000 -6.907 1.453 100.000 0 ( 18 CA | 18 C | 19 N | 19 CA ) -173.986 180.000 -6.014 1.102 100.000 0 ( 21 CA | 21 C | 22 N | 22 CA ) -174.159 180.000 -5.841 1.039 100.000 0 ( 24 CA | 24 C | 25 N | 25 CA ) 171.177 180.000 8.823 2.371 100.000 0 ( 26 CA | 26 C | 27 N | 27 CA ) 174.245 180.000 5.755 1.009 100.000 0 ( 31 CA | 31 C | 32 N | 32 CA ) 173.181 180.000 6.819 1.416 100.000 0 ( 33 CA | 33 C | 34 N | 34 CA ) -173.647 180.000 -6.353 1.229 100.000 0 ( 35 CA | 35 C | 36 N | 36 CA ) -172.864 180.000 -7.136 1.551 100.000 0 ( 41 CA | 41 C | 42 N | 42 CA ) -172.814 180.000 -7.186 1.573 100.000 0 ( 42 CA | 42 C | 43 N | 43 CA ) 174.646 180.000 5.354 0.873 100.000 0 ( 43 CA | 43 C | 44 N | 44 CA ) 170.918 180.000 9.082 2.513 100.000 0 ( 59 CA | 59 C | 60 N | 60 CA ) 174.539 180.000 5.461 0.908 100.000 0 ( 69 CA | 69 C | 70 N | 70 CA ) 174.903 180.000 5.097 0.791 100.000 0 ( 73 CA | 73 C | 74 N | 74 CA ) 170.995 180.000 9.005 2.470 100.000 0 (atom-i |atom-j |atom-k |atom-L ) angle equil. delta energy const. period ( 1 C | 2 N | 2 CA | 2 C ) 73.000 180.000 107.000 0.485 0.375 1 ( 1 C | 2 N | 2 CA | 2 C ) 73.000 108.000 35.000 0.150 0.075 5 ( 1 CB | 1 CA | 1 C | 2 N ) -76.269 -180.000 -103.731 0.619 0.500 1 ( 1 CB | 1 CA | 1 C | 2 N ) -76.269 -45.000 31.269 0.315 0.200 4 ( 1 CB | 1 CA | 1 C | 2 N ) -76.269 -108.000 -31.731 0.193 0.100 5 ( 1 CB | 1 CA | 1 C | 1 O ) 103.483 180.000 76.517 0.288 0.375 1 ( 1 CB | 1 CA | 1 C | 1 O ) 103.483 60.000 -43.483 0.371 0.225 3 ( 1 CB | 1 CA | 1 C | 1 O ) 103.483 135.000 31.517 0.238 0.150 4 ( 3 ND1 | 3 CG | 3 CB | 3 CA ) -113.516 -180.000 -66.484 0.361 0.600 1 ( 2 C | 3 N | 3 CA | 3 C ) -73.406 -180.000 -106.594 0.482 0.375 1 ( 2 C | 3 N | 3 CA | 3 C ) -73.406 -108.000 -34.594 0.149 0.075 5 ( 2 C | 3 N | 3 CA | 3 CB ) 164.582 90.000 -74.582 0.743 0.400 2 ( 4 ND1 | 4 CG | 4 CB | 4 CA ) -113.198 -180.000 -66.802 0.364 0.600 1 ( 3 C | 4 N | 4 CA | 4 C ) -79.600 -180.000 -100.400 0.443 0.375 1 ( 3 C | 4 N | 4 CA | 4 C ) -79.600 -45.000 34.600 0.262 0.150 4 ( 3 C | 4 N | 4 CA | 4 CB ) 157.582 90.000 -67.582 0.684 0.400 2 ( 3 CB | 3 CA | 3 C | 4 N ) -152.490 -90.000 62.490 0.629 0.400 2 ( 3 CB | 3 CA | 3 C | 3 O ) 28.222 180.000 151.778 0.705 0.375 1 ( 3 CB | 3 CA | 3 C | 3 O ) 28.222 90.000 61.778 0.466 0.300 2 ( 3 CB | 3 CA | 3 C | 3 O ) 28.222 60.000 31.778 0.246 0.225 3 ( 5 ND1 | 5 CG | 5 CB | 5 CA ) 102.086 180.000 77.914 0.474 0.600 1 ( 4 C | 5 N | 5 CA | 5 C ) -148.382 -180.000 -31.618 0.056 0.375 1 ( 4 C | 5 N | 5 CA | 5 C ) -148.382 -90.000 58.382 0.435 0.300 2 ( 4 C | 5 N | 5 CA | 5 C ) -148.382 -180.000 -31.618 0.244 0.225 3 ( 4 C | 5 N | 5 CA | 5 C ) -148.382 -180.000 -31.618 0.145 0.075 5 ( 4 C | 5 N | 5 CA | 5 CB ) 89.013 180.000 90.987 0.509 0.500 1 ( 4 C | 5 N | 5 CA | 5 CB ) 89.013 45.000 -44.013 0.400 0.200 4 ( 4 CB | 4 CA | 4 C | 5 N ) 90.820 180.000 89.180 0.493 0.500 1 ( 4 CB | 4 CA | 4 C | 5 N ) 90.820 60.000 -30.820 0.313 0.300 3 ( 4 CB | 4 CA | 4 C | 5 N ) 90.820 135.000 44.180 0.400 0.200 4 ( 4 CB | 4 CA | 4 C | 4 O ) -88.398 -180.000 -91.602 0.385 0.375 1 ( 4 CB | 4 CA | 4 C | 4 O ) -88.398 -45.000 43.398 0.299 0.150 4 ( 6 ND1 | 6 CG | 6 CB | 6 CA ) 80.930 180.000 99.070 0.695 0.600 1 ( 5 C | 6 N | 6 CA | 6 C ) -144.095 -180.000 -35.905 0.071 0.375 1 ( 5 C | 6 N | 6 CA | 6 C ) -144.095 -90.000 54.095 0.394 0.300 2 ( 5 C | 6 N | 6 CA | 6 C ) -144.095 -180.000 -35.905 0.293 0.225 3 ( 5 C | 6 N | 6 CA | 6 C ) -144.095 -180.000 -35.905 0.150 0.075 5 ( 5 C | 6 N | 6 CA | 6 CB ) 93.586 180.000 86.414 0.469 0.500 1 ( 5 C | 6 N | 6 CA | 6 CB ) 93.586 60.000 -33.586 0.356 0.300 3 ( 5 C | 6 N | 6 CA | 6 CB ) 93.586 135.000 41.414 0.394 0.200 4 ( 5 CB | 5 CA | 5 C | 6 N ) -99.878 -180.000 -80.122 0.414 0.500 1 ( 5 CB | 5 CA | 5 C | 6 N ) -99.878 -60.000 39.878 0.448 0.300 3 ( 5 CB | 5 CA | 5 C | 6 N ) -99.878 -135.000 -35.122 0.354 0.200 4 ( 5 CB | 5 CA | 5 C | 5 O ) 80.323 180.000 99.677 0.438 0.375 1 ( 5 CB | 5 CA | 5 C | 5 O ) 80.323 45.000 -35.323 0.267 0.150 4 ( 7 ND1 | 7 CG | 7 CB | 7 CA ) 108.689 180.000 71.311 0.408 0.600 1 ( 6 C | 7 N | 7 CA | 7 C ) -71.552 -180.000 -108.448 0.494 0.375 1 ( 6 C | 7 N | 7 CA | 7 C ) -71.552 -36.000 35.552 0.150 0.075 5 ( 6 C | 7 N | 7 CA | 7 CB ) 165.780 90.000 -75.780 0.752 0.400 2 ( 6 C | 7 N | 7 CA | 7 CB ) 165.780 135.000 -30.780 0.309 0.200 4 ( 6 CB | 6 CA | 6 C | 7 N ) -97.621 -180.000 -82.379 0.434 0.500 1 ( 6 CB | 6 CA | 6 C | 7 N ) -97.621 -60.000 37.621 0.417 0.300 3 ( 6 CB | 6 CA | 6 C | 7 N ) -97.621 -135.000 -37.379 0.372 0.200 4 ( 6 CB | 6 CA | 6 C | 6 O ) 82.379 180.000 97.621 0.425 0.375 1 ( 6 CB | 6 CA | 6 C | 6 O ) 82.379 45.000 -37.379 0.279 0.150 4 ( 8 ND1 | 8 CG | 8 CB | 8 CA ) -80.295 -180.000 -99.705 0.701 0.600 1 ( 7 C | 8 N | 8 CA | 8 C ) -78.429 -180.000 -101.571 0.450 0.375 1 ( 7 C | 8 N | 8 CA | 8 C ) -78.429 -45.000 33.429 0.254 0.150 4 ( 7 C | 8 N | 8 CA | 8 CB ) 159.065 90.000 -69.065 0.698 0.400 2 ( 7 CB | 7 CA | 7 C | 8 N ) -86.269 -180.000 -93.731 0.533 0.500 1 ( 7 CB | 7 CA | 7 C | 8 N ) -86.269 -45.000 41.269 0.393 0.200 4 ( 7 CB | 7 CA | 7 C | 7 O ) 92.911 180.000 87.089 0.356 0.375 1 ( 7 CB | 7 CA | 7 C | 7 O ) 92.911 60.000 -32.911 0.259 0.225 3 ( 7 CB | 7 CA | 7 C | 7 O ) 92.911 135.000 42.089 0.297 0.150 4 ( 8 C | 9 N | 9 CA | 9 C ) -144.441 -180.000 -35.559 0.070 0.375 1 ( 8 C | 9 N | 9 CA | 9 C ) -144.441 -90.000 54.441 0.397 0.300 2 ( 8 C | 9 N | 9 CA | 9 C ) -144.441 -180.000 -35.559 0.290 0.225 3 ( 8 C | 9 N | 9 CA | 9 C ) -144.441 -180.000 -35.559 0.150 0.075 5 ( 8 C | 9 N | 9 CA | 9 CB ) 93.073 180.000 86.927 0.473 0.500 1 ( 8 C | 9 N | 9 CA | 9 CB ) 93.073 60.000 -33.073 0.348 0.300 3 ( 8 C | 9 N | 9 CA | 9 CB ) 93.073 135.000 41.927 0.395 0.200 4 ( 8 CB | 8 CA | 8 C | 9 N ) -59.340 -180.000 -120.660 0.755 0.500 1 ( 8 CB | 8 CA | 8 C | 9 N ) -59.340 -90.000 -30.660 0.208 0.400 2 ( 8 CB | 8 CA | 8 C | 8 O ) 120.579 180.000 59.421 0.184 0.375 1 ( 8 CB | 8 CA | 8 C | 8 O ) 120.579 90.000 -30.579 0.155 0.300 2 ( 8 CB | 8 CA | 8 C | 8 O ) 120.579 180.000 59.421 0.450 0.225 3 ( 10 ND1 | 10 CG | 10 CB | 10 CA ) 89.680 180.000 90.320 0.603 0.600 1 ( 9 C | 10 N | 10 CA | 10 C ) -141.995 -180.000 -38.005 0.080 0.375 1 ( 9 C | 10 N | 10 CA | 10 C ) -141.995 -90.000 51.995 0.373 0.300 2 ( 9 C | 10 N | 10 CA | 10 C ) -141.995 -180.000 -38.005 0.317 0.225 3 ( 9 C | 10 N | 10 CA | 10 C ) -141.995 -108.000 33.995 0.149 0.075 5 ( 9 C | 10 N | 10 CA | 10 CB ) 95.289 180.000 84.711 0.454 0.500 1 ( 9 C | 10 N | 10 CA | 10 CB ) 95.289 60.000 -35.289 0.382 0.300 3 ( 9 C | 10 N | 10 CA | 10 CB ) 95.289 135.000 39.711 0.387 0.200 4 ( 9 CB | 9 CA | 9 C | 10 N ) -106.500 -180.000 -73.500 0.358 0.500 1 ( 9 CB | 9 CA | 9 C | 10 N ) -106.500 -60.000 46.500 0.528 0.300 3 ( 9 CB | 9 CA | 9 C | 9 O ) 73.664 180.000 