USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 705 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 36 ASN : amide:sc= -1.04 K(o=-4.8,f=-7.9!) USER MOD Set 1.2: A 126 SER OG : rot 69:sc= -3.75! USER MOD Single : A 43 MET CE :methyl -159:sc= -0.665 (180deg=-2.1) USER MOD Single : A 44 LYS NZ :NH3+ 156:sc=-0.00537 (180deg=-0.193) USER MOD Single : A 45 SER OG : rot -53:sc= -0.155 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -3.12! C(o=-3.1!,f=-5.7!) USER MOD Single : A 66 SER OG : rot 67:sc=0.000218 USER MOD Single : A 72 LYS NZ :NH3+ -121:sc= -0.0207 (180deg=-0.272) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 59:sc= -0.728! USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -12.1! C(o=-12!,f=-10!) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 90:sc= -1.46! USER MOD Single : A 111 THR OG1 : rot 158:sc= -2.43 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0.0227 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot -31:sc= 0.562 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.0444 USER MOD ----------------------------------------------------------------- ATOM 12 N ASN A 36 -1.936 -16.352 -9.010 1.00 0.00 N ATOM 13 CA ASN A 36 -2.501 -15.365 -8.045 1.00 0.00 C ATOM 14 C ASN A 36 -1.654 -14.092 -8.031 1.00 0.00 C ATOM 15 O ASN A 36 -2.163 -12.999 -7.889 1.00 0.00 O ATOM 16 CB ASN A 36 -2.451 -16.064 -6.686 1.00 0.00 C ATOM 17 CG ASN A 36 -3.875 -16.372 -6.220 1.00 0.00 C ATOM 18 OD1 ASN A 36 -4.807 -15.679 -6.579 1.00 0.00 O ATOM 19 ND2 ASN A 36 -4.085 -17.390 -5.432 1.00 0.00 N ATOM 0 HA ASN A 36 -3.515 -15.064 -8.309 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.873 -16.985 -6.760 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -1.947 -15.430 -5.957 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -5.031 -17.605 -5.117 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -3.303 -17.972 -5.131 1.00 0.00 H new ATOM 26 N ALA A 37 -0.363 -14.231 -8.170 1.00 0.00 N ATOM 27 CA ALA A 37 0.529 -13.043 -8.162 1.00 0.00 C ATOM 28 C ALA A 37 -0.120 -11.871 -8.906 1.00 0.00 C ATOM 29 O ALA A 37 -0.802 -12.054 -9.895 1.00 0.00 O ATOM 30 CB ALA A 37 1.798 -13.501 -8.881 1.00 0.00 C ATOM 0 H ALA A 37 0.113 -15.125 -8.290 1.00 0.00 H new ATOM 0 HA ALA A 37 0.733 -12.691 -7.151 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.512 -12.678 -8.918 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.239 -14.340 -8.342 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.549 -13.812 -9.896 1.00 0.00 H new ATOM 36 N VAL A 38 0.082 -10.670 -8.436 1.00 0.00 N ATOM 37 CA VAL A 38 -0.530 -9.490 -9.118 1.00 0.00 C ATOM 38 C VAL A 38 0.549 -8.471 -9.490 1.00 0.00 C ATOM 39 O VAL A 38 1.728 -8.709 -9.314 1.00 0.00 O ATOM 40 CB VAL A 38 -1.487 -8.895 -8.086 1.00 0.00 C ATOM 41 CG1 VAL A 38 -2.500 -9.957 -7.655 1.00 0.00 C ATOM 42 CG2 VAL A 38 -0.691 -8.424 -6.868 1.00 0.00 C ATOM 0 H VAL A 38 0.642 -10.453 -7.612 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.038 -9.766 -10.042 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.015 -8.049 -8.525 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -3.182 -9.532 -6.919 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.067 -10.293 -8.523 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.974 -10.804 -7.215 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.372 -7.999 -6.130 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.163 -9.270 -6.429 1.00 0.00 H new ATOM 0 HG23 VAL A 38 0.030 -7.666 -7.175 1.00 0.00 H new ATOM 52 N VAL A 39 0.156 -7.334 -10.000 1.00 0.00 N ATOM 53 CA VAL A 39 1.164 -6.301 -10.376 1.00 0.00 C ATOM 54 C VAL A 39 0.595 -4.896 -10.196 1.00 0.00 C ATOM 55 O VAL A 39 -0.444 -4.561 -10.728 1.00 0.00 O ATOM 56 CB VAL A 39 1.474 -6.547 -11.856 1.00 0.00 C ATOM 57 CG1 VAL A 39 0.168 -6.622 -12.651 1.00 0.00 C ATOM 58 CG2 VAL A 39 2.327 -5.392 -12.401 1.00 0.00 C ATOM 0 H VAL A 39 -0.816 -7.077 -10.172 1.00 0.00 H new ATOM 0 HA VAL A 39 2.053 -6.372 -9.750 1.00 0.00 H new ATOM 0 HB VAL A 39 2.018 -7.486 -11.956 1.00 0.00 H new ATOM 0 HG11 VAL A 39 0.392 -6.797 -13.703 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.444 -7.439 -12.269 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.376 -5.683 -12.547 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.547 -5.568 -13.454 1.00 0.00 H new ATOM 0 HG22 VAL A 39 1.780 -4.455 -12.296 1.00 0.00 H new ATOM 0 HG23 VAL A 39 3.260 -5.333 -11.840 1.00 0.00 H new ATOM 68 N LEU A 40 1.289 -4.057 -9.484 1.00 0.00 N ATOM 69 CA LEU A 40 0.803 -2.665 -9.320 1.00 0.00 C ATOM 70 C LEU A 40 1.368 -1.843 -10.468 1.00 0.00 C ATOM 71 O LEU A 40 2.552 -1.873 -10.736 1.00 0.00 O ATOM 72 CB LEU A 40 1.354 -2.179 -7.982 1.00 0.00 C ATOM 73 CG LEU A 40 0.224 -1.540 -7.168 1.00 0.00 C ATOM 74 CD1 LEU A 40 0.822 -0.709 -6.032 1.00 0.00 C ATOM 75 CD2 LEU A 40 -0.613 -0.630 -8.075 1.00 0.00 C ATOM 0 H LEU A 40 2.167 -4.274 -9.011 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.284 -2.584 -9.331 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.788 -3.013 -7.430 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.153 -1.456 -8.146 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.410 -2.324 -6.754 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.019 -0.254 -5.452 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.417 -1.353 -5.384 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.457 0.073 -6.448 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.416 -0.177 -7.494 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.022 0.153 -8.490 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.040 -1.219 -8.887 1.00 0.00 H new ATOM 87 N VAL A 41 0.541 -1.142 -11.175 1.00 0.00 N ATOM 88 CA VAL A 41 1.062 -0.367 -12.328 1.00 0.00 C ATOM 89 C VAL A 41 0.762 1.119 -12.181 1.00 0.00 C ATOM 90 O VAL A 41 -0.376 1.538 -12.181 1.00 0.00 O ATOM 91 CB VAL A 41 0.333 -0.955 -13.536 1.00 0.00 C ATOM 92 CG1 VAL A 41 0.253 0.078 -14.661 1.00 0.00 C ATOM 93 CG2 VAL A 41 1.094 -2.189 -14.024 1.00 0.00 C ATOM 0 H VAL A 41 -0.463 -1.070 -11.010 1.00 0.00 H new ATOM 0 HA VAL A 41 2.146 -0.440 -12.416 1.00 0.00 H new ATOM 0 HB VAL A 41 -0.680 -1.233 -13.246 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -0.269 -0.354 -15.515 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.289 0.956 -14.311 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.260 0.369 -14.960 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.581 -2.615 -14.886 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.106 -1.903 -14.309 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.138 -2.929 -13.225 1.00 0.00 H new ATOM 103 N LEU A 42 1.777 1.921 -12.090 1.00 0.00 N ATOM 104 CA LEU A 42 1.545 3.374 -11.985 1.00 0.00 C ATOM 105 C LEU A 42 2.207 4.085 -13.173 1.00 0.00 C ATOM 106 O LEU A 42 3.087 3.545 -13.812 1.00 0.00 O ATOM 107 CB LEU A 42 2.171 3.797 -10.665 1.00 0.00 C ATOM 108 CG LEU A 42 1.078 4.249 -9.690 1.00 0.00 C ATOM 109 CD1 LEU A 42 0.412 5.523 -10.212 1.00 0.00 C ATOM 110 CD2 LEU A 42 0.029 3.144 -9.548 1.00 0.00 C ATOM 0 H LEU A 42 2.755 1.631 -12.084 1.00 0.00 H new ATOM 0 HA LEU A 42 0.486 3.632 -12.009 1.00 0.00 H new ATOM 0 HB2 LEU A 42 2.732 2.967 -10.236 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.880 4.608 -10.832 1.00 0.00 H new ATOM 0 HG LEU A 42 1.527 4.451 -8.717 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -0.364 5.840 -9.515 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.159 6.311 -10.306 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -0.034 5.327 -11.187 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.748 3.467 -8.854 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.416 2.938 -10.521 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.503 2.239 -9.167 1.00 0.00 H new ATOM 122 N MET A 43 1.787 5.282 -13.490 1.00 0.00 N ATOM 123 CA MET A 43 2.398 5.991 -14.656 1.00 0.00 C ATOM 124 C MET A 43 3.564 6.882 -14.219 1.00 0.00 C ATOM 125 O MET A 43 3.879 7.866 -14.859 1.00 0.00 O ATOM 126 CB MET A 43 1.267 6.831 -15.252 1.00 0.00 C ATOM 127 CG MET A 43 1.021 8.062 -14.377 1.00 0.00 C ATOM 128 SD MET A 43 -0.675 8.645 -14.623 1.00 0.00 S ATOM 129 CE MET A 43 -0.601 8.801 -16.424 1.00 0.00 C ATOM 0 H MET A 43 1.055 5.796 -12.999 1.00 0.00 H new ATOM 0 HA MET A 43 2.812 5.288 -15.379 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.525 7.139 -16.265 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.357 6.235 -15.322 1.00 0.00 H new ATOM 0 HG2 MET A 43 1.184 7.815 -13.328 1.00 0.00 H new ATOM 0 HG3 MET A 43 1.729 8.851 -14.632 1.00 0.00 H new ATOM 0 HE1 MET A 43 -1.382 9.482 -16.763 1.00 0.00 H new ATOM 0 HE2 MET A 43 0.373 9.193 -16.716 1.00 0.00 H new ATOM 0 HE3 MET A 43 -0.750 7.822 -16.880 1.00 0.00 H new ATOM 139 N LYS A 44 4.211 6.541 -13.144 1.00 0.00 N ATOM 140 CA LYS A 44 5.365 7.365 -12.673 1.00 0.00 C ATOM 141 C LYS A 44 6.661 6.911 -13.357 1.00 0.00 C ATOM 142 O LYS A 44 7.017 7.401 -14.405 1.00 0.00 O ATOM 143 CB LYS A 44 5.433 7.133 -11.166 1.00 0.00 C ATOM 144 CG LYS A 44 4.429 8.047 -10.461 1.00 0.00 C ATOM 145 CD LYS A 44 4.646 9.493 -10.912 1.00 0.00 C ATOM 146 CE LYS A 44 4.689 10.407 -9.688 1.00 0.00 C ATOM 147 NZ LYS A 44 6.018 10.153 -9.067 1.00 0.00 N ATOM 0 H LYS A 44 3.994 5.728 -12.568 1.00 0.00 H new ATOM 0 HA LYS A 44 5.241 8.421 -12.912 1.00 0.00 H new ATOM 0 HB2 LYS A 44 5.213 6.090 -10.938 1.00 0.00 H new ATOM 0 HB3 LYS A 44 6.441 7.333 -10.802 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.411 7.732 -10.692 1.00 0.00 H new ATOM 0 HG3 LYS A 44 4.549 7.971 -9.380 1.00 0.00 H new ATOM 0 HD2 LYS A 44 5.577 9.574 -11.473 1.00 0.00 H new ATOM 0 HD3 LYS A 44 3.843 9.801 -11.581 1.00 0.00 H new ATOM 0 HE2 LYS A 44 4.579 11.454 -9.972 1.00 0.00 H new ATOM 0 HE3 LYS A 44 3.879 10.178 -8.