106.336 0.480 0.375 1 ( 9 CB | 9 CA | 9 C | 9 O ) 73.664 108.000 34.336 0.149 0.075 5 ( 10 C | 11 N | 11 CA | 11 C ) -61.294 -180.000 -118.706 0.555 0.375 1 ( 10 C | 11 N | 11 CA | 11 CB ) 175.940 90.000 -85.940 0.796 0.400 2 ( 10 C | 11 N | 11 CA | 11 CB ) 175.940 135.000 -40.940 0.392 0.200 4 ( 10 CB | 10 CA | 10 C | 11 N ) -79.976 -180.000 -100.024 0.587 0.500 1 ( 10 CB | 10 CA | 10 C | 11 N ) -79.976 -45.000 34.976 0.353 0.200 4 ( 10 CB | 10 CA | 10 C | 10 O ) 99.849 180.000 80.151 0.311 0.375 1 ( 10 CB | 10 CA | 10 C | 10 O ) 99.849 60.000 -39.849 0.336 0.225 3 ( 10 CB | 10 CA | 10 C | 10 O ) 99.849 135.000 35.151 0.266 0.150 4 ( 11 C | 12 N | 12 CA | 12 C ) -150.541 -90.000 60.541 0.455 0.300 2 ( 11 C | 12 N | 12 CA | 12 CB ) 86.645 180.000 93.355 0.529 0.500 1 ( 11 C | 12 N | 12 CA | 12 CB ) 86.645 45.000 -41.645 0.395 0.200 4 ( 11 CB | 11 CA | 11 C | 12 N ) -85.078 -180.000 -94.922 0.543 0.500 1 ( 11 CB | 11 CA | 11 C | 12 N ) -85.078 -45.000 40.078 0.388 0.200 4 ( 11 CB | 11 CA | 11 C | 11 O ) 94.886 180.000 85.114 0.343 0.375 1 ( 11 CB | 11 CA | 11 C | 11 O ) 94.886 60.000 -34.886 0.282 0.225 3 ( 11 CB | 11 CA | 11 C | 11 O ) 94.886 135.000 40.114 0.291 0.150 4 ( 12 C | 13 N | 13 CA | 13 C ) -76.355 -180.000 -103.645 0.463 0.375 1 ( 12 C | 13 N | 13 CA | 13 C ) -76.355 -45.000 31.355 0.237 0.150 4 ( 12 C | 13 N | 13 CA | 13 C ) -76.355 -108.000 -31.645 0.145 0.075 5 ( 12 C | 13 N | 13 CA | 13 CB ) 160.131 90.000 -70.131 0.708 0.400 2 ( 12 CB | 12 CA | 12 C | 13 N ) -131.045 -180.000 -48.955 0.172 0.500 1 ( 12 CB | 12 CA | 12 C | 13 N ) -131.045 -90.000 41.045 0.345 0.400 2 ( 12 CB | 12 CA | 12 C | 13 N ) -131.045 -180.000 -48.955 0.551 0.300 3 ( 12 CB | 12 CA | 12 C | 12 O ) 49.625 180.000 130.375 0.618 0.375 1 ( 12 CB | 12 CA | 12 C | 12 O ) 49.625 90.000 40.375 0.252 0.300 2 ( 13 CB | 13 CA | 13 C | 14 N ) -124.357 -180.000 -55.643 0.218 0.500 1 ( 13 CB | 13 CA | 13 C | 14 N ) -124.357 -90.000 34.357 0.255 0.400 2 ( 13 CB | 13 CA | 13 C | 14 N ) -124.357 -180.000 -55.643 0.592 0.300 3 ( 13 CB | 13 CA | 13 C | 13 O ) 56.567 180.000 123.433 0.582 0.375 1 ( 13 CB | 13 CA | 13 C | 13 O ) 56.567 90.000 33.433 0.182 0.300 2 ( 14 C | 15 N | 15 CA | 15 C ) -107.903 -180.000 -72.097 0.260 0.375 1 ( 14 C | 15 N | 15 CA | 15 C ) -107.903 -60.000 47.903 0.406 0.225 3 ( 14 C | 15 N | 15 CA | 15 CB ) 129.985 180.000 50.015 0.179 0.500 1 ( 14 C | 15 N | 15 CA | 15 CB ) 129.985 90.000 -39.985 0.330 0.400 2 ( 14 C | 15 N | 15 CA | 15 CB ) 129.985 180.000 50.015 0.560 0.300 3 ( 14 CB | 14 CA | 14 C | 15 N ) -104.962 -180.000 -75.038 0.371 0.500 1 ( 14 CB | 14 CA | 14 C | 15 N ) -104.962 -60.000 44.962 0.512 0.300 3 ( 14 CB | 14 CA | 14 C | 15 N ) -104.962 -135.000 -30.038 0.300 0.200 4 ( 14 CB | 14 CA | 14 C | 14 O ) 74.849 180.000 105.151 0.473 0.375 1 ( 14 CB | 14 CA | 14 C | 14 O ) 74.849 108.000 33.151 0.148 0.075 5 ( 15 C | 16 N | 16 CA | 16 C ) -97.293 -180.000 -82.707 0.327 0.375 1 ( 15 C | 16 N | 16 CA | 16 C ) -97.293 -60.000 37.293 0.309 0.225 3 ( 15 C | 16 N | 16 CA | 16 C ) -97.293 -135.000 -37.707 0.281 0.150 4 ( 15 C | 16 N | 16 CA | 16 CB ) 139.585 180.000 40.415 0.119 0.500 1 ( 15 C | 16 N | 16 CA | 16 CB ) 139.585 90.000 -49.585 0.464 0.400 2 ( 15 C | 16 N | 16 CA | 16 CB ) 139.585 180.000 40.415 0.456 0.300 3 ( 15 C | 16 N | 16 CA | 16 CB ) 139.585 108.000 -31.585 0.193 0.100 5 ( 15 CB | 15 CA | 15 C | 16 N ) -139.018 -180.000 -40.982 0.123 0.500 1 ( 15 CB | 15 CA | 15 C | 16 N ) -139.018 -90.000 49.018 0.456 0.400 2 ( 15 CB | 15 CA | 15 C | 16 N ) -139.018 -180.000 -40.982 0.463 0.300 3 ( 15 CB | 15 CA | 15 C | 16 N ) -139.018 -108.000 31.018 0.191 0.100 5 ( 15 CB | 15 CA | 15 C | 15 O ) 41.352 180.000 138.648 0.656 0.375 1 ( 15 CB | 15 CA | 15 C | 15 O ) 41.352 90.000 48.648 0.338 0.300 2 ( 16 C | 17 N | 17 CA | 17 C ) -135.010 -180.000 -44.990 0.110 0.375 1 ( 16 C | 17 N | 17 CA | 17 C ) -135.010 -90.000 45.010 0.300 0.300 2 ( 16 C | 17 N | 17 CA | 17 C ) -135.010 -180.000 -44.990 0.384 0.225 3 ( 16 C | 17 N | 17 CA | 17 CB ) 101.315 180.000 78.685 0.402 0.500 1 ( 16 C | 17 N | 17 CA | 17 CB ) 101.315 60.000 -41.315 0.468 0.300 3 ( 16 C | 17 N | 17 CA | 17 CB ) 101.315 135.000 33.685 0.341 0.200 4 ( 16 CB | 16 CA | 16 C | 17 N ) 154.728 90.000 -64.728 0.654 0.400 2 ( 16 CB | 16 CA | 16 C | 16 O ) -25.929 -180.000 -154.071 0.712 0.375 1 ( 16 CB | 16 CA | 16 C | 16 O ) -25.929 -90.000 -64.071 0.485 0.300 2 ( 16 CB | 16 CA | 16 C | 16 O ) -25.929 -60.000 -34.071 0.273 0.225 3 ( 17 C | 18 N | 18 CA | 18 C ) 103.725 180.000 76.275 0.286 0.375 1 ( 17 C | 18 N | 18 CA | 18 C ) 103.725 60.000 -43.725 0.373 0.225 3 ( 17 C | 18 N | 18 CA | 18 C ) 103.725 135.000 31.275 0.236 0.150 4 ( 17 CB | 17 CA | 17 C | 18 N ) -55.968 -180.000 -124.032 0.780 0.500 1 ( 17 CB | 17 CA | 17 C | 18 N ) -55.968 -90.000 -34.032 0.251 0.400 2 ( 17 CB | 17 CA | 17 C | 17 O ) 123.783 180.000 56.217 0.166 0.375 1 ( 17 CB | 17 CA | 17 C | 17 O ) 123.783 90.000 -33.783 0.186 0.300 2 ( 17 CB | 17 CA | 17 C | 17 O ) 123.783 180.000 56.217 0.446 0.225 3 ( 18 C | 19 N | 19 CA | 19 C ) -120.755 -180.000 -59.245 0.183 0.375 1 ( 18 C | 19 N | 19 CA | 19 C ) -120.755 -90.000 30.755 0.157 0.300 2 ( 18 C | 19 N | 19 CA | 19 C ) -120.755 -180.000 -59.245 0.450 0.225 3 ( 18 C | 19 N | 19 CA | 19 CB ) 117.260 180.000 62.740 0.271 0.500 1 ( 18 C | 19 N | 19 CA | 19 CB ) 117.260 60.000 -57.260 0.597 0.300 3 ( 19 C | 20 N | 20 CA | 20 C ) -172.180 -90.000 82.180 0.589 0.300 2 ( 19 C | 20 N | 20 CA | 20 C ) -172.180 -135.000 37.180 0.278 0.150 4 ( 19 C | 20 N | 20 CA | 20 CB ) 64.593 180.000 115.407 0.715 0.500 1 ( 19 CB | 19 CA | 19 C | 20 N ) -108.326 -180.000 -71.674 0.343 0.500 1 ( 19 CB | 19 CA | 19 C | 20 N ) -108.326 -60.000 48.326 0.546 0.300 3 ( 19 CB | 19 CA | 19 C | 19 O ) 71.690 180.000 108.310 0.493 0.375 1 ( 19 CB | 19 CA | 19 C | 19 O ) 71.690 36.000 -35.690 0.150 0.075 5 ( 20 C | 21 N | 21 CA | 21 C ) -124.917 -180.000 -55.083 0.160 0.375 1 ( 20 C | 21 N | 21 CA | 21 C ) -124.917 -90.000 34.917 0.197 0.300 2 ( 20 C | 21 N | 21 CA | 21 C ) -124.917 -180.000 -55.083 0.443 0.225 3 ( 20 CB | 20 CA | 20 C | 21 N ) -51.427 -180.000 -128.573 0.812 0.500 1 ( 20 CB | 20 CA | 20 C | 21 N ) -51.427 -90.000 -38.573 0.311 0.400 2 ( 20 CB | 20 CA | 20 C | 20 O ) 128.357 180.000 51.643 0.142 0.375 1 ( 20 CB | 20 CA | 20 C | 20 O ) 128.357 90.000 -38.357 0.231 0.300 2 ( 20 CB | 20 CA | 20 C | 20 O ) 128.357 180.000 51.643 0.429 0.225 3 ( 21 C | 22 N | 22 CA | 22 C ) -59.102 -180.000 -120.898 0.568 0.375 1 ( 21 C | 22 N | 22 CA | 22 C ) -59.102 -90.000 -30.898 0.158 0.300 2 ( 21 C | 22 N | 22 CA | 22 CB ) 178.570 90.000 -88.570 0.800 0.400 2 ( 21 C | 22 N | 22 CA | 22 CB ) 178.570 135.000 -43.570 0.399 0.200 4 ( 22 C | 23 N | 23 CA | 23 C ) -46.745 -180.000 -133.255 0.632 0.375 1 ( 22 C | 23 N | 23 CA | 23 C ) -46.745 -90.000 -43.255 0.282 0.300 2 ( 22 C | 23 N | 23 CA | 23 CB ) -168.727 -90.000 78.727 0.769 0.400 2 ( 22 C | 23 N | 23 CA | 23 CB ) -168.727 -135.000 33.727 0.341 0.200 4 ( 22 CB | 22 CA | 22 C | 23 N ) -82.585 -180.000 -97.415 0.565 0.500 1 ( 22 CB | 22 CA | 22 C | 23 N ) -82.585 -45.000 37.585 0.374 0.200 4 ( 22 CB | 22 CA | 22 C | 22 O ) 96.499 180.000 83.501 0.333 0.375 1 ( 22 CB | 22 CA | 22 C | 22 O ) 96.499 60.000 -36.499 0.300 0.225 3 ( 22 CB | 22 CA | 22 C | 22 O ) 96.499 135.000 38.501 0.285 0.150 4 ( 23 C | 24 N | 24 CA | 24 C ) -62.017 -180.000 -117.983 0.551 0.375 1 ( 23 C | 24 N | 24 CA | 24 CB ) 173.309 90.000 -83.309 0.789 0.400 2 ( 23 C | 24 N | 24 CA | 24 CB ) 173.309 135.000 -38.309 0.379 0.200 4 ( 23 CB | 23 CA | 23 C | 24 N ) 60.643 180.000 119.357 0.745 0.500 1 ( 23 CB | 23 CA | 23 C | 23 O ) -119.630 -180.000 -60.370 0.190 0.375 1 ( 23 CB | 23 CA | 23 C | 23 O ) -119.630 -60.000 59.630 0.450 0.225 3 ( 24 C | 25 N | 25 CA | 25 C ) -58.261 -180.000 -121.739 0.572 0.375 1 ( 24 C | 25 N | 25 CA | 25 C ) -58.261 -90.000 -31.739 0.166 0.300 2 ( 24 C | 25 N | 25 CA | 25 CB ) -178.901 -90.000 88.901 0.800 0.400 2 ( 24 C | 25 N | 25 CA | 25 CB ) -178.901 -135.000 43.901 0.399 0.200 4 ( 24 CB | 24 CA | 24 C | 25 N ) 91.079 180.000 88.921 0.491 0.500 1 ( 24 CB | 24 CA | 24 C | 25 N ) 91.079 60.000 -31.079 0.317 0.300 3 ( 24 CB | 24 CA | 24 C | 25 N ) 91.079 135.000 43.921 0.399 0.200 4 ( 24 CB | 24 CA | 24 C | 24 O ) -89.795 -180.000 -90.205 0.376 0.375 1 ( 24 CB | 24 CA | 24 C | 24 O ) -89.795 -45.000 44.795 0.300 0.150 4 ( 26 CZ | 26 NE | 26 CD | 26 CG ) -138.097 -180.000 -41.903 0.511 2.000 1 ( 25 C | 26 N | 26 CA | 26 C ) -66.111 -180.000 -113.889 0.527 0.375 1 ( 25 C | 26 N | 26 CA | 26 C ) -66.111 -36.000 30.111 0.140 0.075 5 ( 25 C | 26 N | 26 CA | 26 CB ) 170.779 90.000 -80.779 0.779 0.400 2 ( 25 C | 26 N | 26 CA | 26 CB ) 170.779 135.000 -35.779 0.360 0.200 4 ( 25 CB | 25 CA | 25 C | 26 N ) 73.284 180.000 106.716 0.644 0.500 1 ( 25 CB | 25 CA | 25 C | 26 N ) 73.284 108.000 34.716 0.199 0.100 5 ( 25 CB | 25 CA | 25 C | 25 O ) -106.910 -180.000 -73.090 0.266 0.375 1 ( 25 CB | 25 CA | 25 C | 25 O ) -106.910 -60.000 46.910 0.399 0.225 3 ( 26 C | 27 N | 27 CA | 27 C ) -60.389 -180.000 -119.611 0.560 0.375 1 ( 26 C | 27 N | 27 CA | 27 CB ) 177.937 90.000 -87.937 0.799 0.400 2 ( 26 C | 27 N | 27 CA | 27 CB ) 177.937 135.000 -42.937 0.398 0.200 4 ( 26 CB | 26 CA | 26 C | 27 N ) 90.694 180.000 89.306 0.494 0.500 1 ( 26 CB | 26 CA | 26 C | 27 N ) 90.694 60.000 -30.694 0.311 0.300 3 ( 26 CB | 26 CA | 26 C | 27 N ) 90.694 135.000 44.306 0.400 0.200 4 ( 26 CB | 26 CA | 26 C | 26 O ) -88.874 -180.000 -91.126 0.382 0.375 1 ( 26 CB | 26 CA | 26 C | 26 O ) -88.874 -45.000 43.874 0.300 0.150 4 ( 27 C | 28 N | 28 CA | 28 C ) -62.119 -180.000 -117.881 0.550 0.375 1 ( 27 C | 28 N | 28 CA | 28 CB ) 174.948 90.000 -84.948 0.794 0.400 2 ( 27 C | 28 N | 28 CA | 28 CB ) 174.948 135.000 -39.948 0.388 0.200 4 ( 27 CB | 27 CA | 27 C | 28 N ) 76.938 180.000 103.062 0.613 0.500 1 ( 27 CB | 27 CA | 27 C | 28 N ) 76.938 45.000 -31.938 0.322 0.200 4 ( 27 CB | 27 CA | 27 C | 28 N ) 76.938 108.000 31.062 0.191 0.100 5 ( 27 CB | 27 CA | 27 C | 27 O ) -103.977 -180.000 -76.023 0.284 0.375 1 ( 27 CB | 27 CA | 27 C | 27 O ) -103.977 -60.000 43.977 0.375 0.225 3 ( 27 CB | 27 CA | 27 C | 27 O ) -103.977 -135.000 -31.023 0.234 0.150 4 ( 28 C | 29 N | 29 CA | 29 C ) -64.681 -180.000 -115.319 0.535 0.375 1 ( 28 C | 29 N | 29 CA | 29 CB ) 170.020 90.000 -80.020 0.776 0.400 2 ( 28 C | 29 N | 29 CA | 29 CB ) 170.020 135.000 -35.020 0.353 0.200 4 ( 28 CB | 28 CA | 28 C | 29 N ) 65.599 180.000 114.401 0.707 0.500 1 ( 28 CB | 28 CA | 28 C | 28 O ) -114.761 -180.000 -65.239 0.218 0.375 1 ( 28 CB | 28 CA | 28 C | 28 O ) -114.761 -60.000 54.761 0.442 0.225 3 ( 29 C | 30 N | 30 CA | 30 C ) -64.296 -180.000 -115.704 0.538 0.375 1 ( 29 C | 30 N | 30 CA | 30 CB ) 172.731 90.000 -82.731 0.787 0.400 2 ( 29 C | 30 N | 30 CA | 30 CB ) 172.731 135.000 -37.731 0.375 0.200 4 ( 29 CB | 29 CA | 29 C | 30 N ) 92.832 180.000 87.168 0.475 0.500 1 ( 29 CB | 29 CA | 29 C | 30 N ) 92.832 60.000 -32.832 0.344 0.300 3 ( 29 CB | 29 CA | 29 C | 30 N ) 92.832 135.000 42.168 0.396 0.200 4 ( 29 CB | 29 CA | 29 C | 29 O ) -88.080 -180.000 -91.920 0.388 0.375 1 ( 29 CB | 29 CA | 29 C | 29 O ) -88.080 -45.000 43.080 0.299 0.150 4 ( 30 C | 31 N | 31 CA | 31 C ) -81.211 -180.000 -98.789 0.432 0.375 1 ( 30 C | 31 N | 31 CA | 31 C ) -81.211 -45.000 36.211 0.273 0.150 4 ( 30 C | 31 N | 31 CA | 31 CB ) 155.618 90.000 -65.618 0.664 0.400 2 ( 30 CB | 30 CA | 30 C | 31 N ) 77.657 180.000 102.343 0.607 0.500 1 ( 30 CB | 30 CA | 30 C | 31 N ) 77.657 45.000 -32.657 0.330 0.200 4 ( 30 CB | 30 CA | 30 C | 31 N ) 77.657 108.000 30.343 0.188 0.100 5 ( 30 CB | 30 CA | 30 C | 30 O ) -102.612 -180.000 -77.388 0.293 0.375 1 ( 30 CB | 30 CA | 30 C | 30 O ) -102.612 -60.000 42.612 0.363 0.225 3 ( 30 CB | 30 CA | 30 C | 30 O ) -102.612 -135.000 -32.388 0.246 0.150 4 ( 31 C | 32 N | 32 CA | 32 C ) 64.413 180.000 115.587 0.537 0.375 1 ( 31 C | 32 N | 32 CA | 32 CB ) -59.995 -180.000 -120.005 0.750 0.500 1 ( 31 C | 32 N | 32 CA | 32 CB ) -59.995 -90.000 -30.005 0.200 0.400 2 ( 31 CB | 31 CA | 31 C | 32 N ) 123.863 180.000 56.137 0.221 0.500 1 ( 31 CB | 31 CA | 31 C | 32 N ) 123.863 90.000 -33.863 0.248 0.400 2 ( 31 CB | 31 CA | 31 C | 32 N ) 123.863 180.000 56.137 0.594 0.300 3 ( 31 CB | 31 CA | 31 C | 31 O ) -55.573 -180.000 -124.427 0.587 0.375 1 ( 31 CB | 31 CA | 31 C | 31 O ) -55.573 -90.000 -34.427 0.192 0.300 2 ( 32 C | 33 N | 33 CA | 33 C ) -67.764 -180.000 -112.236 0.517 0.375 1 ( 32 C | 33 N | 33 CA | 33 C ) -67.764 -36.000 31.764 0.145 0.075 5 ( 32 C | 33 N | 33 CA | 33 CB ) 170.190 90.000 -80.190 0.777 0.400 2 ( 32 C | 33 N | 33 CA | 33 CB ) 170.190 135.000 -35.190 0.355 0.200 4 ( 32 CB | 32 CA | 32 C | 33 N ) 162.765 90.000 -72.765 0.730 0.400 2 ( 32 CB | 32 CA | 32 C | 32 O ) -19.262 -180.000 -160.738 0.729 0.375 1 ( 32 CB | 32 CA | 32 C | 32 O ) -19.262 -90.000 -70.738 0.535 0.300 2 ( 32 CB | 32 CA | 32 C | 32 O ) -19.262 -60.000 -40.738 0.345 0.225 3 ( 33 CB | 33 CA | 33 C | 34 N ) -118.177 -180.000 -61.823 0.264 0.500 1 ( 33 CB | 33 CA | 33 C | 34 N ) -118.177 -60.000 58.177 0.599 0.300 3 ( 33 CB | 33 CA | 33 C | 33 O ) 61.313 180.000 118.687 0.555 0.375 1 ( 34 C | 35 N | 35 CA | 35 C ) -148.745 -180.000 -31.255 0.054 0.375 1 ( 34 C | 35 N | 35 CA | 35 C ) -148.745 -90.000 58.745 0.438 0.300 2 ( 34 C | 35 N | 35 CA | 35 C ) -148.745 -180.000 -31.255 0.240 0.225 3 ( 34 C | 35 N | 35 CA | 35 C ) -148.745 -180.000 -31.255 0.144 0.075 5 ( 34 C | 35 N | 35 CA | 35 CB ) 86.464 180.000 93.536 0.531 0.500 1 ( 34 C | 35 