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 6.301 10.979 -8.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 5.960 9.316 -8.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 6.723 9.986 -9.813 1.00 0.00 H new ATOM 161 N SER A 45 7.362 5.975 -12.762 1.00 0.00 N ATOM 162 CA SER A 45 8.641 5.464 -13.361 1.00 0.00 C ATOM 163 C SER A 45 9.787 6.449 -13.127 1.00 0.00 C ATOM 164 O SER A 45 10.429 6.916 -14.046 1.00 0.00 O ATOM 165 CB SER A 45 8.357 5.283 -14.852 1.00 0.00 C ATOM 166 OG SER A 45 8.764 6.445 -15.565 1.00 0.00 O ATOM 0 H SER A 45 7.102 5.538 -11.878 1.00 0.00 H new ATOM 0 HA SER A 45 8.953 4.526 -12.902 1.00 0.00 H new ATOM 0 HB2 SER A 45 8.888 4.409 -15.229 1.00 0.00 H new ATOM 0 HB3 SER A 45 7.294 5.102 -15.010 1.00 0.00 H new ATOM 0 HG SER A 45 8.358 7.238 -15.157 1.00 0.00 H new ATOM 172 N ASP A 46 10.054 6.748 -11.890 1.00 0.00 N ATOM 173 CA ASP A 46 11.162 7.685 -11.558 1.00 0.00 C ATOM 174 C ASP A 46 11.536 7.492 -10.088 1.00 0.00 C ATOM 175 O ASP A 46 12.354 6.658 -9.751 1.00 0.00 O ATOM 176 CB ASP A 46 10.592 9.086 -11.800 1.00 0.00 C ATOM 177 CG ASP A 46 11.131 9.641 -13.120 1.00 0.00 C ATOM 178 OD1 ASP A 46 10.638 9.232 -14.159 1.00 0.00 O ATOM 179 OD2 ASP A 46 12.024 10.471 -13.070 1.00 0.00 O ATOM 0 H ASP A 46 9.547 6.380 -11.085 1.00 0.00 H new ATOM 0 HA ASP A 46 12.059 7.521 -12.155 1.00 0.00 H new ATOM 0 HB2 ASP A 46 9.503 9.046 -11.829 1.00 0.00 H new ATOM 0 HB3 ASP A 46 10.865 9.747 -10.978 1.00 0.00 H new ATOM 184 N GLU A 47 10.933 8.241 -9.210 1.00 0.00 N ATOM 185 CA GLU A 47 11.230 8.095 -7.776 1.00 0.00 C ATOM 186 C GLU A 47 11.045 6.658 -7.316 1.00 0.00 C ATOM 187 O GLU A 47 11.637 6.233 -6.345 1.00 0.00 O ATOM 188 CB GLU A 47 10.178 8.967 -7.106 1.00 0.00 C ATOM 189 CG GLU A 47 10.881 10.065 -6.353 1.00 0.00 C ATOM 190 CD GLU A 47 9.908 11.212 -6.074 1.00 0.00 C ATOM 191 OE1 GLU A 47 8.860 10.948 -5.507 1.00 0.00 O ATOM 192 OE2 GLU A 47 10.226 12.333 -6.434 1.00 0.00 O ATOM 0 H GLU A 47 10.240 8.954 -9.436 1.00 0.00 H new ATOM 0 HA GLU A 47 12.258 8.372 -7.541 1.00 0.00 H new ATOM 0 HB2 GLU A 47 9.505 9.389 -7.852 1.00 0.00 H new ATOM 0 HB3 GLU A 47 9.568 8.371 -6.427 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.278 9.678 -5.415 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.729 10.429 -6.932 1.00 0.00 H new ATOM 199 N ILE A 48 10.193 5.919 -7.967 1.00 0.00 N ATOM 200 CA ILE A 48 9.947 4.540 -7.488 1.00 0.00 C ATOM 201 C ILE A 48 11.077 3.593 -7.813 1.00 0.00 C ATOM 202 O ILE A 48 11.580 2.935 -6.929 1.00 0.00 O ATOM 203 CB ILE A 48 8.606 4.070 -8.023 1.00 0.00 C ATOM 204 CG1 ILE A 48 7.679 5.257 -8.234 1.00 0.00 C ATOM 205 CG2 ILE A 48 7.964 3.180 -6.972 1.00 0.00 C ATOM 206 CD1 ILE A 48 7.799 5.724 -9.660 1.00 0.00 C ATOM 0 H ILE A 48 9.668 6.205 -8.793 1.00 0.00 H new ATOM 0 HA ILE A 48 9.909 4.546 -6.399 1.00 0.00 H new ATOM 0 HB ILE A 48 8.761 3.545 -8.966 1.00 0.00 H new ATOM 0 HG12 ILE A 48 6.649 4.974 -8.016 1.00 0.00 H new ATOM 0 HG13 ILE A 48 7.940 6.065 -7.550 1.00 0.00 H new ATOM 0 HG21 ILE A 48 6.997 2.829 -7.334 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.610 2.325 -6.776 1.00 0.00 H new ATOM 0 HG23 ILE A 48 7.823 3.747 -6.052 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.138 6.575 -9.821 1.00 0.00 H new ATOM 0 HD12 ILE A 48 8.828 6.021 -9.860 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.518 4.914 -10.333 1.00 0.00 H new ATOM 218 N ASP A 49 11.519 3.521 -9.032 1.00 0.00 N ATOM 219 CA ASP A 49 12.670 2.616 -9.315 1.00 0.00 C ATOM 220 C ASP A 49 13.688 2.803 -8.184 1.00 0.00 C ATOM 221 O ASP A 49 14.387 1.892 -7.786 1.00 0.00 O ATOM 222 CB ASP A 49 13.241 3.082 -10.655 1.00 0.00 C ATOM 223 CG ASP A 49 14.557 2.353 -10.930 1.00 0.00 C ATOM 224 OD1 ASP A 49 14.552 1.133 -10.901 1.00 0.00 O ATOM 225 OD2 ASP A 49 15.546 3.027 -11.163 1.00 0.00 O ATOM 0 H ASP A 49 11.147 4.035 -9.831 1.00 0.00 H new ATOM 0 HA ASP A 49 12.399 1.562 -9.367 1.00 0.00 H new ATOM 0 HB2 ASP A 49 12.528 2.882 -11.455 1.00 0.00 H new ATOM 0 HB3 ASP A 49 13.407 4.159 -10.637 1.00 0.00 H new ATOM 230 N ALA A 50 13.714 3.993 -7.631 1.00 0.00 N ATOM 231 CA ALA A 50 14.622 4.285 -6.490 1.00 0.00 C ATOM 232 C ALA A 50 14.021 3.742 -5.198 1.00 0.00 C ATOM 233 O ALA A 50 14.649 2.962 -4.509 1.00 0.00 O ATOM 234 CB ALA A 50 14.736 5.808 -6.443 1.00 0.00 C ATOM 0 H ALA A 50 13.136 4.779 -7.929 1.00 0.00 H new ATOM 0 HA ALA A 50 15.600 3.818 -6.606 1.00 0.00 H new ATOM 0 HB1 ALA A 50 15.393 6.099 -5.623 1.00 0.00 H new ATOM 0 HB2 ALA A 50 15.148 6.171 -7.384 1.00 0.00 H new ATOM 0 HB3 ALA A 50 13.748 6.242 -6.288 1.00 0.00 H new ATOM 240 N ILE A 51 12.812 4.106 -4.850 1.00 0.00 N ATOM 241 CA ILE A 51 12.260 3.547 -3.625 1.00 0.00 C ATOM 242 C ILE A 51 12.053 2.056 -3.834 1.00 0.00 C ATOM 243 O ILE A 51 12.501 1.283 -3.051 1.00 0.00 O ATOM 244 CB ILE A 51 10.983 4.316 -3.356 1.00 0.00 C ATOM 245 CG1 ILE A 51 9.934 4.079 -4.430 1.00 0.00 C ATOM 246 CG2 ILE A 51 11.296 5.810 -3.231 1.00 0.00 C ATOM 247 CD1 ILE A 51 9.224 5.402 -4.799 1.00 0.00 C ATOM 0 H ILE A 51 12.211 4.752 -5.361 1.00 0.00 H new ATOM 0 HA ILE A 51 12.910 3.644 -2.756 1.00 0.00 H new ATOM 0 HB ILE A 51 10.565 3.951 -2.418 1.00 0.00 H new ATOM 0 HG12 ILE A 51 10.403 3.652 -5.316 1.00 0.00 H new ATOM 0 HG13 ILE A 51 9.202 3.353 -4.077 1.00 0.00 H new ATOM 0 HG21 ILE A 51 10.375 6.360 -3.038 1.00 0.00 H new ATOM 0 HG22 ILE A 51 11.993 5.968 -2.408 1.00 0.00 H new ATOM 0 HG23 ILE A 51 11.743 6.167 -4.159 1.00 0.00 H new ATOM 0 HD11 ILE A 51 8.477 5.211 -5.569 1.00 0.00 H new ATOM 0 HD12 ILE A 51 8.737 5.812 -3.915 1.00 0.00 H new ATOM 0 HD13 ILE A 51 9.957 6.116 -5.174 1.00 0.00 H new ATOM 259 N ILE A 52 11.457 1.630 -4.916 1.00 0.00 N ATOM 260 CA ILE A 52 11.338 0.156 -5.145 1.00 0.00 C ATOM 261 C ILE A 52 12.674 -0.483 -4.782 1.00 0.00 C ATOM 262 O ILE A 52 12.753 -1.516 -4.160 1.00 0.00 O ATOM 263 CB ILE A 52 11.101 -0.008 -6.630 1.00 0.00 C ATOM 264 CG1 ILE A 52 9.792 0.668 -7.031 1.00 0.00 C ATOM 265 CG2 ILE A 52 11.031 -1.496 -6.945 1.00 0.00 C ATOM 266 CD1 ILE A 52 8.641 0.073 -6.221 1.00 0.00 C ATOM 0 H ILE A 52 11.054 2.224 -5.640 1.00 0.00 H new ATOM 0 HA ILE A 52 10.542 -0.300 -4.557 1.00 0.00 H new ATOM 0 HB ILE A 52 11.914 0.456 -7.188 1.00 0.00 H new ATOM 0 HG12 ILE A 52 9.857 1.742 -6.856 1.00 0.00 H new ATOM 0 HG13 ILE A 52 9.610 0.529 -8.097 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.860 -1.634 -8.013 1.00 0.00 H new ATOM 0 HG22 ILE A 52 11.970 -1.972 -6.663 1.00 0.00 H new ATOM 0 HG23 ILE A 52 10.212 -1.948 -6.385 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.707 0.556 -6.508 1.00 0.00 H new ATOM 0 HD12 ILE A 52 8.572 -0.997 -6.418 1.00 0.00 H new ATOM 0 HD13 ILE A 52 8.822 0.235 -5.158 1.00 0.00 H new ATOM 278 N GLU A 53 13.734 0.160 -5.156 1.00 0.00 N ATOM 279 CA GLU A 53 15.072 -0.370 -4.820 1.00 0.00 C ATOM 280 C GLU A 53 15.257 -0.409 -3.303 1.00 0.00 C ATOM 281 O GLU A 53 15.331 -1.460 -2.709 1.00 0.00 O ATOM 282 CB GLU A 53 16.038 0.621 -5.455 1.00 0.00 C ATOM 283 CG GLU A 53 17.390 -0.055 -5.694 1.00 0.00 C ATOM 284 CD GLU A 53 17.882 0.279 -7.103 1.00 0.00 C ATOM 285 OE1 GLU A 53 17.980 1.455 -7.413 1.00 0.00 O ATOM 286 OE2 GLU A 53 18.152 -0.647 -7.852 1.00 0.00 O ATOM 0 H GLU A 53 13.731 1.034 -5.682 1.00 0.00 H new ATOM 0 HA GLU A 53 15.227 -1.387 -5.180 1.00 0.00 H new ATOM 0 HB2 GLU A 53 15.632 0.986 -6.398 1.00 0.00 H new ATOM 0 HB3 GLU A 53 16.164 1.487 -4.806 1.00 0.00 H new ATOM 0 HG2 GLU A 53 18.115 0.284 -4.954 1.00 0.00 H new ATOM 0 HG3 GLU A 53 17.295 -1.134 -5.576 1.00 0.00 H new ATOM 293 N ASP A 54 15.326 0.730 -2.669 1.00 0.00 N ATOM 294 CA ASP A 54 15.531 0.744 -1.181 1.00 0.00 C ATOM 295 C ASP A 54 14.251 0.377 -0.430 1.00 0.00 C ATOM 296 O ASP A 54 14.249 0.187 0.770 1.00 0.00 O ATOM 297 CB ASP A 54 15.928 2.178 -0.867 1.00 0.00 C ATOM 298 CG ASP A 54 16.518 2.253 0.542 1.00 0.00 C ATOM 299 OD1 ASP A 54 16.225 1.371 1.333 1.00 0.00 O ATOM 300 OD2 ASP A 54 17.254 3.189 0.806 1.00 0.00 O ATOM 0 H ASP A 54 15.251 1.648 -3.107 1.00 0.00 H new ATOM 0 HA ASP A 54 16.280 0.015 -0.873 1.00 0.00 H new ATOM 0 HB2 ASP A 54 16.657 2.532 -1.596 1.00 0.00 H new ATOM 0 HB3 ASP A 54 15.059 2.831 -0.943 1.00 0.00 H new ATOM 305 N ILE A 55 13.167 0.308 -1.128 1.00 0.00 N ATOM 306 CA ILE A 55 11.862 -0.008 -0.488 1.00 0.00 C ATOM 307 C ILE A 55 11.400 -1.425 -0.841 1.00 0.00 C ATOM 308 O ILE A 55 10.743 -2.092 -0.066 1.00 0.00 O ATOM 309 CB ILE A 55 10.912 1.051 -1.064 1.00 0.00 C ATOM 310 CG1 ILE A 55 9.858 1.428 -0.043 1.00 0.00 C ATOM 311 CG2 ILE A 55 10.202 0.506 -2.287 1.00 0.00 C ATOM 312 CD1 ILE A 55 10.516 2.123 1.149 1.00 0.00 C ATOM 0 H ILE A 55 13.122 0.459 -2.136 1.00 0.00 H new ATOM 0 HA ILE A 55 11.907 0.016 0.601 1.00 0.00 H new ATOM 0 HB ILE A 55 11.507 1.925 -1.328 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.118 2.087 -0.497 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.328 0.537 0.292 1.00 0.00 H new ATOM 0 HG21 ILE A 55 9.531 1.266 -2.687 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.938 0.236 -3.045 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.626 -0.377 -2.010 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.753 2.392 1.880 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.239 1.449 1.610 1.00 0.00 H new ATOM 0 HD13 ILE A 55 11.026 3.024 0.809 1.00 0.00 H new ATOM 324 N VAL A 56 11.694 -1.858 -2.032 1.00 0.00 N ATOM 325 CA VAL