N | 35 CA | 35 CB ) 86.464 45.000 -41.464 0.394 0.200 4 ( 34 CB | 34 CA | 34 C | 35 N ) 139.143 180.000 40.857 0.122 0.500 1 ( 34 CB | 34 CA | 34 C | 35 N ) 139.143 90.000 -49.143 0.458 0.400 2 ( 34 CB | 34 CA | 34 C | 35 N ) 139.143 180.000 40.857 0.461 0.300 3 ( 34 CB | 34 CA | 34 C | 35 N ) 139.143 108.000 -31.143 0.191 0.100 5 ( 34 CB | 34 CA | 34 C | 34 O ) -41.891 -180.000 -138.109 0.654 0.375 1 ( 34 CB | 34 CA | 34 C | 34 O ) -41.891 -90.000 -48.109 0.332 0.300 2 ( 35 CB | 35 CA | 35 C | 36 N ) -84.484 -180.000 -95.516 0.548 0.500 1 ( 35 CB | 35 CA | 35 C | 36 N ) -84.484 -45.000 39.484 0.385 0.200 4 ( 35 CB | 35 CA | 35 C | 35 O ) 95.864 180.000 84.136 0.337 0.375 1 ( 35 CB | 35 CA | 35 C | 35 O ) 95.864 60.000 -35.864 0.293 0.225 3 ( 35 CB | 35 CA | 35 C | 35 O ) 95.864 135.000 39.136 0.288 0.150 4 ( 36 C | 37 N | 37 CA | 37 C ) -70.555 -180.000 -109.445 0.500 0.375 1 ( 36 C | 37 N | 37 CA | 37 C ) -70.555 -36.000 34.555 0.149 0.075 5 ( 36 C | 37 N | 37 CA | 37 CB ) 168.191 90.000 -78.191 0.766 0.400 2 ( 36 C | 37 N | 37 CA | 37 CB ) 168.191 135.000 -33.191 0.336 0.200 4 ( 36 CB | 36 CA | 36 C | 37 N ) -98.970 -180.000 -81.030 0.422 0.500 1 ( 36 CB | 36 CA | 36 C | 37 N ) -98.970 -60.000 38.970 0.436 0.300 3 ( 36 CB | 36 CA | 36 C | 37 N ) -98.970 -135.000 -36.030 0.362 0.200 4 ( 36 CB | 36 CA | 36 C | 36 O ) 78.870 180.000 101.130 0.447 0.375 1 ( 36 CB | 36 CA | 36 C | 36 O ) 78.870 45.000 -33.870 0.257 0.150 4 ( 37 C | 38 N | 38 CA | 38 C ) -51.184 -180.000 -128.816 0.610 0.375 1 ( 37 C | 38 N | 38 CA | 38 C ) -51.184 -90.000 -38.816 0.236 0.300 2 ( 37 C | 38 N | 38 CA | 38 CB ) -174.262 -90.000 84.262 0.792 0.400 2 ( 37 C | 38 N | 38 CA | 38 CB ) -174.262 -135.000 39.262 0.384 0.200 4 ( 37 CB | 37 CA | 37 C | 38 N ) 79.720 180.000 100.280 0.589 0.500 1 ( 37 CB | 37 CA | 37 C | 38 N ) 79.720 45.000 -34.720 0.351 0.200 4 ( 37 CB | 37 CA | 37 C | 37 O ) -99.168 -180.000 -80.832 0.315 0.375 1 ( 37 CB | 37 CA | 37 C | 37 O ) -99.168 -60.000 39.168 0.329 0.225 3 ( 37 CB | 37 CA | 37 C | 37 O ) -99.168 -135.000 -35.832 0.270 0.150 4 ( 38 C | 39 N | 39 CA | 39 C ) -57.010 -180.000 -122.990 0.579 0.375 1 ( 38 C | 39 N | 39 CA | 39 C ) -57.010 -90.000 -32.990 0.178 0.300 2 ( 38 C | 39 N | 39 CA | 39 CB ) -179.559 -90.000 89.559 0.800 0.400 2 ( 38 C | 39 N | 39 CA | 39 CB ) -179.559 -135.000 44.559 0.400 0.200 4 ( 38 CB | 38 CA | 38 C | 39 N ) 77.637 180.000 102.363 0.607 0.500 1 ( 38 CB | 38 CA | 38 C | 39 N ) 77.637 45.000 -32.637 0.330 0.200 4 ( 38 CB | 38 CA | 38 C | 39 N ) 77.637 108.000 30.363 0.188 0.100 5 ( 38 CB | 38 CA | 38 C | 38 O ) -102.764 -180.000 -77.236 0.292 0.375 1 ( 38 CB | 38 CA | 38 C | 38 O ) -102.764 -60.000 42.764 0.364 0.225 3 ( 38 CB | 38 CA | 38 C | 38 O ) -102.764 -135.000 -32.236 0.244 0.150 4 ( 39 C | 40 N | 40 CA | 40 C ) -47.845 -180.000 -132.155 0.627 0.375 1 ( 39 C | 40 N | 40 CA | 40 C ) -47.845 -90.000 -42.155 0.270 0.300 2 ( 39 C | 40 N | 40 CA | 40 CB ) -169.184 -90.000 79.184 0.772 0.400 2 ( 39 C | 40 N | 40 CA | 40 CB ) -169.184 -135.000 34.184 0.346 0.200 4 ( 39 CB | 39 CA | 39 C | 40 N ) 73.607 180.000 106.393 0.641 0.500 1 ( 39 CB | 39 CA | 39 C | 40 N ) 73.607 108.000 34.393 0.199 0.100 5 ( 39 CB | 39 CA | 39 C | 39 O ) -107.582 -180.000 -72.418 0.262 0.375 1 ( 39 CB | 39 CA | 39 C | 39 O ) -107.582 -60.000 47.582 0.404 0.225 3 ( 40 C | 41 N | 41 CA | 41 C ) -68.438 -180.000 -111.562 0.513 0.375 1 ( 40 C | 41 N | 41 CA | 41 C ) -68.438 -36.000 32.438 0.146 0.075 5 ( 40 C | 41 N | 41 CA | 41 CB ) 169.841 90.000 -79.841 0.775 0.400 2 ( 40 C | 41 N | 41 CA | 41 CB ) 169.841 135.000 -34.841 0.352 0.200 4 ( 40 CB | 40 CA | 40 C | 41 N ) 74.340 180.000 105.660 0.635 0.500 1 ( 40 CB | 40 CA | 40 C | 41 N ) 74.340 108.000 33.660 0.198 0.100 5 ( 40 CB | 40 CA | 40 C | 40 O ) -105.904 -180.000 -74.096 0.272 0.375 1 ( 40 CB | 40 CA | 40 C | 40 O ) -105.904 -60.000 45.904 0.391 0.225 3 ( 41 C | 42 N | 42 CA | 42 C ) -93.746 -180.000 -86.254 0.351 0.375 1 ( 41 C | 42 N | 42 CA | 42 C ) -93.746 -60.000 33.746 0.269 0.225 3 ( 41 C | 42 N | 42 CA | 42 C ) -93.746 -135.000 -41.254 0.295 0.150 4 ( 41 C | 42 N | 42 CA | 42 CB ) 142.574 180.000 37.426 0.103 0.500 1 ( 41 C | 42 N | 42 CA | 42 CB ) 142.574 90.000 -52.574 0.505 0.400 2 ( 41 C | 42 N | 42 CA | 42 CB ) 142.574 180.000 37.426 0.414 0.300 3 ( 41 C | 42 N | 42 CA | 42 CB ) 142.574 108.000 -34.574 0.199 0.100 5 ( 41 CB | 41 CA | 41 C | 42 N ) 84.809 180.000 95.191 0.545 0.500 1 ( 41 CB | 41 CA | 41 C | 42 N ) 84.809 45.000 -39.809 0.387 0.200 4 ( 41 CB | 41 CA | 41 C | 41 O ) -95.948 -180.000 -84.052 0.336 0.375 1 ( 41 CB | 41 CA | 41 C | 41 O ) -95.948 -60.000 35.948 0.294 0.225 3 ( 41 CB | 41 CA | 41 C | 41 O ) -95.948 -135.000 -39.052 0.287 0.150 4 ( 42 C | 43 N | 43 CA | 43 C ) -80.510 -180.000 -99.490 0.437 0.375 1 ( 42 C | 43 N | 43 CA | 43 C ) -80.510 -45.000 35.510 0.268 0.150 4 ( 42 C | 43 N | 43 CA | 43 CB ) 157.703 90.000 -67.703 0.685 0.400 2 ( 42 CB | 42 CA | 42 C | 43 N ) 125.012 180.000 54.988 0.213 0.500 1 ( 42 CB | 42 CA | 42 C | 43 N ) 125.012 90.000 -35.012 0.263 0.400 2 ( 42 CB | 42 CA | 42 C | 43 N ) 125.012 180.000 54.988 0.590 0.300 3 ( 42 CB | 42 CA | 42 C | 42 O ) -54.946 -180.000 -125.054 0.590 0.375 1 ( 42 CB | 42 CA | 42 C | 42 O ) -54.946 -90.000 -35.054 0.198 0.300 2 ( 43 CB | 43 CA | 43 C | 44 N ) -95.526 -180.000 -84.474 0.452 0.500 1 ( 43 CB | 43 CA | 43 C | 44 N ) -95.526 -60.000 35.526 0.386 0.300 3 ( 43 CB | 43 CA | 43 C | 44 N ) -95.526 -135.000 -39.474 0.385 0.200 4 ( 43 CB | 43 CA | 43 C | 43 O ) 84.216 180.000 95.784 0.413 0.375 1 ( 43 CB | 43 CA | 43 C | 43 O ) 84.216 45.000 -39.216 0.288 0.150 4 ( 44 C | 45 N | 45 CA | 45 C ) -55.908 -180.000 -124.092 0.585 0.375 1 ( 44 C | 45 N | 45 CA | 45 C ) -55.908 -90.000 -34.092 0.189 0.300 2 ( 44 C | 45 N | 45 CA | 45 CB ) -179.031 -90.000 89.031 0.800 0.400 2 ( 44 C | 45 N | 45 CA | 45 CB ) -179.031 -135.000 44.031 0.400 0.200 4 ( 44 CB | 44 CA | 44 C | 45 N ) -86.953 -180.000 -93.047 0.527 0.500 1 ( 44 CB | 44 CA | 44 C | 45 N ) -86.953 -45.000 41.953 0.395 0.200 4 ( 44 CB | 44 CA | 44 C | 44 O ) 92.287 180.000 87.713 0.360 0.375 1 ( 44 CB | 44 CA | 44 C | 44 O ) 92.287 60.000 -32.287 0.252 0.225 3 ( 44 CB | 44 CA | 44 C | 44 O ) 92.287 135.000 42.713 0.298 0.150 4 ( 45 C | 46 N | 46 CA | 46 C ) -64.042 -180.000 -115.958 0.539 0.375 1 ( 45 C | 46 N | 46 CA | 46 CB ) 174.222 90.000 -84.222 0.792 0.400 2 ( 45 C | 46 N | 46 CA | 46 CB ) 174.222 135.000 -39.222 0.384 0.200 4 ( 45 CB | 45 CA | 45 C | 46 N ) 90.514 180.000 89.486 0.496 0.500 1 ( 45 CB | 45 CA | 45 C | 46 N ) 90.514 60.000 -30.514 0.308 0.300 3 ( 45 CB | 45 CA | 45 C | 46 N ) 90.514 135.000 44.486 0.400 0.200 4 ( 45 CB | 45 CA | 45 C | 45 O ) -91.478 -180.000 -88.522 0.365 0.375 1 ( 45 CB | 45 CA | 45 C | 45 O ) -91.478 -60.000 31.478 0.242 0.225 3 ( 45 CB | 45 CA | 45 C | 45 O ) -91.478 -135.000 -43.522 0.299 0.150 4 ( 46 C | 47 N | 47 CA | 47 C ) -67.029 -180.000 -112.971 0.521 0.375 1 ( 46 C | 47 N | 47 CA | 47 C ) -67.029 -36.000 31.029 0.143 0.075 5 ( 46 C | 47 N | 47 CA | 47 CB ) 170.292 90.000 -80.292 0.777 0.400 2 ( 46 C | 47 N | 47 CA | 47 CB ) 170.292 135.000 -35.292 0.356 0.200 4 ( 46 CB | 46 CA | 46 C | 47 N ) 58.216 180.000 121.784 0.763 0.500 1 ( 46 CB | 46 CA | 46 C | 47 N ) 58.216 90.000 31.784 0.222 0.400 2 ( 46 CB | 46 CA | 46 C | 46 O ) -122.319 -180.000 -57.681 0.175 0.375 1 ( 46 CB | 46 CA | 46 C | 46 O ) -122.319 -90.000 32.319 0.171 0.300 2 ( 46 CB | 46 CA | 46 C | 46 O ) -122.319 -180.000 -57.681 0.448 0.225 3 ( 47 C | 48 N | 48 CA | 48 C ) -61.809 -180.000 -118.191 0.552 0.375 1 ( 47 C | 48 N | 48 CA | 48 CB ) 175.471 90.000 -85.471 0.795 0.400 2 ( 47 C | 48 N | 48 CA | 48 CB ) 175.471 135.000 -40.471 0.390 0.200 4 ( 47 CB | 47 CA | 47 C | 48 N ) 91.937 180.000 88.063 0.483 0.500 1 ( 47 CB | 47 CA | 47 C | 48 N ) 91.937 60.000 -31.937 0.330 0.300 3 ( 47 CB | 47 CA | 47 C | 48 N ) 91.937 135.000 43.063 0.398 0.200 4 ( 47 CB | 47 CA | 47 C | 47 O ) -87.926 -180.000 -92.074 0.389 0.375 1 ( 47 CB | 47 CA | 47 C | 47 O ) -87.926 -45.000 42.926 0.298 0.150 4 ( 48 C | 49 N | 49 CA | 49 C ) -57.508 -180.000 -122.492 0.576 0.375 1 ( 48 C | 49 N | 49 CA | 49 C ) -57.508 -90.000 -32.492 0.173 0.300 2 ( 48 C | 49 N | 49 CA | 49 CB ) -179.937 -90.000 89.937 0.800 0.400 2 ( 48 C | 49 N | 49 CA | 49 CB ) -179.937 -135.000 44.937 0.400 0.200 4 ( 48 CB | 48 CA | 48 C | 49 N ) 68.689 180.000 111.311 0.682 0.500 1 ( 48 CB | 48 CA | 48 C | 49 N ) 68.689 36.000 -32.689 0.196 0.100 5 ( 48 CB | 48 CA | 48 C | 48 O ) -111.452 -180.000 -68.548 0.238 0.375 1 ( 48 CB | 48 CA | 48 C | 48 O ) -111.452 -60.000 51.452 0.428 0.225 3 ( 49 C | 50 N | 50 CA | 50 C ) -74.076 -180.000 -105.924 0.478 0.375 1 ( 49 C | 50 N | 50 CA | 50 C ) -74.076 -108.000 -33.924 0.149 0.075 5 ( 49 C | 50 N | 50 CA | 50 CB ) 163.284 90.000 -73.284 0.734 0.400 2 ( 49 CB | 49 CA | 49 C | 50 N ) 89.474 180.000 90.526 0.505 0.500 1 ( 49 CB | 49 CA | 49 C | 50 N ) 89.474 45.000 -44.474 0.400 0.200 4 ( 49 CB | 49 CA | 49 C | 49 O ) -90.217 -180.000 -89.783 0.374 0.375 1 ( 49 CB | 49 CA | 49 C | 49 O ) -90.217 -60.000 30.217 0.228 0.225 3 ( 49 CB | 49 CA | 49 C | 49 O ) -90.217 -135.000 -44.783 0.300 0.150 4 ( 50 C | 51 N | 51 CA | 51 C ) -52.697 -180.000 -127.303 0.602 0.375 1 ( 50 C | 51 N | 51 CA | 51 C ) -52.697 -90.000 -37.303 0.220 0.300 2 ( 50 C | 51 N | 51 CA | 51 CB ) -174.329 -90.000 84.329 0.792 0.400 2 ( 50 C | 51 N | 51 CA | 51 CB ) -174.329 -135.000 39.329 0.385 0.200 4 ( 50 CB | 50 CA | 50 C | 51 N ) 83.057 180.000 96.943 0.560 0.500 1 ( 50 CB | 50 CA | 50 C | 51 N ) 83.057 45.000 -38.057 0.377 0.200 4 ( 50 CB | 50 CA | 50 C | 50 O ) -97.654 -180.000 -82.346 0.325 0.375 1 ( 50 CB | 50 CA | 50 C | 50 O ) -97.654 -60.000 37.654 0.313 0.225 3 ( 50 CB | 50 CA | 50 C | 50 O ) -97.654 -135.000 -37.346 0.279 0.150 4 ( 51 C | 52 N | 52 CA | 52 C ) -55.196 -180.000 -124.804 0.589 0.375 1 ( 51 C | 52 N | 52 CA | 52 C ) -55.196 -90.000 -34.804 0.195 0.300 2 ( 51 C | 52 N | 52 CA | 52 CB ) -177.460 -90.000 87.460 0.798 0.400 2 ( 51 C | 52 N | 52 CA | 52 CB ) -177.460 -135.000 42.460 0.397 0.200 4 ( 51 CB | 51 CA | 51 C | 52 N ) 74.664 180.000 105.336 0.632 0.500 1 ( 51 CB | 51 CA | 51 C | 52 N ) 74.664 108.000 33.336 0.197 0.100 5 ( 51 CB | 51 CA | 51 C | 51 O ) -106.198 -180.000 -73.802 0.270 0.375 1 ( 51 CB | 51 CA | 51 C | 51 O ) -106.198 -60.000 46.198 0.394 0.225 3 ( 52 C | 53 N | 53 CA | 53 C ) -72.794 -180.000 -107.206 0.486 0.375 1 ( 52 C | 53 N | 53 CA | 53 C ) -72.794 -108.000 -35.206 0.150 0.075 5 ( 52 C | 53 N | 53 CA | 53 CB ) 163.934 90.000 -73.934 0.739 0.400 2 ( 52 CB | 52 CA | 52 C | 53 N ) 75.044 180.000 104.956 0.629 0.500 1 ( 52 CB | 52 CA | 52 C | 53 N ) 75.044 45.000 -30.044 0.301 0.200 4 ( 52 CB | 52 CA | 52 C | 53 N ) 75.044 108.000 32.956 0.196 0.100 5 ( 52 CB | 52 CA | 52 C | 52 O ) -105.971 -180.000 -74.029 0.272 0.375 1 ( 52 CB | 52 CA | 52 C | 52 O ) -105.971 -60.000 45.971 0.392 0.225 3 ( 53 C | 54 N | 54 CA | 54 C ) -83.761 -180.000 -96.239 0.416 0.375 1 ( 53 C | 54 N | 54 CA | 54 C ) -83.761 -45.000 38.761 0.286 0.150 4 ( 53 C | 54 N | 54 CA | 54 CB ) 153.390 90.000 -63.390 0.639 0.400 2 ( 53 CB | 53 CA | 53 C | 54 N ) 107.128 180.000 72.872 0.353 0.500 1 ( 53 CB | 53 CA | 53 C | 54 N ) 107.128 60.000 -47.128 0.534 0.300 3 ( 53 CB | 53 CA | 53 C | 53 O ) -72.691 -180.000 -107.309 0.487 0.375 1 ( 53 CB | 53 CA | 53 C | 53 O ) -72.691 -108.000 -35.309 0.150 0.075 5 ( 54 C | 55 N | 55 CA | 55 C ) -118.957 -180.000 -61.043 0.193 0.375 1 ( 54 C | 55 N | 55 CA | 55 C ) -118.957 -60.000 58.957 0.450 0.225 3 ( 54 C | 55 N | 55 CA | 55 CB ) 118.239 180.000 61.761 0.263 0.500 1 ( 54 C | 55 N | 55 CA | 55 CB ) 118.239 60.000 -58.239 0.599 0.300 3 ( 54 CB | 54 CA | 54 C | 55 N ) 111.937 180.000 68.063 0.313 0.500 1 ( 54 CB | 54 CA | 54 C | 55 N ) 111.937 60.000 -51.937 0.574 0.300 3 ( 54 CB | 54 CA | 54 C | 54 O ) -68.171 -180.000 -111.829 0.514 0.375 1 ( 54 CB | 54 CA | 54 C | 54 O ) -68.171 -36.000 32.171 0.146 0.075 5 ( 55 CB | 55 CA | 55 C | 56 N ) -85.072 -180.000 -94.928 0.543 0.500 1 ( 55 CB | 55 CA | 55 C | 56 N ) -85.072 -45.000 40.072 0.388 0.200 4 ( 55 CB | 55 CA | 55 C | 55 O ) 94.417 180.000 85.583 0.346 0.375 1 ( 55 CB | 55 CA | 55 C | 55 O ) 94.417 60.000 -34.417 0.277 0.225 3 ( 55 CB | 55 CA | 55 C | 55 O ) 94.417 135.000 40.583 0.293 0.150 4 ( 56 C | 57 N | 57 CA | 57 C ) -76.301 -180.000 -103.699 0.464 0.375 1 ( 56 C | 57 N | 57 CA | 57 C ) -76.301 -45.000 31.301 0.236 0.150 4 ( 56 C | 57 N | 57 CA | 57 C ) -76.301 -108.000 -31.699 0.145 0.075 5 ( 56 C | 57 N | 57 CA | 57 CB ) 161.675 90.000 -71.675 0.721 0.400 2 ( 56 CB | 56 CA | 56 C | 57 N ) 161.292 90.000 -71.292 0.718 0.400 2 ( 56 CB | 56 CA | 56 C | 56 O ) -20.393 -180.000 -159.607 0.726 0.375 1 ( 56 CB | 56 CA | 56 C | 56 O ) -20.393 -90.000 -69.607 0.527 0.300 2 ( 56 CB | 56 CA | 56 C | 56 O ) -20.393 -60.000 -39.607 0.333 0.225 3 ( 57 C | 58 N | 58 CA | 58 C ) -90.214 -180.000 -89.786 0.374 0.375 1 ( 57 C | 58 N | 58 CA | 58 C ) -90.214 -60.000 30.214 0.228 0.225 3 ( 57 C | 58 N | 58 CA | 58 C ) -90.214 -135.000 -44.786 0.300 0.150 4 ( 57 C | 58 N | 58 CA | 58 CB ) 149.279 180.000 30.721 0.070 0.500 1 ( 57 C | 58 N | 58 CA | 58 CB ) 149.279 90.000 -59.279 0.591 0.400 2 ( 57 C | 58 N | 58 CA | 58 CB ) 149.279 180.000 30.721 0.311 0.300 3 ( 57 C | 58 N | 58 CA | 58 CB ) 149.279 180.000 30.721 0.190 0.100 5 ( 57 CB | 57 CA | 57 C | 58 N ) -88.250 -180.000 -91.750 0.515 0.500 1 ( 57 CB | 57 CA | 57 C | 58 N ) -88.250 -45.000 