A 56 11.225 -3.195 -2.476 1.00 0.00 C ATOM 326 C VAL A 56 12.387 -4.155 -2.775 1.00 0.00 C ATOM 327 O VAL A 56 12.332 -5.311 -2.408 1.00 0.00 O ATOM 328 CB VAL A 56 10.404 -2.881 -3.726 1.00 0.00 C ATOM 329 CG1 VAL A 56 10.327 -4.104 -4.630 1.00 0.00 C ATOM 330 CG2 VAL A 56 8.996 -2.470 -3.293 1.00 0.00 C ATOM 0 H VAL A 56 12.241 -1.341 -2.720 1.00 0.00 H new ATOM 0 HA VAL A 56 10.650 -3.713 -1.708 1.00 0.00 H new ATOM 0 HB VAL A 56 10.879 -2.072 -4.281 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.739 -3.865 -5.516 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.333 -4.398 -4.930 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.854 -4.925 -4.092 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.396 -2.242 -4.174 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.532 -3.287 -2.740 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.054 -1.588 -2.656 1.00 0.00 H new ATOM 340 N LEU A 57 13.427 -3.709 -3.436 1.00 0.00 N ATOM 341 CA LEU A 57 14.562 -4.641 -3.732 1.00 0.00 C ATOM 342 C LEU A 57 14.842 -5.488 -2.496 1.00 0.00 C ATOM 343 O LEU A 57 14.801 -6.701 -2.528 1.00 0.00 O ATOM 344 CB LEU A 57 15.749 -3.741 -4.033 1.00 0.00 C ATOM 345 CG LEU A 57 16.930 -4.571 -4.509 1.00 0.00 C ATOM 346 CD1 LEU A 57 17.809 -3.706 -5.413 1.00 0.00 C ATOM 347 CD2 LEU A 57 17.732 -5.025 -3.288 1.00 0.00 C ATOM 0 H LEU A 57 13.540 -2.755 -3.779 1.00 0.00 H new ATOM 0 HA LEU A 57 14.350 -5.315 -4.562 1.00 0.00 H new ATOM 0 HB2 LEU A 57 15.477 -3.011 -4.796 1.00 0.00 H new ATOM 0 HB3 LEU A 57 16.025 -3.181 -3.140 1.00 0.00 H new ATOM 0 HG LEU A 57 16.585 -5.443 -5.065 1.00 0.00 H new ATOM 0 HD11 LEU A 57 18.660 -4.291 -5.761 1.00 0.00 H new ATOM 0 HD12 LEU A 57 17.227 -3.367 -6.270 1.00 0.00 H new ATOM 0 HD13 LEU A 57 18.167 -2.842 -4.853 1.00 0.00 H new ATOM 0 HD21 LEU A 57 18.584 -5.622 -3.614 1.00 0.00 H new ATOM 0 HD22 LEU A 57 18.089 -4.152 -2.742 1.00 0.00 H new ATOM 0 HD23 LEU A 57 17.096 -5.625 -2.637 1.00 0.00 H new ATOM 359 N LYS A 58 15.092 -4.837 -1.402 1.00 0.00 N ATOM 360 CA LYS A 58 15.342 -5.566 -0.129 1.00 0.00 C ATOM 361 C LYS A 58 14.007 -5.774 0.589 1.00 0.00 C ATOM 362 O LYS A 58 13.672 -6.863 1.008 1.00 0.00 O ATOM 363 CB LYS A 58 16.250 -4.647 0.689 1.00 0.00 C ATOM 364 CG LYS A 58 17.182 -5.491 1.562 1.00 0.00 C ATOM 365 CD LYS A 58 18.621 -5.352 1.062 1.00 0.00 C ATOM 366 CE LYS A 58 19.144 -3.951 1.389 1.00 0.00 C ATOM 367 NZ LYS A 58 20.627 -4.067 1.304 1.00 0.00 N ATOM 0 H LYS A 58 15.135 -3.820 -1.331 1.00 0.00 H new ATOM 0 HA LYS A 58 15.799 -6.544 -0.281 1.00 0.00 H new ATOM 0 HB2 LYS A 58 16.835 -4.011 0.024 1.00 0.00 H new ATOM 0 HB3 LYS A 58 15.648 -3.987 1.314 1.00 0.00 H new ATOM 0 HG2 LYS A 58 17.115 -5.168 2.601 1.00 0.00 H new ATOM 0 HG3 LYS A 58 16.876 -6.537 1.533 1.00 0.00 H new ATOM 0 HD2 LYS A 58 19.254 -6.106 1.530 1.00 0.00 H new ATOM 0 HD3 LYS A 58 18.661 -5.525 -0.013 1.00 0.00 H new ATOM 0 HE2 LYS A 58 18.764 -3.213 0.683 1.00 0.00 H new ATOM 0 HE3 LYS A 58 18.829 -3.633 2.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 21.060 -3.145 1.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 20.960 -4.772 1.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 20.898 -4.364 0.345 1.00 0.00 H new ATOM 381 N GLY A 59 13.235 -4.728 0.720 1.00 0.00 N ATOM 382 CA GLY A 59 11.913 -4.855 1.394 1.00 0.00 C ATOM 383 C GLY A 59 11.158 -6.048 0.804 1.00 0.00 C ATOM 384 O GLY A 59 10.660 -6.894 1.519 1.00 0.00 O ATOM 0 H GLY A 59 13.464 -3.791 0.389 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.050 -4.991 2.467 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.334 -3.941 1.260 1.00 0.00 H new ATOM 388 N GLY A 60 11.070 -6.125 -0.498 1.00 0.00 N ATOM 389 CA GLY A 60 10.348 -7.265 -1.128 1.00 0.00 C ATOM 390 C GLY A 60 11.281 -8.481 -1.251 1.00 0.00 C ATOM 391 O GLY A 60 11.070 -9.355 -2.067 1.00 0.00 O ATOM 0 H GLY A 60 11.467 -5.448 -1.150 1.00 0.00 H new ATOM 0 HA2 GLY A 60 9.475 -7.527 -0.531 1.00 0.00 H new ATOM 0 HA3 GLY A 60 9.985 -6.975 -2.114 1.00 0.00 H new ATOM 395 N LYS A 61 12.314 -8.547 -0.456 1.00 0.00 N ATOM 396 CA LYS A 61 13.246 -9.713 -0.542 1.00 0.00 C ATOM 397 C LYS A 61 13.052 -10.655 0.656 1.00 0.00 C ATOM 398 O LYS A 61 13.601 -11.738 0.696 1.00 0.00 O ATOM 399 CB LYS A 61 14.659 -9.106 -0.543 1.00 0.00 C ATOM 400 CG LYS A 61 15.172 -8.927 0.892 1.00 0.00 C ATOM 401 CD LYS A 61 16.004 -10.147 1.297 1.00 0.00 C ATOM 402 CE LYS A 61 17.161 -9.700 2.196 1.00 0.00 C ATOM 403 NZ LYS A 61 17.441 -10.870 3.076 1.00 0.00 N ATOM 0 H LYS A 61 12.554 -7.848 0.247 1.00 0.00 H new ATOM 0 HA LYS A 61 13.065 -10.312 -1.435 1.00 0.00 H new ATOM 0 HB2 LYS A 61 15.338 -9.752 -1.099 1.00 0.00 H new ATOM 0 HB3 LYS A 61 14.646 -8.143 -1.053 1.00 0.00 H new ATOM 0 HG2 LYS A 61 15.776 -8.023 0.963 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.332 -8.804 1.576 1.00 0.00 H new ATOM 0 HD2 LYS A 61 15.379 -10.869 1.823 1.00 0.00 H new ATOM 0 HD3 LYS A 61 16.391 -10.647 0.409 1.00 0.00 H new ATOM 0 HE2 LYS A 61 18.037 -9.431 1.606 1.00 0.00 H new ATOM 0 HE3 LYS A 61 16.889 -8.822 2.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 18.223 -10.640 3.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 16.591 -11.099 3.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 17.704 -11.689 2.491 1.00 0.00 H new ATOM 417 N ALA A 62 12.291 -10.248 1.636 1.00 0.00 N ATOM 418 CA ALA A 62 12.083 -11.105 2.819 1.00 0.00 C ATOM 419 C ALA A 62 10.802 -11.921 2.659 1.00 0.00 C ATOM 420 O ALA A 62 10.821 -13.051 2.213 1.00 0.00 O ATOM 421 CB ALA A 62 11.964 -10.139 3.998 1.00 0.00 C ATOM 0 H ALA A 62 11.805 -9.352 1.660 1.00 0.00 H new ATOM 0 HA ALA A 62 12.896 -11.816 2.961 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.807 -10.704 4.917 1.00 0.00 H new ATOM 0 HB2 ALA A 62 12.880 -9.554 4.083 1.00 0.00 H new ATOM 0 HB3 ALA A 62 11.120 -9.469 3.836 1.00 0.00 H new ATOM 427 N LYS A 63 9.687 -11.347 3.007 1.00 0.00 N ATOM 428 CA LYS A 63 8.398 -12.076 2.860 1.00 0.00 C ATOM 429 C LYS A 63 8.066 -12.189 1.378 1.00 0.00 C ATOM 430 O LYS A 63 7.473 -13.145 0.918 1.00 0.00 O ATOM 431 CB LYS A 63 7.368 -11.208 3.579 1.00 0.00 C ATOM 432 CG LYS A 63 7.190 -9.882 2.835 1.00 0.00 C ATOM 433 CD LYS A 63 6.731 -8.802 3.815 1.00 0.00 C ATOM 434 CE LYS A 63 7.911 -7.883 4.144 1.00 0.00 C ATOM 435 NZ LYS A 63 7.574 -7.279 5.463 1.00 0.00 N ATOM 0 H LYS A 63 9.612 -10.404 3.387 1.00 0.00 H new ATOM 0 HA LYS A 63 8.425 -13.084 3.273 1.00 0.00 H new ATOM 0 HB2 LYS A 63 6.415 -11.733 3.637 1.00 0.00 H new ATOM 0 HB3 LYS A 63 7.690 -11.019 4.603 1.00 0.00 H new ATOM 0 HG2 LYS A 63 8.129 -9.587 2.367 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.458 -9.997 2.036 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.915 -8.224 3.381 1.00 0.00 H new ATOM 0 HD3 LYS A 63 6.347 -9.261 4.726 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.845 -8.443 4.193 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.039 -7.116 3.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.337 -6.636 5.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 6.684 -6.747 5.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.465 -8.032 6.172 1.00 0.00 H new ATOM 449 N ASN A 64 8.465 -11.204 0.636 1.00 0.00 N ATOM 450 CA ASN A 64 8.212 -11.193 -0.831 1.00 0.00 C ATOM 451 C ASN A 64 9.130 -12.197 -1.535 1.00 0.00 C ATOM 452 O ASN A 64 10.339 -12.080 -1.482 1.00 0.00 O ATOM 453 CB ASN A 64 8.552 -9.767 -1.254 1.00 0.00 C ATOM 454 CG ASN A 64 7.262 -8.954 -1.401 1.00 0.00 C ATOM 455 OD1 ASN A 64 7.221 -7.986 -2.133 1.00 0.00 O ATOM 456 ND2 ASN A 64 6.200 -9.308 -0.728 1.00 0.00 N ATOM 0 H ASN A 64 8.966 -10.388 0.987 1.00 0.00 H new ATOM 0 HA ASN A 64 7.190 -11.473 -1.087 1.00 0.00 H new ATOM 0 HB2 ASN A 64 9.204 -9.303 -0.514 1.00 0.00 H new ATOM 0 HB3 ASN A 64 9.097 -9.777 -2.198 1.00 0.00 H new ATOM 0 HD21 ASN A 64 5.337 -8.771 -0.818 1.00 0.00 H new ATOM 0 HD22 ASN A 64 6.234 -10.121 -0.113 1.00 0.00 H new ATOM 463 N PRO A 65 8.515 -13.152 -2.173 1.00 0.00 N ATOM 464 CA PRO A 65 9.260 -14.203 -2.909 1.00 0.00 C ATOM 465 C PRO A 65 10.055 -13.601 -4.075 1.00 0.00 C ATOM 466 O PRO A 65 11.201 -13.941 -4.292 1.00 0.00 O ATOM 467 CB PRO A 65 8.141 -15.115 -3.412 1.00 0.00 C ATOM 468 CG PRO A 65 6.948 -14.238 -3.467 1.00 0.00 C ATOM 469 CD PRO A 65 7.070 -13.355 -2.280 1.00 0.00 C ATOM 0 HA PRO A 65 9.998 -14.723 -2.298 1.00 0.00 H new ATOM 0 HB2 PRO A 65 8.376 -15.528 -4.393 1.00 0.00 H new ATOM 0 HB3 PRO A 65 7.983 -15.959 -2.740 1.00 0.00 H new ATOM 0 HG2 PRO A 65 6.925 -13.659 -4.390 1.00 0.00 H new ATOM 0 HG3 PRO A 65 6.027 -14.820 -3.434 1.00 0.00 H new ATOM 0 HD2 PRO A 65 6.539 -12.414 -2.420 1.00 0.00 H new ATOM 0 HD3 PRO A 65 6.660 -13.822 -1.385 1.00 0.00 H new ATOM 477 N SER A 66 9.465 -12.704 -4.819 1.00 0.00 N ATOM 478 CA SER A 66 10.197 -12.083 -5.953 1.00 0.00 C ATOM 479 C SER A 66 9.296 -11.110 -6.669 1.00 0.00 C ATOM 480 O SER A 66 8.296 -11.453 -7.267 1.00 0.00 O ATOM 481 CB SER A 66 10.622 -13.230 -6.865 1.00 0.00 C ATOM 482 OG SER A 66 12.028 -13.178 -7.063 1.00 0.00 O ATOM 0 H SER A 66 8.508 -12.377 -4.688 1.00 0.00 H new ATOM 0 HA SER A 66 11.069 -11.520 -5.620 1.00 0.00 H new ATOM 0 HB2 SER A 66 10.341 -14.185 -6.422 1.00 0.00 H new ATOM 0 HB3 SER A 66 10.106 -13.159 -7.822 1.00 0.00 H new ATOM 0 HG SER A 66 12.485 -13.376 -6.219 1.00 0.00 H new ATOM 488 N ILE A 67 9.648 -9.887 -6.544 1.00 0.00 N ATOM 489 CA ILE A 67 8.870 -8.797 -7.117 1.00 0.00 C ATOM 490 C ILE A 67 9.517 -8.269 -8.395 1.00 0.00 C ATOM 491 O ILE A 67 10.702 -8.001 -8.440 1.00 0.00 O ATOM 492 CB ILE A 67 8.924 -7.780 -5.990 1.00 0.00 