43.250 0.399 0.200 4 ( 57 CB | 57 CA | 57 C | 57 O ) 92.011 180.000 87.989 0.362 0.375 1 ( 57 CB | 57 CA | 57 C | 57 O ) 92.011 60.000 -32.011 0.249 0.225 3 ( 57 CB | 57 CA | 57 C | 57 O ) 92.011 135.000 42.989 0.299 0.150 4 ( 59 OE1 | 59 CD | 59 CG | 59 CB ) 58.985 90.000 31.015 0.531 1.000 2 ( 58 C | 59 N | 59 CA | 59 C ) -53.532 -180.000 -126.468 0.598 0.375 1 ( 58 C | 59 N | 59 CA | 59 C ) -53.532 -90.000 -36.468 0.212 0.300 2 ( 58 C | 59 N | 59 CA | 59 CB ) -176.601 -90.000 86.601 0.797 0.400 2 ( 58 C | 59 N | 59 CA | 59 CB ) -176.601 -135.000 41.601 0.394 0.200 4 ( 58 CB | 58 CA | 58 C | 59 N ) -75.552 -180.000 -104.448 0.625 0.500 1 ( 58 CB | 58 CA | 58 C | 59 N ) -75.552 -45.000 30.552 0.307 0.200 4 ( 58 CB | 58 CA | 58 C | 59 N ) -75.552 -108.000 -32.448 0.195 0.100 5 ( 58 CB | 58 CA | 58 C | 58 O ) 102.887 180.000 77.113 0.291 0.375 1 ( 58 CB | 58 CA | 58 C | 58 O ) 102.887 60.000 -42.887 0.366 0.225 3 ( 58 CB | 58 CA | 58 C | 58 O ) 102.887 135.000 32.113 0.243 0.150 4 ( 59 C | 60 N | 60 CA | 60 C ) -80.657 -180.000 -99.343 0.436 0.375 1 ( 59 C | 60 N | 60 CA | 60 C ) -80.657 -45.000 35.657 0.269 0.150 4 ( 59 C | 60 N | 60 CA | 60 CB ) 157.852 90.000 -67.852 0.686 0.400 2 ( 59 CB | 59 CA | 59 C | 60 N ) 100.497 180.000 79.503 0.409 0.500 1 ( 59 CB | 59 CA | 59 C | 60 N ) 100.497 60.000 -40.497 0.457 0.300 3 ( 59 CB | 59 CA | 59 C | 60 N ) 100.497 135.000 34.503 0.349 0.200 4 ( 59 CB | 59 CA | 59 C | 59 O ) -79.155 -180.000 -100.845 0.446 0.375 1 ( 59 CB | 59 CA | 59 C | 59 O ) -79.155 -45.000 34.155 0.259 0.150 4 ( 60 C | 61 N | 61 CA | 61 C ) -69.914 -180.000 -110.086 0.504 0.375 1 ( 60 C | 61 N | 61 CA | 61 C ) -69.914 -36.000 33.914 0.149 0.075 5 ( 60 C | 61 N | 61 CA | 61 CB ) 165.474 90.000 -75.474 0.750 0.400 2 ( 60 C | 61 N | 61 CA | 61 CB ) 165.474 135.000 -30.474 0.306 0.200 4 ( 60 CB | 60 CA | 60 C | 61 N ) 84.044 180.000 95.956 0.552 0.500 1 ( 60 CB | 60 CA | 60 C | 61 N ) 84.044 45.000 -39.044 0.383 0.200 4 ( 60 CB | 60 CA | 60 C | 60 O ) -96.154 -180.000 -83.846 0.335 0.375 1 ( 60 CB | 60 CA | 60 C | 60 O ) -96.154 -60.000 36.154 0.296 0.225 3 ( 60 CB | 60 CA | 60 C | 60 O ) -96.154 -135.000 -38.846 0.286 0.150 4 ( 61 C | 62 N | 62 CA | 62 C ) -58.227 -180.000 -121.773 0.572 0.375 1 ( 61 C | 62 N | 62 CA | 62 C ) -58.227 -90.000 -31.773 0.166 0.300 2 ( 61 C | 62 N | 62 CA | 62 CB ) 179.268 90.000 -89.268 0.800 0.400 2 ( 61 C | 62 N | 62 CA | 62 CB ) 179.268 135.000 -44.268 0.400 0.200 4 ( 61 CB | 61 CA | 61 C | 62 N ) 80.855 180.000 99.145 0.579 0.500 1 ( 61 CB | 61 CA | 61 C | 62 N ) 80.855 45.000 -35.855 0.361 0.200 4 ( 61 CB | 61 CA | 61 C | 61 O ) -99.804 -180.000 -80.196 0.311 0.375 1 ( 61 CB | 61 CA | 61 C | 61 O ) -99.804 -60.000 39.804 0.335 0.225 3 ( 61 CB | 61 CA | 61 C | 61 O ) -99.804 -135.000 -35.196 0.266 0.150 4 ( 62 C | 63 N | 63 CA | 63 C ) -65.162 -180.000 -114.838 0.533 0.375 1 ( 62 C | 63 N | 63 CA | 63 CB ) 171.985 90.000 -81.985 0.784 0.400 2 ( 62 C | 63 N | 63 CA | 63 CB ) 171.985 135.000 -36.985 0.370 0.200 4 ( 62 CB | 62 CA | 62 C | 63 N ) 89.847 180.000 90.153 0.501 0.500 1 ( 62 CB | 62 CA | 62 C | 63 N ) 89.847 45.000 -44.847 0.400 0.200 4 ( 62 CB | 62 CA | 62 C | 62 O ) -89.380 -180.000 -90.620 0.379 0.375 1 ( 62 CB | 62 CA | 62 C | 62 O ) -89.380 -45.000 44.380 0.300 0.150 4 ( 63 C | 64 N | 64 CA | 64 C ) -57.818 -180.000 -122.182 0.575 0.375 1 ( 63 C | 64 N | 64 CA | 64 C ) -57.818 -90.000 -32.182 0.170 0.300 2 ( 63 C | 64 N | 64 CA | 64 CB ) -179.771 -90.000 89.771 0.800 0.400 2 ( 63 C | 64 N | 64 CA | 64 CB ) -179.771 -135.000 44.771 0.400 0.200 4 ( 63 CB | 63 CA | 63 C | 64 N ) 72.731 180.000 107.269 0.648 0.500 1 ( 63 CB | 63 CA | 63 C | 64 N ) 72.731 108.000 35.269 0.200 0.100 5 ( 63 CB | 63 CA | 63 C | 63 O ) -108.178 -180.000 -71.822 0.258 0.375 1 ( 63 CB | 63 CA | 63 C | 63 O ) -108.178 -60.000 48.178 0.408 0.225 3 ( 64 C | 65 N | 65 CA | 65 C ) -56.755 -180.000 -123.245 0.581 0.375 1 ( 64 C | 65 N | 65 CA | 65 C ) -56.755 -90.000 -33.245 0.180 0.300 2 ( 64 C | 65 N | 65 CA | 65 CB ) -179.183 -90.000 89.183 0.800 0.400 2 ( 64 C | 65 N | 65 CA | 65 CB ) -179.183 -135.000 44.183 0.400 0.200 4 ( 64 CB | 64 CA | 64 C | 65 N ) 76.654 180.000 103.346 0.615 0.500 1 ( 64 CB | 64 CA | 64 C | 65 N ) 76.654 45.000 -31.654 0.319 0.200 4 ( 64 CB | 64 CA | 64 C | 65 N ) 76.654 108.000 31.346 0.192 0.100 5 ( 64 CB | 64 CA | 64 C | 64 O ) -102.813 -180.000 -77.187 0.292 0.375 1 ( 64 CB | 64 CA | 64 C | 64 O ) -102.813 -60.000 42.813 0.365 0.225 3 ( 64 CB | 64 CA | 64 C | 64 O ) -102.813 -135.000 -32.187 0.244 0.150 4 ( 65 C | 66 N | 66 CA | 66 C ) -71.308 -180.000 -108.692 0.495 0.375 1 ( 65 C | 66 N | 66 CA | 66 C ) -71.308 -36.000 35.308 0.150 0.075 5 ( 65 C | 66 N | 66 CA | 66 CB ) 165.092 90.000 -75.092 0.747 0.400 2 ( 65 C | 66 N | 66 CA | 66 CB ) 165.092 135.000 -30.092 0.301 0.200 4 ( 65 CB | 65 CA | 65 C | 66 N ) 75.725 180.000 104.275 0.623 0.500 1 ( 65 CB | 65 CA | 65 C | 66 N ) 75.725 45.000 -30.725 0.309 0.200 4 ( 65 CB | 65 CA | 65 C | 66 N ) 75.725 108.000 32.275 0.195 0.100 5 ( 65 CB | 65 CA | 65 C | 65 O ) -105.055 -180.000 -74.945 0.278 0.375 1 ( 65 CB | 65 CA | 65 C | 65 O ) -105.055 -60.000 45.055 0.385 0.225 3 ( 66 C | 67 N | 67 CA | 67 C ) -69.601 -180.000 -110.399 0.506 0.375 1 ( 66 C | 67 N | 67 CA | 67 C ) -69.601 -36.000 33.601 0.148 0.075 5 ( 66 C | 67 N | 67 CA | 67 CB ) 168.757 90.000 -78.757 0.770 0.400 2 ( 66 C | 67 N | 67 CA | 67 CB ) 168.757 135.000 -33.757 0.341 0.200 4 ( 66 CB | 66 CA | 66 C | 67 N ) 97.801 180.000 82.199 0.432 0.500 1 ( 66 CB | 66 CA | 66 C | 67 N ) 97.801 60.000 -37.801 0.419 0.300 3 ( 66 CB | 66 CA | 66 C | 67 N ) 97.801 135.000 37.199 0.371 0.200 4 ( 66 CB | 66 CA | 66 C | 66 O ) -82.622 -180.000 -97.378 0.423 0.375 1 ( 66 CB | 66 CA | 66 C | 66 O ) -82.622 -45.000 37.622 0.281 0.150 4 ( 67 C | 68 N | 68 CA | 68 C ) -57.510 -180.000 -122.490 0.576 0.375 1 ( 67 C | 68 N | 68 CA | 68 C ) -57.510 -90.000 -32.490 0.173 0.300 2 ( 67 C | 68 N | 68 CA | 68 CB ) 179.899 90.000 -89.899 0.800 0.400 2 ( 67 C | 68 N | 68 CA | 68 CB ) 179.899 135.000 -44.899 0.400 0.200 4 ( 67 CB | 67 CA | 67 C | 68 N ) 64.452 180.000 115.548 0.716 0.500 1 ( 67 CB | 67 CA | 67 C | 67 O ) -115.785 -180.000 -64.215 0.212 0.375 1 ( 67 CB | 67 CA | 67 C | 67 O ) -115.785 -60.000 55.785 0.445 0.225 3 ( 69 CZ | 69 NE | 69 CD | 69 CG ) -118.640 -180.000 -61.360 1.041 2.000 1 ( 68 C | 69 N | 69 CA | 69 C ) -59.243 -180.000 -120.757 0.567 0.375 1 ( 68 C | 69 N | 69 CA | 69 C ) -59.243 -90.000 -30.757 0.157 0.300 2 ( 68 C | 69 N | 69 CA | 69 CB ) 178.944 90.000 -88.944 0.800 0.400 2 ( 68 C | 69 N | 69 CA | 69 CB ) 178.944 135.000 -43.944 0.399 0.200 4 ( 68 CB | 68 CA | 68 C | 69 N ) 86.639 180.000 93.361 0.529 0.500 1 ( 68 CB | 68 CA | 68 C | 69 N ) 86.639 45.000 -41.639 0.395 0.200 4 ( 68 CB | 68 CA | 68 C | 68 O ) -94.396 -180.000 -85.604 0.346 0.375 1 ( 68 CB | 68 CA | 68 C | 68 O ) -94.396 -60.000 34.396 0.276 0.225 3 ( 68 CB | 68 CA | 68 C | 68 O ) -94.396 -135.000 -40.604 0.293 0.150 4 ( 69 C | 70 N | 70 CA | 70 C ) -65.141 -180.000 -114.859 0.533 0.375 1 ( 69 C | 70 N | 70 CA | 70 CB ) 173.050 90.000 -83.050 0.788 0.400 2 ( 69 C | 70 N | 70 CA | 70 CB ) 173.050 135.000 -38.050 0.377 0.200 4 ( 69 CB | 69 CA | 69 C | 70 N ) 80.153 180.000 99.847 0.586 0.500 1 ( 69 CB | 69 CA | 69 C | 70 N ) 80.153 45.000 -35.153 0.355 0.200 4 ( 69 CB | 69 CA | 69 C | 69 O ) -99.794 -180.000 -80.206 0.311 0.375 1 ( 69 CB | 69 CA | 69 C | 69 O ) -99.794 -60.000 39.794 0.335 0.225 3 ( 69 CB | 69 CA | 69 C | 69 O ) -99.794 -135.000 -35.206 0.266 0.150 4 ( 70 C | 71 N | 71 CA | 71 C ) -49.230 -180.000 -130.770 0.620 0.375 1 ( 70 C | 71 N | 71 CA | 71 C ) -49.230 -90.000 -40.770 0.256 0.300 2 ( 70 C | 71 N | 71 CA | 71 CB ) -170.802 -90.000 80.802 0.780 0.400 2 ( 70 C | 71 N | 71 CA | 71 CB ) -170.802 -135.000 35.802 0.360 0.200 4 ( 70 CB | 70 CA | 70 C | 71 N ) 73.298 180.000 106.702 0.644 0.500 1 ( 70 CB | 70 CA | 70 C | 71 N ) 73.298 108.000 34.702 0.199 0.100 5 ( 70 CB | 70 CA | 70 C | 70 O ) -108.359 -180.000 -71.641 0.257 0.375 1 ( 70 CB | 70 CA | 70 C | 70 O ) -108.359 -60.000 48.359 0.409 0.225 3 ( 71 C | 72 N | 72 CA | 72 C ) -87.052 -180.000 -92.948 0.394 0.375 1 ( 71 C | 72 N | 72 CA | 72 C ) -87.052 -45.000 42.052 0.297 0.150 4 ( 71 CB | 71 CA | 71 C | 72 N ) 87.028 180.000 92.972 0.526 0.500 1 ( 71 CB | 71 CA | 71 C | 72 N ) 87.028 45.000 -42.028 0.396 0.200 4 ( 71 CB | 71 CA | 71 C | 71 O ) -91.920 -180.000 -88.080 0.362 0.375 1 ( 71 CB | 71 CA | 71 C | 71 O ) -91.920 -60.000 31.920 0.248 0.225 3 ( 71 CB | 71 CA | 71 C | 71 O ) -91.920 -135.000 -43.080 0.299 0.150 4 ( 72 C | 73 N | 73 CA | 73 C ) -64.993 -180.000 -115.007 0.534 0.375 1 ( 72 C | 73 N | 73 CA | 73 CB ) 170.562 90.000 -80.562 0.778 0.400 2 ( 72 C | 73 N | 73 CA | 73 CB ) 170.562 135.000 -35.562 0.358 0.200 4 ( 73 C | 74 N | 74 CA | 74 C ) -60.161 -180.000 -119.839 0.562 0.375 1 ( 73 C | 74 N | 74 CA | 74 CB ) 177.723 90.000 -87.723 0.799 0.400 2 ( 73 C | 74 N | 74 CA | 74 CB ) 177.723 135.000 -42.723 0.397 0.200 4 ( 73 CB | 73 CA | 73 C | 74 N ) 103.020 180.000 76.980 0.387 0.500 1 ( 73 CB | 73 CA | 73 C | 74 N ) 103.020 60.000 -43.020 0.489 0.300 3 ( 73 CB | 73 CA | 73 C | 74 N ) 103.020 135.000 31.980 0.323 0.200 4 ( 73 CB | 73 CA | 73 C | 73 O ) -77.076 -180.000 -102.924 0.459 0.375 1 ( 73 CB | 73 CA | 73 C | 73 O ) -77.076 -45.000 32.076 0.243 0.150 4 ( 73 CB | 73 CA | 73 C | 73 O ) -77.076 -108.000 -30.924 0.143 0.075 5 ( 74 C | 75 N | 75 CA | 75 C ) -70.343 -180.000 -109.657 0.501 0.375 1 ( 74 C | 75 N | 75 CA | 75 C ) -70.343 -36.000 34.343 0.149 0.075 5 ( 74 C | 75 N | 75 CA | 75 CB ) 167.650 90.000 -77.650 0.763 0.400 2 ( 74 C | 75 N | 75 CA | 75 CB ) 167.650 135.000 -32.650 0.330 0.200 4 ( 74 CB | 74 CA | 74 C | 75 N ) 83.643 180.000 96.357 0.555 0.500 1 ( 74 CB | 74 CA | 74 C | 75 N ) 83.643 45.000 -38.643 0.381 0.200 4 ( 74 CB | 74 CA | 74 C | 74 O ) -96.770 -180.000 -83.230 0.331 0.375 1 ( 74 CB | 74 CA | 74 C | 74 O ) -96.770 -60.000 36.770 0.303 0.225 3 ( 74 CB | 74 CA | 74 C | 74 O ) -96.770 -135.000 -38.230 0.284 0.150 4 ( 75 C | 76 N | 76 CA | 76 C ) -62.153 -180.000 -117.847 0.550 0.375 1 ( 75 C | 76 N | 76 CA | 76 CB ) 176.035 90.000 -86.035 0.796 0.400 2 ( 75 C | 76 N | 76 CA | 76 CB ) 176.035 135.000 -41.035 0.392 0.200 4 ( 75 CB | 75 CA | 75 C | 76 N ) 78.186 180.000 101.814 0.602 0.500 1 ( 75 CB | 75 CA | 75 C | 76 N ) 78.186 45.000 -33.186 0.336 0.200 4 ( 75 CB | 75 CA | 75 C | 75 O ) -102.353 -180.000 -77.647 0.295 0.375 1 ( 75 CB | 75 CA | 75 C | 75 O ) -102.353 -60.000 42.353 0.361 0.225 3 ( 75 CB | 75 CA | 75 C | 75 O ) -102.353 -135.000 -32.647 0.248 0.150 4 ( 76 C | 77 N | 77 CA | 77 C ) -64.135 -180.000 -115.865 0.539 0.375 1 ( 76 C | 77 N | 77 CA | 77 CB ) 172.421 90.000 -82.421 0.786 0.400 2 ( 76 C | 77 N | 77 CA | 77 CB ) 172.421 135.000 -37.421 0.373 0.200 4 ( 76 CB | 76 CA | 76 C | 77 N ) 79.191 180.000 100.809 0.594 0.500 1 ( 76 CB | 76 CA | 76 C | 77 N ) 79.191 45.000 -34.191 0.346 0.200 4 ( 76 CB | 76 CA | 76 C | 76 O ) -101.523 -180.000 -78.477 0.300 0.375 1 ( 76 CB | 76 CA | 76 C | 76 O ) -101.523 -60.000 41.523 0.353 0.225 3 ( 76 CB | 76 CA | 76 C | 76 O ) -101.523 -135.000 -33.477 0.254 0.150 4 ( 77 C | 78 N | 78 CA | 78 C ) -69.851 -180.000 -110.149 0.504 0.375 1 ( 77 C | 78 N | 78 CA | 78 C ) -69.851 -36.000 33.851 0.149 0.075 5 ( 77 C | 78 N | 78 CA | 78 CB ) 167.477 90.000 -77.477 0.762 0.400 2 ( 77 C | 78 N | 78 CA | 78 CB ) 167.477 135.000 -32.477 0.328 0.200 4 ( 77 CB | 77 CA | 77 C | 78 N ) 97.773 180.000 82.227 0.432 0.500 1 ( 77 CB | 77 CA | 77 C | 78 N ) 97.773 60.000 -37.773 0.419 0.300 3 ( 77 CB | 77 CA | 77 C | 78 N ) 97.773 135.000 37.227 0.371 0.200 4 ( 77 CB | 77 CA | 77 C | 77 O ) -81.281 -180.000 -98.719 0.432 0.375 1 ( 77 CB | 77 CA | 77 C | 77 O ) -81.281 -45.000 36.281 0.273 0.150 4 ( 78 C | 79 N | 79 CA | 79 C ) -77.423 -180.000 -102.577 0.457 0.375 1 ( 78 C | 79 N | 79 CA | 79 C ) -77.423 -45.000 32.423 0.246 0.150 4 ( 78 C | 79 N | 79 CA | 79 C ) -77.423 -108.000 -30.577 0.142 0.075 5 ( 78 C | 79 N | 79 CA | 79 CB ) 160.807 90.000 -70.807 0.714 0.400 2 ( 78 CB | 78 CA | 78 C | 79 N ) 87.001 180.000 92.999 0.526 0.500 1 ( 78 CB | 78 CA | 78 C | 79 N ) 87.001 45.000 -42.001 0.396 0.200 4 ( 78 CB | 78 CA | 78 C | 78 O ) -93.417 -180.000 -86.583 0.353 0.375 1 ( 78 CB | 78 CA | 78 C | 78 O ) -93.417 -60.000 33.417 0.265 0.225 3 ( 78 CB | 78 CA | 78 C | 78 O ) -93.417 -135.000 -41.583 0.296 0.150 4 ( 79 C | 80 N | 80 CA | 80 C ) -105.714 -180.000 -74.286 0.273 0.375 1 ( 79 C | 80 N | 80 CA | 80 C ) -105.714 -60.000 45.714 0.390 0.225 3 ( 79 C | 80 N | 80 CA | 80 CB ) 131.479 180.000 48.521 0.169 0.500 1 ( 79 C | 80 N | 80 CA | 80 CB ) 131.479 90.000 -41.479 0.351 0.400 2 ( 79 C | 80 N | 80 CA | 80 CB ) 131.479 180.000 48.521 0.547 0.300 3 ( 79 CB | 79 CA | 79 C | 80 N ) 66.188 180.000 113.812 0.702 0.500 1 ( 79 CB | 79 CA | 79 C | 80 N ) 66.188 36.000 -30.188 0.187 0.100 5 ( 79 CB | 79 CA | 79 C | 79 O ) -114.403 -180.000 -65.597 0.220 0.375 1 ( 79 CB | 79 CA | 79 C | 79 O ) -114.403 -60.000 54.403 0.440 0.225 3 ( 80 C | 81 N | 81 CA | 81 C ) -122.654 -180.000 -57.346 0.173 0.375 1 ( 80 C | 81 N | 81 CA | 81 C ) -122.654 -90.000 32.654 0.175 0.300 2 ( 80 C | 81 N | 81 CA | 81 C ) -122.654 -180.000 -57.346 0.448 0.225 3 ( 80 C | 81 N | 81 CA | 81 CB ) 115.267 180.000 64.733 0.287 0.500 1 ( 80 C | 81 N | 81 CA | 81 CB ) 115.267 60.000 -55.267 0.591 0.300 3 ( 80 CB | 80 CA | 80 C | 81 N ) -150.322 -90.000 60.322 0.604 0.400 2 ( 80 CB | 80 