C ATOM 493 CG1 ILE A 67 7.838 -8.115 -4.965 1.00 0.00 C ATOM 494 CG2 ILE A 67 8.715 -6.363 -6.532 1.00 0.00 C ATOM 495 CD1 ILE A 67 7.882 -9.616 -4.657 1.00 0.00 C ATOM 0 H ILE A 67 10.484 -9.586 -6.043 1.00 0.00 H new ATOM 0 HA ILE A 67 7.859 -9.069 -7.420 1.00 0.00 H new ATOM 0 HB ILE A 67 9.905 -7.821 -5.516 1.00 0.00 H new ATOM 0 HG12 ILE A 67 7.993 -7.540 -4.052 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.857 -7.840 -5.353 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.757 -5.649 -5.710 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.497 -6.131 -7.255 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.742 -6.299 -7.018 1.00 0.00 H new ATOM 0 HD11 ILE A 67 7.110 -9.860 -3.927 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.707 -10.181 -5.573 1.00 0.00 H new ATOM 0 HD13 ILE A 67 8.860 -9.876 -4.252 1.00 0.00 H new ATOM 507 N VAL A 68 8.749 -8.108 -9.433 1.00 0.00 N ATOM 508 CA VAL A 68 9.335 -7.583 -10.703 1.00 0.00 C ATOM 509 C VAL A 68 9.202 -6.055 -10.746 1.00 0.00 C ATOM 510 O VAL A 68 8.112 -5.519 -10.780 1.00 0.00 O ATOM 511 CB VAL A 68 8.553 -8.259 -11.847 1.00 0.00 C ATOM 512 CG1 VAL A 68 8.161 -7.236 -12.924 1.00 0.00 C ATOM 513 CG2 VAL A 68 9.436 -9.328 -12.490 1.00 0.00 C ATOM 0 H VAL A 68 7.750 -8.314 -9.462 1.00 0.00 H new ATOM 0 HA VAL A 68 10.399 -7.805 -10.789 1.00 0.00 H new ATOM 0 HB VAL A 68 7.647 -8.701 -11.432 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.611 -7.738 -13.720 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.533 -6.463 -12.480 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.061 -6.780 -13.337 1.00 0.00 H new ATOM 0 HG21 VAL A 68 8.890 -9.811 -13.300 1.00 0.00 H new ATOM 0 HG22 VAL A 68 10.339 -8.864 -12.887 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.709 -10.072 -11.742 1.00 0.00 H new ATOM 523 N VAL A 69 10.301 -5.351 -10.754 1.00 0.00 N ATOM 524 CA VAL A 69 10.223 -3.865 -10.805 1.00 0.00 C ATOM 525 C VAL A 69 10.338 -3.384 -12.253 1.00 0.00 C ATOM 526 O VAL A 69 11.420 -3.253 -12.793 1.00 0.00 O ATOM 527 CB VAL A 69 11.404 -3.370 -9.974 1.00 0.00 C ATOM 528 CG1 VAL A 69 11.418 -1.840 -9.974 1.00 0.00 C ATOM 529 CG2 VAL A 69 11.261 -3.876 -8.537 1.00 0.00 C ATOM 0 H VAL A 69 11.244 -5.739 -10.728 1.00 0.00 H new ATOM 0 HA VAL A 69 9.276 -3.487 -10.419 1.00 0.00 H new ATOM 0 HB VAL A 69 12.334 -3.744 -10.402 1.00 0.00 H new ATOM 0 HG11 VAL A 69 12.261 -1.484 -9.381 1.00 0.00 H new ATOM 0 HG12 VAL A 69 11.515 -1.477 -10.997 1.00 0.00 H new ATOM 0 HG13 VAL A 69 10.488 -1.468 -9.544 1.00 0.00 H new ATOM 0 HG21 VAL A 69 12.103 -3.524 -7.942 1.00 0.00 H new ATOM 0 HG22 VAL A 69 10.332 -3.499 -8.109 1.00 0.00 H new ATOM 0 HG23 VAL A 69 11.246 -4.966 -8.535 1.00 0.00 H new ATOM 539 N GLU A 70 9.228 -3.126 -12.888 1.00 0.00 N ATOM 540 CA GLU A 70 9.264 -2.658 -14.303 1.00 0.00 C ATOM 541 C GLU A 70 9.297 -1.128 -14.360 1.00 0.00 C ATOM 542 O GLU A 70 8.663 -0.453 -13.573 1.00 0.00 O ATOM 543 CB GLU A 70 7.966 -3.172 -14.922 1.00 0.00 C ATOM 544 CG GLU A 70 7.772 -4.648 -14.596 1.00 0.00 C ATOM 545 CD GLU A 70 8.929 -5.457 -15.181 1.00 0.00 C ATOM 546 OE1 GLU A 70 10.016 -5.381 -14.631 1.00 0.00 O ATOM 547 OE2 GLU A 70 8.710 -6.144 -16.165 1.00 0.00 O ATOM 0 H GLU A 70 8.295 -3.219 -12.487 1.00 0.00 H new ATOM 0 HA GLU A 70 10.148 -3.019 -14.828 1.00 0.00 H new ATOM 0 HB2 GLU A 70 7.122 -2.595 -14.544 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.990 -3.031 -16.003 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.725 -4.789 -13.516 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.825 -5.000 -15.005 1.00 0.00 H new ATOM 554 N ASP A 71 10.021 -0.578 -15.296 1.00 0.00 N ATOM 555 CA ASP A 71 10.087 0.907 -15.417 1.00 0.00 C ATOM 556 C ASP A 71 10.056 1.309 -16.895 1.00 0.00 C ATOM 557 O ASP A 71 11.003 1.094 -17.624 1.00 0.00 O ATOM 558 CB ASP A 71 11.420 1.297 -14.777 1.00 0.00 C ATOM 559 CG ASP A 71 11.217 1.530 -13.279 1.00 0.00 C ATOM 560 OD1 ASP A 71 10.663 2.559 -12.929 1.00 0.00 O ATOM 561 OD2 ASP A 71 11.616 0.675 -12.506 1.00 0.00 O ATOM 0 H ASP A 71 10.571 -1.093 -15.983 1.00 0.00 H new ATOM 0 HA ASP A 71 9.247 1.405 -14.933 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.157 0.510 -14.937 1.00 0.00 H new ATOM 0 HB3 ASP A 71 11.811 2.200 -15.247 1.00 0.00 H new ATOM 566 N LYS A 72 8.971 1.881 -17.344 1.00 0.00 N ATOM 567 CA LYS A 72 8.883 2.281 -18.779 1.00 0.00 C ATOM 568 C LYS A 72 8.544 3.770 -18.909 1.00 0.00 C ATOM 569 O LYS A 72 8.616 4.520 -17.955 1.00 0.00 O ATOM 570 CB LYS A 72 7.758 1.425 -19.360 1.00 0.00 C ATOM 571 CG LYS A 72 8.209 0.828 -20.695 1.00 0.00 C ATOM 572 CD LYS A 72 7.071 0.931 -21.714 1.00 0.00 C ATOM 573 CE LYS A 72 6.366 -0.423 -21.832 1.00 0.00 C ATOM 574 NZ LYS A 72 7.291 -1.270 -22.636 1.00 0.00 N ATOM 0 H LYS A 72 8.145 2.088 -16.782 1.00 0.00 H new ATOM 0 HA LYS A 72 9.828 2.130 -19.301 1.00 0.00 H new ATOM 0 HB2 LYS A 72 7.496 0.629 -18.663 1.00 0.00 H new ATOM 0 HB3 LYS A 72 6.863 2.030 -19.504 1.00 0.00 H new ATOM 0 HG2 LYS A 72 9.089 1.356 -21.063 1.00 0.00 H new ATOM 0 HG3 LYS A 72 8.497 -0.215 -20.560 1.00 0.00 H new ATOM 0 HD2 LYS A 72 6.360 1.697 -21.405 1.00 0.00 H new ATOM 0 HD3 LYS A 72 7.464 1.234 -22.684 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.183 -0.860 -20.850 1.00 0.00 H new ATOM 0 HE3 LYS A 72 5.397 -0.322 -22.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 6.805 -1.595 -23.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 8.129 -0.714 -22.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 7.586 -2.093 -22.073 1.00 0.00 H new ATOM 588 N ALA A 73 8.177 4.200 -20.086 1.00 0.00 N ATOM 589 CA ALA A 73 7.834 5.638 -20.290 1.00 0.00 C ATOM 590 C ALA A 73 6.779 6.083 -19.277 1.00 0.00 C ATOM 591 O ALA A 73 5.623 5.719 -19.367 1.00 0.00 O ATOM 592 CB ALA A 73 7.279 5.716 -21.713 1.00 0.00 C ATOM 0 H ALA A 73 8.100 3.616 -20.918 1.00 0.00 H new ATOM 0 HA ALA A 73 8.697 6.290 -20.153 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.003 6.746 -21.940 1.00 0.00 H new ATOM 0 HB2 ALA A 73 8.039 5.380 -22.419 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.399 5.078 -21.796 1.00 0.00 H new ATOM 598 N GLY A 74 7.171 6.869 -18.313 1.00 0.00 N ATOM 599 CA GLY A 74 6.200 7.344 -17.288 1.00 0.00 C ATOM 600 C GLY A 74 5.301 6.193 -16.861 1.00 0.00 C ATOM 601 O GLY A 74 4.100 6.327 -16.742 1.00 0.00 O ATOM 0 H GLY A 74 8.127 7.204 -18.191 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.733 7.741 -16.424 1.00 0.00 H new ATOM 0 HA3 GLY A 74 5.598 8.158 -17.693 1.00 0.00 H new ATOM 605 N PHE A 75 5.888 5.065 -16.630 1.00 0.00 N ATOM 606 CA PHE A 75 5.094 3.875 -16.203 1.00 0.00 C ATOM 607 C PHE A 75 5.874 3.012 -15.201 1.00 0.00 C ATOM 608 O PHE A 75 6.525 2.055 -15.571 1.00 0.00 O ATOM 609 CB PHE A 75 4.839 3.092 -17.492 1.00 0.00 C ATOM 610 CG PHE A 75 3.631 3.666 -18.194 1.00 0.00 C ATOM 611 CD1 PHE A 75 2.457 3.912 -17.474 1.00 0.00 C ATOM 612 CD2 PHE A 75 3.689 3.954 -19.563 1.00 0.00 C ATOM 613 CE1 PHE A 75 1.338 4.447 -18.124 1.00 0.00 C ATOM 614 CE2 PHE A 75 2.569 4.490 -20.212 1.00 0.00 C ATOM 615 CZ PHE A 75 1.394 4.736 -19.493 1.00 0.00 C ATOM 0 H PHE A 75 6.892 4.906 -16.717 1.00 0.00 H new ATOM 0 HA PHE A 75 4.172 4.167 -15.700 1.00 0.00 H new ATOM 0 HB2 PHE A 75 5.712 3.146 -18.143 1.00 0.00 H new ATOM 0 HB3 PHE A 75 4.676 2.039 -17.265 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.414 3.690 -16.418 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.596 3.763 -20.118 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.431 4.637 -17.569 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.613 4.713 -21.268 1.00 0.00 H new ATOM 0 HZ PHE A 75 0.531 5.149 -19.994 1.00 0.00 H new ATOM 625 N TRP A 76 5.794 3.325 -13.931 1.00 0.00 N ATOM 626 CA TRP A 76 6.513 2.496 -12.914 1.00 0.00 C ATOM 627 C TRP A 76 5.661 1.255 -12.602 1.00 0.00 C ATOM 628 O TRP A 76 4.839 1.258 -11.708 1.00 0.00 O ATOM 629 CB TRP A 76 6.678 3.416 -11.683 1.00 0.00 C ATOM 630 CG TRP A 76 6.636 2.646 -10.427 1.00 0.00 C ATOM 631 CD1 TRP A 76 7.533 1.722 -10.079 1.00 0.00 C ATOM 632 CD2 TRP A 76 5.692 2.743 -9.322 1.00 0.00 C ATOM 633 NE1 TRP A 76 7.189 1.216 -8.862 1.00 0.00 N ATOM 634 CE2 TRP A 76 6.059 1.803 -8.349 1.00 0.00 C ATOM 635 CE3 TRP A 76 4.563 3.532 -9.081 1.00 0.00 C ATOM 636 CZ2 TRP A 76 5.337 1.639 -7.166 1.00 0.00 C ATOM 637 CZ3 TRP A 76 3.829 3.381 -7.893 1.00 0.00 C ATOM 638 CH2 TRP A 76 4.214 2.431 -6.939 1.00 0.00 C ATOM 0 H TRP A 76 5.266 4.113 -13.556 1.00 0.00 H new ATOM 0 HA TRP A 76 7.486 2.137 -13.249 1.00 0.00 H new ATOM 0 HB2 TRP A 76 7.625 3.952 -11.752 1.00 0.00 H new ATOM 0 HB3 TRP A 76 5.887 4.166 -11.679 1.00 0.00 H new ATOM 0 HD1 TRP A 76 8.390 1.424 -10.665 1.00 0.00 H new ATOM 0 HE1 TRP A 76 7.713 0.482 -8.385 1.00 0.00 H new ATOM 0 HE3 TRP A 76 4.253 4.263 -9.813 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 5.646 0.906 -6.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 2.963 4.001 -7.714 1.00 0.00 H new ATOM 0 HH2 TRP A 76 3.642 2.313 -6.030 1.00 0.00 H new ATOM 649 N TRP A 77 5.841 0.202 -13.359 1.00 0.00 N ATOM 650 CA TRP A 77 5.033 -1.036 -13.140 1.00 0.00 C ATOM 651 C TRP A 77 5.734 -1.985 -12.159 1.00 0.00 C ATOM 652 O TRP A 77 6.862 -2.384 -12.376 1.00 0.00 O ATOM 653 CB TRP A 77 4.958 -1.698 -14.519 1.00 0.00 C ATOM 654 CG TRP A 77 3.873 -1.079 -15.339 1.00 0.00 C ATOM 655 CD1 TRP A 77 3.631 0.249 -15.432 1.00 0.00 C ATOM 656 CD2 TRP A 77 2.893 -1.736 -16.194 1.00 0.00 C ATOM 657 NE1 TRP A 77 2.563 0.447 -16.288 1.00 0.00 N ATOM 658 CE2 TRP A 77 2.073 -0.745 -16.781 1.00 0.00 C ATOM 659 CE3 TRP A 77 2.636 -3.082 -16.511 1.00 0.00 C ATOM 660 CZ2 TRP A 77 1.035 -1.076 -17.653 1.00 0.00 C ATOM 661 CZ3 TRP A 77 1.591 -3.418 -17.388 1.00 0.00 C ATOM 662 CH2 TRP A 77 0.793 -2.417 -17.958 1.00 0.00 C ATOM 0 H TRP A 77 6.515 0.147 -14.122 1.00 0.00 H new ATOM 0 HA TRP A 77 4.054 -0.807 -12.719 1.00 0.00 H new ATOM 0 HB2 TRP A 77 5.914 -1.593 -15.032 1.00 0.00 H new ATOM 0 HB3 TRP A 77 4.772 -2.766 -14.406 1.00 0.00 H new ATOM 0 HD1 TRP A 77 4.181 1.026 -14.922 1.00 0.00 H new ATOM 0 HE1 TRP A 77 2.183 1.363 -16.526 1.00 0.00 H new ATOM 0 HE3 TRP A 77 3.245 -3.862 -16.078 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 0.423 -0.300 -18.089 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 1.401 -4.455 -17.624 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -0.008 -2.682 -18.632 1.00 0.00 H new ATOM 673 N ILE A 78 5.074 -2.373 -11.099 1.00 0.00 N ATOM 674 CA ILE A 78 5.712 -3.316 -10.137 1.00 0.00 C ATOM 675 C ILE A 78 4.923 -4.621 -10.078 1.00 0.00 C ATOM 676 O ILE A 78 3.710 -4.630 -10.123 1.00 0.00 O ATOM 677 CB ILE A 78 5.675 -2.616 -8.781 1.00 0.00 C ATOM 678 CG1 ILE A 78 6.440 -1.311 -8.853 1.00 0.00 C ATOM 679 CG2 ILE A 78 6.302 -3.516 -7.715 1.00 0.00 C ATOM 680 CD1 ILE A 78 7.732 -1.530 -9.612 1.00 0.00 C ATOM 0 H ILE A 78 4.127 -2.079 -10.860 1.00 0.00 H new ATOM 0 HA ILE A 78 6.731 -3.564 -10.433 1.00 0.00 H new ATOM 0 HB ILE A 78 4.637 -2.411 -8.517 1.00 0.00 H new ATOM 0 HG12 ILE A 78 5.838 -0.550 -9.349 1.00 0.00 H new ATOM 0 HG13 ILE A 78 6.652 -0.945 -7.849 1.00 0.00 H new ATOM 0 HG21 ILE A 78 6.273 -3.011 -6.749 1.00 0.00 H new ATOM 0 HG22 ILE A 78 5.744 -4.450 -7.653 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.337 -3.729 -7.982 1.00 0.00 H new ATOM 0 HD11 ILE A 78 8.286 -0.593 -9.666 1.00 0.00 H new ATOM 0 HD12 ILE A 78 8.334 -2.278 -9.097 1.00 0.00 H new ATOM 0 HD13 ILE A 78 7.507 -1.877 -10.620 1.00 0.00 H new ATOM 692 N LYS A 79 5.607 -5.718 -9.970 1.00 0.00 N ATOM 693 CA LYS A 79 4.904 -7.029 -9.900 1.00 0.00 C ATOM 694 C LYS A 79 5.297 -7.756 -8.613 1.00 0.00 C ATOM 695 O LYS A 79 6.456 -8.021 -8.369 1.00 0.00 O ATOM 696 CB LYS A 79 5.375 -7.796 -11.142 1.00 0.00 C ATOM 697 CG LYS A 79 5.374 -9.309 -10.875 1.00 0.00 C ATOM 698 CD LYS A 79 4.841 -10.046 -12.105 1.00 0.00 C ATOM 699 CE LYS A 79 5.966 -10.867 -12.740 1.00 0.00 C ATOM 700 NZ LYS A 79 5.478 -11.194 -14.109 1.00 0.00 N ATOM 0 H LYS A 79 6.625 -5.768 -9.927 1.00 0.00 H new ATOM 0 HA LYS A 79 3.819 -6.929 -9.884 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.722 -7.570 -11.985 1.00 0.00 H new ATOM 0 HB3 LYS A 79 6.378 -7.471 -11.419 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.384 -9.649 -10.644 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.755 -9.535 -10.007 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.016 -10.700 -11.821 1.00 0.00 H new ATOM 0 HD3 LYS A 79 4.447 -9.331 -12.827 1.00 0.00 H new ATOM 0 HE2 LYS A 79 6.896 -10.300 -12.777 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.167 -11.772 -12.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 6.196 -11.757 -14.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.595 -11.740 -14.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 5.302 -10.314 -14.634 1.00 0.00 H new ATOM 714 N ALA A 80 4.340 -8.086 -7.794 1.00 0.00 N ATOM 715 CA ALA A 80 4.662 -8.799 -6.532 1.00 0.00 C ATOM 716 C ALA A 80 3.779 -10.043 -6.392 1.00 0.00 C ATOM 717 O ALA A 80 2.622 -10.037 -6.765 1.00 0.00 O ATOM 718 CB ALA A 80 4.357 -7.796 -5.420 1.00 0.00 C ATOM 0 H ALA A 80 3.350 -7.892 -7.945 1.00 0.00 H new ATOM 0 HA ALA A 80 5.698 -9.137 -6.500 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.570 -8.250 -4.452 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.977 -6.909 -5.550 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.305 -7.513 -5.464 1.00 0.00 H new ATOM 724 N ASP A 81 4.309 -11.110 -5.858 1.00 0.00 N ATOM 725 CA ASP A 81 3.487 -12.346 -5.700 1.00 0.00 C ATOM 726 C ASP A 81 2.747 -12.313 -4.363 1.00 0.00 C ATOM 727 O ASP A 81 2.779 -13.253 -3.595 1.00 0.00 O ATOM 728 CB ASP A 81 4.484 -13.503 -5.736 1.00 0.00 C ATOM 729 CG ASP A 81 5.245 -13.481 -7.063 1.00 0.00 C ATOM 730 OD1 ASP A 81 4.649 -13.104 -8.059 1.00 0.00 O ATOM 731 OD2 ASP A 81 6.410 -13.842 -7.061 1.00 0.00 O ATOM 0 H ASP A 81 5.271 -11.180 -5.526 1.00 0.00 H new ATOM 0 HA ASP A 81 2.733 -12.443 -6.481 1.00 0.00 H new ATOM 0 HB2 ASP A 81 5.182 -13.421 -4.903 1.00 0.00 H new ATOM 0 HB3 ASP A 81 3.960 -14.452 -5.621 1.00 0.00 H new ATOM 736 N GLY A 82 2.084 -11.228 -4.085 1.00 0.00 N ATOM 737 CA GLY A 82 1.340 -11.107 -2.817 1.00 0.00 C ATOM 738 C GLY A 82 0.471 -9.851 -2.857 1.00 0.00 C ATOM 739 O GLY A 82 0.218 -9.294 -3.907 1.00 0.00 O ATOM 0 H GLY A 82 2.029 -10.412 -4.695 1.00 0.00 H new ATOM 0 HA2 GLY A 82 0.718 -11.988 -2.662 1.00 0.00 H new ATOM 0 HA3 GLY A 82 2.034 -11.056 -1.978 1.00 0.00 H new ATOM 743 N ALA A 83 0.015 -9.395 -1.724 1.00 0.00 N ATOM 744 CA ALA A 83 -0.830 -8.169 -1.706 1.00 0.00 C ATOM 745 C ALA A 83 0.035 -6.940 -1.986 1.00 0.00 C ATOM 746 O ALA A 83 1.224 -6.937 -1.736 1.00 0.00 O ATOM 747 CB ALA A 83 -1.411 -8.105 -0.293 1.00 0.00 C ATOM 0 H ALA A 83 0.190 -9.817 -0.812 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.613 -8.192 -2.464 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -2.048 -7.225 -0.201 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.001 -9.001 -0.101 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.599 -8.043 0.432 1.00 0.00 H new ATOM 753 N ILE A 84 -0.548 -5.897 -2.504 1.00 0.00 N ATOM 754 CA ILE A 84 0.247 -4.673 -2.802 1.00 0.00 C ATOM 755 C ILE A 84 -0.523 -3.426 -2.374 1.00 0.00 C ATOM 756 O ILE A 84 -1.734 -3.436 -2.283 1.00 0.00 O ATOM 757 CB ILE A 84 0.436 -4.686 -4.316 1.00 0.00 C ATOM 758 CG1 ILE A 84 1.296 -3.493 -4.726 1.00 0.00 C ATOM 759 CG2 ILE A 84 -0.927 -4.595 -5.003 1.00 0.00 C ATOM 760 CD1 ILE A 84 2.768 -3.867 -4.583 1.00 0.00 C ATOM 0 H ILE A 84 -1.540 -5.838 -2.734 1.00 0.00 H new ATOM 0 HA ILE A 84 1.198 -4.659 -2.269 1.00 0.00 H new ATOM 0 HB ILE A 84 0.928 -5.611 -4.615 1.00 0.00 H new ATOM 0 HG12 ILE A 84 1.078 -3.209 -5.756 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.065 -2.630 -4.101 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -0.791 -4.604 -6.084 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -1.541 -5.446 -4.707 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -1.422 -3.670 -4.708 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.389 -3.020 -4.874 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.977 -4.131 -3.546 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.991 -4.718 -5.226 1.00 0.00 H new ATOM 772 N GLU A 85 0.165 -2.349 -2.113 1.00 0.00 N ATOM 773 CA GLU A 85 -0.530 -1.122 -1.700 1.00 0.00 C ATOM 774 C GLU A 85 -0.218 0.031 -2.653 1.00 0.00 C ATOM 775 O GLU A 85 0.801 0.052 -3.316 1.00 0.00 O ATOM 776 CB GLU A 85 -0.026 -0.814 -0.294 1.00 0.00 C ATOM 777 CG GLU A 85 -0.288 -2.012 0.620 1.00 0.00 C ATOM 778 CD GLU A 85 0.192 -1.685 2.035 1.00 0.00 C ATOM 779 OE1 GLU A 85 0.869 -0.681 2.191 1.00 0.00 O ATOM 780 OE2 GLU A 85 -0.125 -2.442 2.936 1.00 0.00 O ATOM 0 H GLU A 85 1.181 -2.276 -2.171 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.612 -1.252 -1.718 1.00 0.00 H new ATOM 0 HB2 GLU A 85 1.040 -0.590 -0.320 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.528 0.071 0.097 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.352 -2.250 0.631 1.00 0.00 H new ATOM 0 HG3 GLU A 85 0.232 -2.892 0.242 1.00 0.00 H new ATOM 787 N ILE A 86 -1.095 0.990 -2.721 1.00 0.00 N ATOM 788 CA ILE A 86 -0.882 2.141 -3.610 1.00 0.00 C ATOM 789 C ILE A 86 -1.780 3.308 -3.174 1.00 0.00 C ATOM 790 O ILE A 86 -2.869 3.109 -2.674 1.00 0.00 O ATOM 791 CB ILE A 86 -1.213 1.619 -5.001 1.00 0.00 C ATOM 792 CG1 ILE A 86 -0.410 2.389 -6.023 1.00 0.00 C ATOM 793 CG2 ILE A 86 -2.680 1.809 -5.286 1.00 0.00 C ATOM 794 CD1 ILE A 86 -0.929 3.804 -6.028 1.00 0.00 C ATOM 0 H ILE A 86 -1.963 1.017 -2.185 1.00 0.00 H new ATOM 0 HA ILE A 86 0.134 2.534 -3.583 1.00 0.00 H new ATOM 0 HB ILE A 86 -0.969 0.558 -5.053 1.00 0.00 H new ATOM 0 HG12 ILE A 86 0.651 2.370 -5.772 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -0.512 1.939 -7.010 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -2.909 1.433 -6.283 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -3.268 1.262 -4.549 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -2.927 2.869 -5.233 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -0.372 4.393 -6.756 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -1.986 3.803 -6.294 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.805 4.241 -5.037 1.00 0.00 H new ATOM 806 N ASP A 87 -1.328 4.522 -3.346 1.00 0.00 N ATOM 807 CA ASP A 87 -2.160 5.688 -2.923 1.00 0.00 C ATOM 808 C ASP A 87 -2.385 6.657 -4.069 1.00 0.00 C ATOM 809 O ASP A 87 -1.851 6.512 -5.150 1.00 0.00 O ATOM 810 CB ASP A 87 -1.345 6.409 -1.863 1.00 0.00 C ATOM 811 CG ASP A 87 -1.250 5.551 -0.601 1.00 0.00 C ATOM 812 OD1 ASP A 87 -1.257 4.338 -0.730 1.00 0.00 O ATOM 813 OD2 ASP A 87 -1.176 6.121 0.475 1.00 0.00 O ATOM 0 H ASP A 87 -0.425 4.757 -3.758 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.134 5.346 -2.572 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -0.346 6.622 -2.243 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.807 7.367 -1.627 1.00 0.00 H new ATOM 818 N ALA A 88 -3.159 7.670 -3.812 1.00 0.00 N ATOM 819 CA ALA A 88 -3.412 8.691 -4.858 1.00 0.00 C ATOM 820 C ALA A 88 -3.425 10.118 -4.250 1.00 0.00 C ATOM 821 O ALA A 88 -3.349 11.115 -4.956 1.00 0.00 O ATOM 822 CB ALA