CA | 80 C | 80 O ) 30.809 180.000 149.191 0.697 0.375 1 ( 80 CB | 80 CA | 80 C | 80 O ) 30.809 90.000 59.191 0.443 0.300 2 ( 82 CZ | 82 NE | 82 CD | 82 CG ) -123.767 -180.000 -56.233 0.888 2.000 1 ( 81 C | 82 N | 82 CA | 82 C ) -162.949 -90.000 72.949 0.548 0.300 2 ( 81 C | 82 N | 82 CA | 82 CB ) 74.053 180.000 105.947 0.637 0.500 1 ( 81 C | 82 N | 82 CA | 82 CB ) 74.053 108.000 33.947 0.198 0.100 5 ( 81 CB | 81 CA | 81 C | 82 N ) -102.121 -180.000 -77.879 0.395 0.500 1 ( 81 CB | 81 CA | 81 C | 82 N ) -102.121 -60.000 42.121 0.478 0.300 3 ( 81 CB | 81 CA | 81 C | 82 N ) -102.121 -135.000 -32.879 0.333 0.200 4 ( 81 CB | 81 CA | 81 C | 81 O ) 78.204 180.000 101.796 0.452 0.375 1 ( 81 CB | 81 CA | 81 C | 81 O ) 78.204 45.000 -33.204 0.252 0.150 4 ( 82 C | 83 N | 83 CA | 83 C ) -91.643 -180.000 -88.357 0.364 0.375 1 ( 82 C | 83 N | 83 CA | 83 C ) -91.643 -60.000 31.643 0.244 0.225 3 ( 82 C | 83 N | 83 CA | 83 C ) -91.643 -135.000 -43.357 0.299 0.150 4 ( 82 C | 83 N | 83 CA | 83 CB ) 146.148 180.000 33.852 0.085 0.500 1 ( 82 C | 83 N | 83 CA | 83 CB ) 146.148 90.000 -56.148 0.552 0.400 2 ( 82 C | 83 N | 83 CA | 83 CB ) 146.148 180.000 33.852 0.360 0.300 3 ( 82 C | 83 N | 83 CA | 83 CB ) 146.148 180.000 33.852 0.198 0.100 5 ( 82 CB | 82 CA | 82 C | 83 N ) -102.577 -180.000 -77.423 0.391 0.500 1 ( 82 CB | 82 CA | 82 C | 83 N ) -102.577 -60.000 42.577 0.484 0.300 3 ( 82 CB | 82 CA | 82 C | 83 N ) -102.577 -135.000 -32.423 0.328 0.200 4 ( 82 CB | 82 CA | 82 C | 82 O ) 77.773 180.000 102.227 0.454 0.375 1 ( 82 CB | 82 CA | 82 C | 82 O ) 77.773 45.000 -32.773 0.249 0.150 4 ( 82 CB | 82 CA | 82 C | 82 O ) 77.773 108.000 30.227 0.141 0.075 5 ( 84 CZ | 84 NE | 84 CD | 84 CG ) 134.563 180.000 45.437 0.597 2.000 1 ( 83 C | 84 N | 84 CA | 84 C ) -159.806 -90.000 69.806 0.528 0.300 2 ( 83 C | 84 N | 84 CA | 84 CB ) 77.840 180.000 102.160 0.605 0.500 1 ( 83 C | 84 N | 84 CA | 84 CB ) 77.840 45.000 -32.840 0.332 0.200 4 ( 83 C | 84 N | 84 CA | 84 CB ) 77.840 108.000 30.160 0.187 0.100 5 ( 83 CB | 83 CA | 83 C | 84 N ) -99.245 -180.000 -80.755 0.420 0.500 1 ( 83 CB | 83 CA | 83 C | 84 N ) -99.245 -60.000 39.245 0.440 0.300 3 ( 83 CB | 83 CA | 83 C | 84 N ) -99.245 -135.000 -35.755 0.360 0.200 4 ( 83 CB | 83 CA | 83 C | 83 O ) 80.976 180.000 99.024 0.434 0.375 1 ( 83 CB | 83 CA | 83 C | 83 O ) 80.976 45.000 -35.976 0.271 0.150 4 ( 84 C | 85 N | 85 CA | 85 C ) -74.175 -180.000 -105.825 0.477 0.375 1 ( 84 C | 85 N | 85 CA | 85 C ) -74.175 -108.000 -33.825 0.149 0.075 5 ( 84 C | 85 N | 85 CA | 85 CB ) 163.712 90.000 -73.712 0.737 0.400 2 ( 84 CB | 84 CA | 84 C | 85 N ) -95.160 -180.000 -84.840 0.455 0.500 1 ( 84 CB | 84 CA | 84 C | 85 N ) -95.160 -60.000 35.160 0.380 0.300 3 ( 84 CB | 84 CA | 84 C | 85 N ) -95.160 -135.000 -39.840 0.387 0.200 4 ( 84 CB | 84 CA | 84 C | 84 O ) 85.524 180.000 94.476 0.404 0.375 1 ( 84 CB | 84 CA | 84 C | 84 O ) 85.524 45.000 -40.524 0.293 0.150 4 ( 85 C | 86 N | 86 CA | 86 C ) -64.908 -180.000 -115.092 0.534 0.375 1 ( 85 C | 86 N | 86 CA | 86 CB ) 172.032 90.000 -82.032 0.785 0.400 2 ( 85 C | 86 N | 86 CA | 86 CB ) 172.032 135.000 -37.032 0.370 0.200 4 ( 85 CB | 85 CA | 85 C | 86 N ) -116.067 -180.000 -63.933 0.280 0.500 1 ( 85 CB | 85 CA | 85 C | 86 N ) -116.067 -60.000 56.067 0.594 0.300 3 ( 85 CB | 85 CA | 85 C | 85 O ) 64.279 180.000 115.721 0.538 0.375 1 ( 87 CD | 87 CG | 87 CB | 87 CA ) -90.520 -60.000 30.520 2.054 2.000 3 ( 86 C | 87 N | 87 CA | 87 C ) -59.236 -180.000 -120.764 0.567 0.375 1 ( 86 C | 87 N | 87 CA | 87 C ) -59.236 -90.000 -30.764 0.157 0.300 2 ( 86 C | 87 N | 87 CA | 87 CB ) 177.602 90.000 -87.602 0.799 0.400 2 ( 86 C | 87 N | 87 CA | 87 CB ) 177.602 135.000 -42.602 0.397 0.200 4 ( 86 CB | 86 CA | 86 C | 87 N ) -129.760 -180.000 -50.240 0.180 0.500 1 ( 86 CB | 86 CA | 86 C | 87 N ) -129.760 -90.000 39.760 0.327 0.400 2 ( 86 CB | 86 CA | 86 C | 87 N ) -129.760 -180.000 -50.240 0.562 0.300 3 ( 86 CB | 86 CA | 86 C | 86 O ) 50.217 180.000 129.783 0.615 0.375 1 ( 86 CB | 86 CA | 86 C | 86 O ) 50.217 90.000 39.783 0.246 0.300 2 ( 87 C | 88 N | 88 CA | 88 C ) -86.925 -180.000 -93.075 0.395 0.375 1 ( 87 C | 88 N | 88 CA | 88 C ) -86.925 -45.000 41.925 0.297 0.150 4 ( 87 C | 88 N | 88 CA | 88 CB ) 150.882 90.000 -60.882 0.611 0.400 2 ( 87 CB | 87 CA | 87 C | 88 N ) -116.341 -180.000 -63.659 0.278 0.500 1 ( 87 CB | 87 CA | 87 C | 88 N ) -116.341 -60.000 56.341 0.595 0.300 3 ( 87 CB | 87 CA | 87 C | 87 O ) 64.104 180.000 115.896 0.539 0.375 1 ( 88 C | 89 N | 89 CA | 89 C ) -70.518 -180.000 -109.482 0.500 0.375 1 ( 88 C | 89 N | 89 CA | 89 C ) -70.518 -36.000 34.518 0.149 0.075 5 ( 88 C | 89 N | 89 CA | 89 CB ) 166.971 90.000 -76.971 0.759 0.400 2 ( 88 C | 89 N | 89 CA | 89 CB ) 166.971 135.000 -31.971 0.323 0.200 4 ( 88 CB | 88 CA | 88 C | 89 N ) -144.796 -180.000 -35.204 0.091 0.500 1 ( 88 CB | 88 CA | 88 C | 89 N ) -144.796 -90.000 54.796 0.534 0.400 2 ( 88 CB | 88 CA | 88 C | 89 N ) -144.796 -180.000 -35.204 0.381 0.300 3 ( 88 CB | 88 CA | 88 C | 89 N ) -144.796 -180.000 -35.204 0.200 0.100 5 ( 88 CB | 88 CA | 88 C | 88 O ) 36.454 180.000 143.546 0.677 0.375 1 ( 88 CB | 88 CA | 88 C | 88 O ) 36.454 90.000 53.546 0.388 0.300 2 ( 89 C | 90 N | 90 CA | 90 C ) -88.030 -180.000 -91.970 0.388 0.375 1 ( 89 C | 90 N | 90 CA | 90 C ) -88.030 -45.000 43.030 0.299 0.150 4 ( 89 C | 90 N | 90 CA | 90 CB ) 149.499 180.000 30.501 0.069 0.500 1 ( 89 C | 90 N | 90 CA | 90 CB ) 149.499 90.000 -59.499 0.594 0.400 2 ( 89 C | 90 N | 90 CA | 90 CB ) 149.499 180.000 30.501 0.308 0.300 3 ( 89 C | 90 N | 90 CA | 90 CB ) 149.499 180.000 30.501 0.189 0.100 5 ( 89 CB | 89 CA | 89 C | 90 N ) 61.756 180.000 118.244 0.737 0.500 1 ( 89 CB | 89 CA | 89 C | 89 O ) -118.490 -180.000 -61.510 0.196 0.375 1 ( 89 CB | 89 CA | 89 C | 89 O ) -118.490 -60.000 58.490 0.449 0.225 3 ( 90 C | 91 N | 91 CA | 91 C ) -76.502 -180.000 -103.498 0.463 0.375 1 ( 90 C | 91 N | 91 CA | 91 C ) -76.502 -45.000 31.502 0.238 0.150 4 ( 90 C | 91 N | 91 CA | 91 C ) -76.502 -108.000 -31.498 0.144 0.075 5 ( 90 C | 91 N | 91 CA | 91 CB ) 160.662 90.000 -70.662 0.712 0.400 2 ( 90 CB | 90 CA | 90 C | 91 N ) -92.073 -180.000 -87.927 0.482 0.500 1 ( 90 CB | 90 CA | 90 C | 91 N ) -92.073 -60.000 32.073 0.332 0.300 3 ( 90 CB | 90 CA | 90 C | 91 N ) -92.073 -135.000 -42.927 0.398 0.200 4 ( 90 CB | 90 CA | 90 C | 90 O ) 87.860 180.000 92.140 0.389 0.375 1 ( 90 CB | 90 CA | 90 C | 90 O ) 87.860 45.000 -42.860 0.298 0.150 4 The following couplings have delta J greater than the cutoff: (calculated J) (observed J) (delta J) RMS diff. = 0.000, #(violat.> 1.00)= 0. of 0 J-couplings overall,bonds,angles,improper,dihe,vdw,elec,noe,cdih,coup,sani,vean energies: -1604.37, 79.889, 90.4787, 46.7982, 421.3, -275.305, -1968.27, 0.689549, 4.681791E-02, $coup, $sani, $vean