A 88 -4.777 8.313 -5.455 1.00 0.00 C ATOM 0 H ALA A 88 -3.628 7.834 -2.921 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.632 8.706 -5.619 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.040 9.022 -6.240 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.725 7.309 -5.876 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.536 8.340 -4.673 1.00 0.00 H new ATOM 828 N ALA A 89 -3.510 10.227 -2.944 1.00 0.00 N ATOM 829 CA ALA A 89 -3.519 11.569 -2.289 1.00 0.00 C ATOM 830 C ALA A 89 -2.391 12.450 -2.830 1.00 0.00 C ATOM 831 O ALA A 89 -2.593 13.607 -3.143 1.00 0.00 O ATOM 832 CB ALA A 89 -3.310 11.268 -0.812 1.00 0.00 C ATOM 0 H ALA A 89 -3.574 9.437 -2.302 1.00 0.00 H new ATOM 0 HA ALA A 89 -4.443 12.116 -2.476 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -3.302 12.201 -0.248 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -4.119 10.633 -0.452 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -2.358 10.754 -0.676 1.00 0.00 H new ATOM 838 N GLU A 90 -1.205 11.920 -2.941 1.00 0.00 N ATOM 839 CA GLU A 90 -0.075 12.744 -3.465 1.00 0.00 C ATOM 840 C GLU A 90 -0.495 13.416 -4.771 1.00 0.00 C ATOM 841 O GLU A 90 -0.134 14.540 -5.055 1.00 0.00 O ATOM 842 CB GLU A 90 1.071 11.759 -3.706 1.00 0.00 C ATOM 843 CG GLU A 90 2.159 12.435 -4.544 1.00 0.00 C ATOM 844 CD GLU A 90 3.145 11.380 -5.049 1.00 0.00 C ATOM 845 OE1 GLU A 90 3.965 10.938 -4.261 1.00 0.00 O ATOM 846 OE2 GLU A 90 3.064 11.033 -6.216 1.00 0.00 O ATOM 0 H GLU A 90 -0.968 10.959 -2.694 1.00 0.00 H new ATOM 0 HA GLU A 90 0.220 13.533 -2.774 1.00 0.00 H new ATOM 0 HB2 GLU A 90 1.485 11.426 -2.754 1.00 0.00 H new ATOM 0 HB3 GLU A 90 0.700 10.872 -4.220 1.00 0.00 H new ATOM 0 HG2 GLU A 90 1.710 12.961 -5.387 1.00 0.00 H new ATOM 0 HG3 GLU A 90 2.683 13.181 -3.946 1.00 0.00 H new ATOM 853 N ALA A 91 -1.268 12.741 -5.565 1.00 0.00 N ATOM 854 CA ALA A 91 -1.723 13.357 -6.838 1.00 0.00 C ATOM 855 C ALA A 91 -2.676 14.505 -6.518 1.00 0.00 C ATOM 856 O ALA A 91 -2.747 15.483 -7.226 1.00 0.00 O ATOM 857 CB ALA A 91 -2.437 12.236 -7.593 1.00 0.00 C ATOM 0 H ALA A 91 -1.604 11.794 -5.391 1.00 0.00 H new ATOM 0 HA ALA A 91 -0.907 13.768 -7.433 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -2.803 12.615 -8.547 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -1.741 11.416 -7.771 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -3.277 11.876 -7.000 1.00 0.00 H new ATOM 863 N GLY A 92 -3.405 14.399 -5.445 1.00 0.00 N ATOM 864 CA GLY A 92 -4.343 15.502 -5.085 1.00 0.00 C ATOM 865 C GLY A 92 -3.531 16.712 -4.676 1.00 0.00 C ATOM 866 O GLY A 92 -3.583 17.750 -5.306 1.00 0.00 O ATOM 0 H GLY A 92 -3.395 13.605 -4.805 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.984 15.745 -5.932 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.997 15.192 -4.270 1.00 0.00 H new ATOM 870 N GLU A 93 -2.756 16.579 -3.645 1.00 0.00 N ATOM 871 CA GLU A 93 -1.903 17.717 -3.216 1.00 0.00 C ATOM 872 C GLU A 93 -1.241 18.304 -4.463 1.00 0.00 C ATOM 873 O GLU A 93 -0.944 19.478 -4.538 1.00 0.00 O ATOM 874 CB GLU A 93 -0.866 17.104 -2.273 1.00 0.00 C ATOM 875 CG GLU A 93 -0.079 16.026 -3.012 1.00 0.00 C ATOM 876 CD GLU A 93 1.217 15.728 -2.256 1.00 0.00 C ATOM 877 OE1 GLU A 93 1.188 14.878 -1.381 1.00 0.00 O ATOM 878 OE2 GLU A 93 2.217 16.352 -2.567 1.00 0.00 O ATOM 0 H GLU A 93 -2.674 15.734 -3.080 1.00 0.00 H new ATOM 0 HA GLU A 93 -2.451 18.517 -2.718 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -0.190 17.877 -1.908 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -1.360 16.675 -1.401 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -0.678 15.119 -3.099 1.00 0.00 H new ATOM 0 HG3 GLU A 93 0.147 16.357 -4.026 1.00 0.00 H new ATOM 885 N LEU A 94 -1.045 17.476 -5.460 1.00 0.00 N ATOM 886 CA LEU A 94 -0.442 17.952 -6.733 1.00 0.00 C ATOM 887 C LEU A 94 -1.435 18.884 -7.438 1.00 0.00 C ATOM 888 O LEU A 94 -1.243 20.083 -7.494 1.00 0.00 O ATOM 889 CB LEU A 94 -0.211 16.679 -7.551 1.00 0.00 C ATOM 890 CG LEU A 94 0.920 16.902 -8.549 1.00 0.00 C ATOM 891 CD1 LEU A 94 0.965 15.726 -9.527 1.00 0.00 C ATOM 892 CD2 LEU A 94 0.666 18.200 -9.318 1.00 0.00 C ATOM 0 H LEU A 94 -1.281 16.484 -5.441 1.00 0.00 H new ATOM 0 HA LEU A 94 0.484 18.510 -6.591 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.036 15.850 -6.888 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.124 16.404 -8.079 1.00 0.00 H new ATOM 0 HG LEU A 94 1.871 16.974 -8.021 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.772 15.879 -10.244 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.139 14.801 -8.977 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.016 15.658 -10.059 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.473 18.363 -10.033 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.282 18.128 -9.851 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.626 19.035 -8.619 1.00 0.00 H new ATOM 904 N LEU A 95 -2.510 18.347 -7.961 1.00 0.00 N ATOM 905 CA LEU A 95 -3.521 19.217 -8.640 1.00 0.00 C ATOM 906 C LEU A 95 -4.671 19.499 -7.675 1.00 0.00 C ATOM 907 O LEU A 95 -5.101 20.623 -7.509 1.00 0.00 O ATOM 908 CB LEU A 95 -4.043 18.441 -9.855 1.00 0.00 C ATOM 909 CG LEU A 95 -3.073 17.333 -10.252 1.00 0.00 C ATOM 910 CD1 LEU A 95 -3.508 16.030 -9.583 1.00 0.00 C ATOM 911 CD2 LEU A 95 -3.095 17.173 -11.767 1.00 0.00 C ATOM 0 H LEU A 95 -2.731 17.351 -7.948 1.00 0.00 H new ATOM 0 HA LEU A 95 -3.082 20.166 -8.948 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -5.018 18.011 -9.625 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.185 19.123 -10.693 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.062 17.583 -9.932 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -2.820 15.231 -9.861 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -3.499 16.156 -8.500 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.515 15.772 -9.910 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.404 16.382 -12.059 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.103 16.912 -12.091 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -2.794 18.110 -12.236 1.00 0.00 H new ATOM 923 N GLY A 96 -5.154 18.479 -7.021 1.00 0.00 N ATOM 924 CA GLY A 96 -6.266 18.674 -6.035 1.00 0.00 C ATOM 925 C GLY A 96 -7.643 18.451 -6.685 1.00 0.00 C ATOM 926 O GLY A 96 -8.527 19.276 -6.580 1.00 0.00 O ATOM 0 H GLY A 96 -4.830 17.517 -7.123 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -6.140 17.983 -5.202 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -6.216 19.682 -5.623 1.00 0.00 H new ATOM 930 N LYS A 97 -7.835 17.343 -7.348 1.00 0.00 N ATOM 931 CA LYS A 97 -9.169 17.071 -7.997 1.00 0.00 C ATOM 932 C LYS A 97 -9.476 15.537 -7.930 1.00 0.00 C ATOM 933 O LYS A 97 -9.251 14.954 -6.891 1.00 0.00 O ATOM 934 CB LYS A 97 -8.971 17.648 -9.405 1.00 0.00 C ATOM 935 CG LYS A 97 -7.731 17.025 -10.054 1.00 0.00 C ATOM 936 CD LYS A 97 -7.689 17.406 -11.534 1.00 0.00 C ATOM 937 CE LYS A 97 -6.248 17.330 -12.042 1.00 0.00 C ATOM 938 NZ LYS A 97 -6.350 17.492 -13.520 1.00 0.00 N ATOM 0 H LYS A 97 -7.135 16.612 -7.473 1.00 0.00 H new ATOM 0 HA LYS A 97 -10.041 17.522 -7.523 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -9.851 17.449 -10.016 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.859 18.731 -9.351 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -6.829 17.374 -9.551 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.756 15.941 -9.947 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -8.325 16.734 -12.111 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -8.081 18.414 -11.672 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -5.632 18.114 -11.601 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -5.787 16.377 -11.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -5.400 17.451 -13.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -6.936 16.728 -13.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -6.786 18.410 -13.739 1.00 0.00 H new ATOM 952 N PRO A 98 -9.957 14.883 -8.991 1.00 0.00 N ATOM 953 CA PRO A 98 -10.199 13.412 -8.884 1.00 0.00 C ATOM 954 C PRO A 98 -8.852 12.687 -8.850 1.00 0.00 C ATOM 955 O PRO A 98 -8.785 11.479 -8.750 1.00 0.00 O ATOM 956 CB PRO A 98 -10.994 13.075 -10.136 1.00 0.00 C ATOM 957 CG PRO A 98 -10.652 14.142 -11.117 1.00 0.00 C ATOM 958 CD PRO A 98 -10.313 15.382 -10.331 1.00 0.00 C ATOM 0 HA PRO A 98 -10.735 13.114 -7.983 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -10.728 12.089 -10.518 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -12.064 13.058 -9.930 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -9.809 13.838 -11.737 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -11.490 14.330 -11.788 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -9.485 15.926 -10.785 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -11.159 16.068 -10.287 1.00 0.00 H new ATOM 966 N PHE A 99 -7.787 13.450 -8.914 1.00 0.00 N ATOM 967 CA PHE A 99 -6.405 12.906 -8.863 1.00 0.00 C ATOM 968 C PHE A 99 -6.352 11.571 -8.132 1.00 0.00 C ATOM 969 O PHE A 99 -5.636 10.672 -8.500 1.00 0.00 O ATOM 970 CB PHE A 99 -5.640 13.963 -8.043 1.00 0.00 C ATOM 971 CG PHE A 99 -5.934 13.760 -6.560 1.00 0.00 C ATOM 972 CD1 PHE A 99 -5.293 12.733 -5.853 1.00 0.00 C ATOM 973 CD2 PHE A 99 -6.863 14.575 -5.900 1.00 0.00 C ATOM 974 CE1 PHE A 99 -5.578 12.526 -4.505 1.00 0.00 C ATOM 975 CE2 PHE A 99 -7.148 14.366 -4.545 1.00 0.00 C ATOM 976 CZ PHE A 99 -6.505 13.340 -3.848 1.00 0.00 C ATOM 0 H PHE A 99 -7.828 14.465 -9.003 1.00 0.00 H new ATOM 0 HA PHE A 99 -5.999 12.727 -9.859 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.569 13.879 -8.228 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -5.939 14.965 -8.351 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -4.576 12.100 -6.355 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -7.361 15.368 -6.438 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.081 11.733 -3.966 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -7.864 14.997 -4.039 1.00 0.00 H new ATOM 0 HZ PHE A 99 -6.724 13.176 -2.803 1.00 0.00 H new ATOM 986 N SER A 100 -7.065 11.458 -7.060 1.00 0.00 N ATOM 987 CA SER A 100 -6.996 10.213 -6.286 1.00 0.00 C ATOM 988 C SER A 100 -7.341 9.052 -7.203 1.00 0.00 C ATOM 989 O SER A 100 -6.561 8.144 -7.463 1.00 0.00 O ATOM 990 CB SER A 100 -8.053 10.367 -5.193 1.00 0.00 C ATOM 991 OG SER A 100 -7.426 10.814 -3.996 1.00 0.00 O ATOM 0 H SER A 100 -7.690 12.174 -6.690 1.00 0.00 H new ATOM 0 HA SER A 100 -6.010 10.024 -5.861 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.816 11.080 -5.506 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.557 9.416 -5.021 1.00 0.00 H new ATOM 0 HG SER A 100 -6.980 11.671 -4.161 1.00 0.00 H new ATOM 997 N VAL A 101 -8.528 9.089 -7.686 1.00 0.00 N ATOM 998 CA VAL A 101 -9.011 8.017 -8.560 1.00 0.00 C ATOM 999 C VAL A 101 -8.692 8.259 -10.035 1.00 0.00 C ATOM 1000 O VAL A 101 -8.272 7.359 -10.732 1.00 0.00 O ATOM 1001 CB VAL A 101 -10.465 8.002 -8.271 1.00 0.00 C ATOM 1002 CG1 VAL A 101 -11.094 6.814 -8.980 1.00 0.00 C ATOM 1003 CG2 VAL A 101 -10.643 7.866 -6.755 1.00 0.00 C ATOM 0 H VAL A 101 -9.201 9.835 -7.508 1.00 0.00 H new ATOM 0 HA VAL A 101 -8.529 7.058 -8.371 1.00 0.00 H new ATOM 0 HB VAL A 101 -10.944 8.917 -8.620 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -12.164 6.793 -8.775 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -10.932 6.904 -10.054 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -10.637 5.892 -8.620 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -11.706 7.852 -6.513 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -10.182 6.938 -6.416 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -10.168 8.711 -6.256 1.00 0.00 H new ATOM 1013 N TYR A 102 -8.847 9.446 -10.535 1.00 0.00 N ATOM 1014 CA TYR A 102 -8.488 9.648 -11.964 1.00 0.00 C ATOM 1015 C TYR A 102 -7.067 9.116 -12.159 1.00 0.00 C ATOM 1016 O TYR A 102 -6.761 8.419 -13.116 1.00 0.00 O ATOM 1017 CB TYR A 102 -8.537 11.159 -12.193 1.00 0.00 C ATOM 1018 CG TYR A 102 -8.909 11.450 -13.630 1.00 0.00 C ATOM 1019 CD1 TYR A 102 -10.256 11.581 -13.993 1.00 0.00 C ATOM 1020 CD2 TYR A 102 -7.908 11.593 -14.598 1.00 0.00 C ATOM 1021 CE1 TYR A 102 -10.601 11.858 -15.322 1.00 0.00 C ATOM 1022 CE2 TYR A 102 -8.252 11.872 -15.927 1.00 0.00 C ATOM 1023 CZ TYR A 102 -9.599 12.003 -16.289 1.00 0.00 C ATOM 1024 OH TYR A 102 -9.938 12.280 -17.599 1.00 0.00 O ATOM 0 H TYR A 102 -9.196 10.265 -10.037 1.00 0.00 H new ATOM 0 HA TYR A 102 -9.154 9.135 -12.658 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -9.264 11.614 -11.521 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -7.568 11.602 -11.962 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -11.029 11.468 -13.247 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -6.870 11.488 -14.320 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -11.639 11.960 -15.601 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -7.479 11.986 -16.672 1.00 0.00 H new ATOM 0 HH TYR A 102 -9.124 12.350 -18.140 1.00 0.00 H new ATOM 1034 N ASP A 103 -6.202 9.423 -11.229 1.00 0.00 N ATOM 1035 CA ASP A 103 -4.804 8.937 -11.323 1.00 0.00 C ATOM 1036 C ASP A 103 -4.778 7.412 -11.308 1.00 0.00 C ATOM 1037 O ASP A 103 -4.133 6.806 -12.138 1.00 0.00 O ATOM 1038 CB ASP A 103 -4.079 9.511 -10.106 1.00 0.00 C ATOM 1039 CG ASP A 103 -2.571 9.307 -10.253 1.00 0.00 C ATOM 1040 OD1 ASP A 103 -1.955 10.086 -10.964 1.00 0.00 O ATOM 1041 OD2 ASP A 103 -2.055 8.382 -9.649 1.00 0.00 O ATOM 0 H ASP A 103 -6.409 9.991 -10.408 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.323 9.253 -12.249 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -4.303 10.573 -10.006 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -4.434 9.024 -9.198 1.00 0.00 H new ATOM 1046 N LEU A 104 -5.470 6.755 -10.401 1.00 0.00 N ATOM 1047 CA LEU A 104 -5.403 5.269 -10.457 1.00 0.00 C ATOM 1048 C LEU A 104 -6.239 4.757 -11.636 1.00 0.00 C ATOM 1049 O LEU A 104 -5.829 3.872 -12.351 1.00 0.00 O ATOM 1050 CB LEU A 104 -5.910 4.749 -9.108 1.00 0.00 C ATOM 1051 CG LEU A 104 -7.371 5.123 -8.896 1.00 0.00 C ATOM 1052 CD1 LEU A 104 -8.275 4.052 -9.511 1.00 0.00 C ATOM 1053 CD2 LEU A 104 -7.641 5.220 -7.393 1.00 0.00 C ATOM 0 H LEU A 104 -6.047 7.162 -9.665 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.387 4.911 -10.622 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.798 3.666 -9.066 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.304 5.164 -8.303 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.580 6.080 -9.375 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.319 4.325 -9.356 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -8.074 3.976 -10.580 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -8.077 3.091 -9.035 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -8.685 5.487 -7.227 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -7.434 4.258 -6.923 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.997 5.983 -6.956 1.00 0.00 H new ATOM 1065 N LEU A 105 -7.394 5.316 -11.871 1.00 0.00 N ATOM 1066 CA LEU A 105 -8.216 4.843 -13.029 1.00 0.00 C ATOM 1067 C LEU A 105 -7.382 4.825 -14.311 1.00 0.00 C ATOM 1068 O LEU A 105 -7.734 4.185 -15.282 1.00 0.00 O ATOM 1069 CB LEU A 105 -9.343 5.862 -13.178 1.00 0.00 C ATOM 1070 CG LEU A 105 -10.231 5.838 -11.943 1.00 0.00 C ATOM 1071 CD1 LEU A 105 -11.065 7.118 -11.897 1.00 0.00 C ATOM 1072 CD2 LEU A 105 -11.158 4.622 -12.004 1.00 0.00 C ATOM 0 H LEU A 105 -7.804 6.071 -11.321 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.587 3.832 -12.860 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -8.927 6.860 -13.318 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -9.934 5.636 -14.066 1.00 0.00 H new ATOM 0 HG LEU A 105 -9.612 5.774 -11.048 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -11.703 7.105 -11.013 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -10.403 7.983 -11.854 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -11.685 7.181 -12.791 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -11.794 4.605 -11.119 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -11.780 4.683 -12.897 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -10.561 3.711 -12.039 1.00 0.00 H new ATOM 1084 N ILE A 106 -6.293 5.539 -14.334 1.00 0.00 N ATOM 1085 CA ILE A 106 -5.458 5.580 -15.561 1.00 0.00 C ATOM 1086 C ILE A 106 -4.349 4.525 -15.488 1.00 0.00 C ATOM 1087 O ILE A 106 -4.143 3.766 -16.414 1.00 0.00 O ATOM 1088 CB ILE A 106 -4.905 7.006 -15.586 1.00 0.00 C ATOM 1089 CG1 ILE A 106 -5.752 7.856 -16.537 1.00 0.00 C ATOM 1090 CG2 ILE A 106 -3.450 7.020 -16.057 1.00 0.00 C ATOM 1091 CD1 ILE A 106 -6.854 8.565 -15.747 1.00 0.00 C ATOM 0 H ILE A 106 -5.946 6.097 -13.554 1.00 0.00 H new ATOM 0 HA ILE A 106 -6.013 5.351 -16.471 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.946 7.413 -14.576 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -5.124 8.589 -17.043 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.192 7.226 -17.310 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.080 8.045 -16.066 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.842 6.421 -15.379 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.389 6.604 -17.062 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -7.456 9.170 -16.425 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -7.488 7.823 -15.262 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.403 9.208 -14.991 1.00 0.00 H new ATOM 1103 N ASN A 107 -3.624 4.478 -14.405 1.00 0.00 N ATOM 1104 CA ASN A 107 -2.528 3.480 -14.303 1.00 0.00 C ATOM 1105 C ASN A 107 -2.953 2.263 -13.475 1.00 0.00 C ATOM 1106 O ASN A 107 -2.275 1.258 -13.457 1.00 0.00 O ATOM 1107 CB ASN A 107 -1.392 4.222 -13.613 1.00 0.00 C ATOM 1108 CG ASN A 107 -1.884 4.808 -12.302 1.00 0.00 C ATOM 1109 OD1 ASN A 107 -1.980 6.009 -12.154 1.00 0.00 O ATOM 1110 ND2 ASN A 107 -2.186 4.004 -11.332 1.00 0.00 N ATOM 0 H ASN A 107 -3.743 5.083 -13.593 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.244 3.094 -15.282 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -0.560 3.542 -13.429 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.018 5.016 -14.259 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -2.506 4.379 -10.439 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.104 2.996 -11.461 1.00 0.00 H new ATOM 1117 N VAL A 108 -4.064 2.320 -12.793 1.00 0.00 N ATOM 1118 CA VAL A 108 -4.480 1.134 -11.990 1.00 0.00 C ATOM 1119 C VAL A 108 -4.787 -0.043 -12.918 1.00 0.00 C ATOM 1120 O VAL A 108 -5.044 -1.138 -12.471 1.00 0.00 O ATOM 1121 CB VAL A 108 -5.741 1.555 -11.228 1.00 0.00 C ATOM 1122 CG1 VAL A 108 -6.936 1.592 -12.185 1.00 0.00 C ATOM 1123 CG2 VAL A 108 -6.019 0.540 -10.117 1.00 0.00 C ATOM 0 H VAL A 108 -4.693 3.122 -12.756 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.693 0.816 -11.306 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.590 2.545 -10.799 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.830 1.892 -11.639 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.741 2.308 -12.983 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.088 0.602 -12.615 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -6.915 0.834 -9.571 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -6.169 -0.447 -10.555 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -5.171 0.509 -9.432 1.00 0.00 H new ATOM 1133 N SER A 109 -4.775 0.189 -14.205 1.00 0.00 N ATOM 1134 CA SER A 109 -5.075 -0.902 -15.187 1.00 0.00 C ATOM 1135 C SER A 109 -4.581 -2.257 -14.703 1.00 0.00 C ATOM 1136 O SER A 109 -5.177 -3.276 -14.989 1.00 0.00 O ATOM 1137 CB SER A 109 -4.329 -0.497 -16.456 1.00 0.00 C ATOM 1138 OG SER A 109 -5.049 -0.955 -17.594 1.00 0.00 O ATOM 0 H SER A 109 -4.568 1.096 -14.624 1.00 0.00 H new ATOM 0 HA SER A 109 -6.149 -1.011 -15.338 1.00 0.00 H new ATOM 0 HB2 SER A 109 -4.217 0.587 -16.495 1.00 0.00 H new ATOM 0 HB3 SER A 109 -3.325 -0.922 -16.452 1.00 0.00 H new ATOM 0 HG SER A 109 -4.572 -0.694 -18.410 1.00 0.00 H new ATOM 1144 N SER A 110 -3.522 -2.293 -13.964 1.00 0.00 N ATOM 1145 CA SER A 110 -3.040 -3.606 -13.465 1.00 0.00 C ATOM 1146 C SER A 110 -3.790 -3.967 -12.185 1.00 0.00 C ATOM 1147 O SER A 110 -3.278 -4.667 -11.333 1.00 0.00 O ATOM 1148 CB SER A 110 -1.553 -3.415 -13.188 1.00 0.00 C ATOM 1149 OG SER A 110 -1.390 -2.715 -11.961 1.00 0.00 O ATOM 0 H SER A 110 -2.970 -1.483 -13.683 1.00 0.00 H new ATOM 0 HA SER A 110 -3.207 -4.413 -14.179 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.054 -4.383 -13.137 1.00 0.00 H new ATOM 0 HB3 SER A 110 -1.088 -2.859 -14.002 1.00 0.00 H new ATOM 0 HG SER A 110 -1.329 -3.357 -11.224 1.00 0.00 H new ATOM 1155 N THR A 111 -4.996 -3.486 -12.036 1.00 0.00 N ATOM 1156 CA THR A 111 -5.763 -3.799 -10.799 1.00 0.00 C ATOM 1157 C THR A 111 -6.060 -5.298 -10.713 1.00 0.00 C ATOM 1158 O THR A 111 -6.062 -5.878 -9.646 1.00 0.00 O ATOM 1159 CB THR A 111 -7.051 -2.995 -10.916 1.00 0.00 C ATOM 1160 OG1 THR A 111 -7.858 -3.218 -9.767 1.00 0.00 O ATOM 1161 CG2 THR A 111 -7.797 -3.438 -12.162 1.00 0.00 C ATOM 0 H THR A 111 -5.479 -2.895 -12.713 1.00 0.00 H new ATOM 0 HA THR A 111 -5.207 -3.543 -9.897 1.00 0.00 H new ATOM 0 HB THR A 111 -6.819 -1.932 -10.986 1.00 0.00 H new ATOM 0 HG1 THR A 111 -8.486 -2.474 -9.659 1.00 0.00 H new ATOM 0 HG21 THR A 111 -8.721 -2.868 -12.255 1.00 0.00 H new ATOM 0 HG22 THR A 111 -7.174 -3.265 -13.040 1.00 0.00 H new ATOM 0 HG23 THR A 111 -8.032 -4.500 -12.087 1.00 0.00 H new ATOM 1169 N VAL A 112 -6.312 -5.934 -11.826 1.00 0.00 N ATOM 1170 CA VAL A 112 -6.609 -7.395 -11.793 1.00 0.00 C ATOM 1171 C VAL A 112 -7.735 -7.672 -10.788 1.00 0.00 C ATOM 1172 O VAL A 112 -8.899 -7.668 -11.136 1.00 0.00 O ATOM 1173 CB VAL A 112 -5.297 -8.053 -11.353 1.00 0.00 C ATOM 1174 CG1 VAL A 112 -5.477 -9.570 -11.283 1.00 0.00 C ATOM 1175 CG2 VAL A 112 -4.200 -7.719 -12.368 1.00 0.00 C ATOM 0 H VAL A 112 -6.325 -5.507 -12.752 1.00 0.00 H new ATOM 0 HA VAL A 112 -6.945 -7.782 -12.755 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.017 -7.678 -10.369 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.541 -10.033 -10.970 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -6.260 -9.811 -10.564 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.758 -9.949 -12.266 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -3.264 -8.185 -12.059 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -4.486 -8.096 -13.350 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -4.068 -6.638 -12.418 1.00 0.00 H new ATOM 1185 N GLY A 113 -7.403 -7.895 -9.543 1.00 0.00 N ATOM 1186 CA GLY A 113 -8.463 -8.152 -8.528 1.00 0.00 C ATOM 1187 C GLY A 113 -8.964 -6.812 -7.984 1.00 0.00 C ATOM 1188 O GLY A 113 -8.983 -6.584 -6.792 1.00 0.00 O ATOM 0 H GLY A 113 -6.447 -7.910 -9.188 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -9.286 -8.709 -8.976 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -8.068 -8.764 -7.717 1.00 0.00 H new ATOM 1192 N ARG A 114 -9.394 -5.939 -8.859 1.00 0.00 N ATOM 1193 CA ARG A 114 -9.917 -4.620 -8.430 1.00 0.00 C ATOM 1194 C ARG A 114 -9.005 -3.969 -7.379 1.00 0.00 C ATOM 1195 O ARG A 114 -8.011 -4.532 -6.964 1.00 0.00 O ATOM 1196 CB ARG A 114 -11.276 -4.977 -7.870 1.00 0.00 C ATOM 1197 CG ARG A 114 -11.803 -3.848 -6.983 1.00 0.00 C ATOM 1198 CD ARG A 114 -13.194 -4.214 -6.462 1.00 0.00 C ATOM 1199 NE ARG A 114 -14.055 -3.048 -6.805 1.00 0.00 N ATOM 1200 CZ ARG A 114 -15.354 -3.170 -6.787 1.00 0.00 C ATOM 1201 NH1 ARG A 114 -15.983 -3.599 -7.847 1.00 0.00 N ATOM 1202 NH2 ARG A 114 -16.025 -2.866 -5.711 1.00 0.00 N ATOM 0 H ARG A 114 -9.402 -6.093 -9.867 1.00 0.00 H new ATOM 0 HA ARG A 114 -9.967 -3.884 -9.232 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -11.975 -5.163 -8.686 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -11.207 -5.899 -7.293 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -11.123 -3.680 -6.148 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -11.848 -2.918 -7.549 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -13.562 -5.127 -6.929 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -13.179 -4.390 -5.386 1.00 0.00 H new ATOM 0 HE ARG A 114 -13.630 -2.155 -7.054 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -15.459 -3.839 -8.689 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -16.998 -3.695 -7.834 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -15.534 -2.532 -4.881 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -17.040 -2.962 -5.699 1.00 0.00 H new ATOM 1216 N ALA A 115 -9.322 -2.771 -6.965 1.00 0.00 N ATOM 1217 CA ALA A 115 -8.465 -2.076 -5.962 1.00 0.00 C ATOM 1218 C ALA A 115 -9.311 -1.535 -4.810 1.00 0.00 C ATOM 1219 O ALA A 115 -10.110 -0.637 -4.982 1.00 0.00 O ATOM 1220 CB ALA A 115 -7.823 -0.926 -6.732 1.00 0.00 C ATOM 0 H ALA A 115 -10.137 -2.244 -7.278 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.727 -2.745 -5.520 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -7.173 -0.360 -6.065 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -7.236 -1.325 -7.559 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -8.601 -0.270 -7.123 1.00 0.00 H new ATOM 1226 N TYR A 116 -9.125 -2.061 -3.631 1.00 0.00 N ATOM 1227 CA TYR A 116 -9.905 -1.556 -2.470 1.00 0.00 C ATOM 1228 C TYR A 116 -9.426 -0.147 -2.130 1.00 0.00 C ATOM 1229 O TYR A 116 -8.263 0.073 -1.857 1.00 0.00 O ATOM 1230 CB TYR A 116 -9.600 -2.522 -1.325 1.00 0.00 C ATOM 1231 CG TYR A 116 -10.445 -3.765 -1.477 1.00 0.00 C ATOM 1232 CD1 TYR A 116 -11.841 -3.665 -1.476 1.00 0.00 C ATOM 1233 CD2 TYR A 116 -9.832 -5.014 -1.622 1.00 0.00 C ATOM 1234 CE1 TYR A 116 -12.625 -4.818 -1.616 1.00 0.00 C ATOM 1235 CE2 TYR A 116 -10.615 -6.166 -1.763 1.00 0.00 C ATOM 1236 CZ TYR A 116 -12.012 -6.068 -1.761 1.00 0.00 C ATOM 1237 OH TYR A 116 -12.784 -7.205 -1.900 1.00 0.00 O ATOM 0 H TYR A 116 -8.470 -2.815 -3.423 1.00 0.00 H new ATOM 0 HA TYR A 116 -10.976 -1.506 -2.667 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -8.542 -2.785 -1.329 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -9.806 -2.044 -0.367 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -12.314 -2.700 -1.367 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -8.755 -5.090 -1.625 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -13.702 -4.742 -1.612 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -10.142 -7.130 -1.873 1.00 0.00 H new ATOM 0 HH TYR A 116 -12.201 -7.987 -1.991 1.00 0.00 H new ATOM 1247 N THR A 117 -10.303 0.813 -2.165 1.00 0.00 N ATOM 1248 CA THR A 117 -9.877 2.206 -1.864 1.00 0.00 C ATOM 1249 C THR A 117 -9.755 2.421 -0.353 1.00 0.00 C ATOM 1250 O THR A 117 -10.007 1.534 0.437 1.00 0.00 O ATOM 1251 CB THR A 117 -10.978 3.091 -2.452 1.00 0.00 C ATOM 1252 OG1 THR A 117 -11.324 2.614 -3.745 1.00 0.00 O ATOM 1253 CG2 THR A 117 -10.481 4.534 -2.552 1.00 0.00 C ATOM 0 H THR A 117 -11.291 0.696 -2.388 1.00 0.00 H new ATOM 0 HA THR A 117 -8.899 2.436 -2.287 1.00 0.00 H new ATOM 0 HB THR A 117 -11.855 3.059 -1.805 1.00 0.00 H new ATOM 0 HG1 THR A 117 -12.030 3.178 -4.124 1.00 0.00 H new ATOM 0 HG21 THR A 117 -11.268 5.162 -2.971 1.00 0.00 H new ATOM 0 HG22 THR A 117 -10.217 4.898 -1.559 1.00 0.00 H new ATOM 0 HG23 THR A 117 -9.603 4.573 -3.197 1.00 0.00 H new ATOM 1261 N LEU A 118 -9.359 3.597 0.048 1.00 0.00 N ATOM 1262 CA LEU A 118 -9.202 3.887 1.499 1.00 0.00 C ATOM 1263 C LEU A 118 -9.297 5.379 1.754 1.00 0.00 C ATOM 1264 O LEU A 118 -8.374 5.986 2.261 1.00 0.00 O ATOM 1265 CB LEU A 118 -7.814 3.363 1.869 1.00 0.00 C ATOM 1266 CG LEU A 118 -7.847 2.794 3.289 1.00 0.00 C ATOM 1267 CD1 LEU A 118 -6.523 2.089 3.591 1.00 0.00 C ATOM 1268 CD2 LEU A 118 -8.057 3.932 4.291 1.00 0.00 C ATOM 0 H LEU A 118 -9.136 4.375 -0.573 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.983 3.416 2.096 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -7.504 2.592 1.164 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -7.081 4.167 1.805 1.00 0.00 H new ATOM 0 HG LEU A 118 -8.666 2.079 3.372 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -6.549 1.685 4.603 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -6.372 1.277 2.879 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -5.703 2.802 3.506 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -8.081 3.526 5.302 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -7.239 4.647 4.206 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -9.001 4.434 4.079 1.00 0.00 H new ATOM 1280 N GLY A 119 -10.414 5.969 1.420 1.00 0.00 N ATOM 1281 CA GLY A 119 -10.597 7.427 1.656 1.00 0.00 C ATOM 1282 C GLY A 119 -9.603 8.235 0.835 1.00 0.00 C ATOM 1283 O GLY A 119 -9.964 9.099 0.061 1.00 0.00 O ATOM 0 H GLY A 119 -11.211 5.499 0.991 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -11.614 7.718 1.393 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -10.466 7.648 2.715 1.00 0.00 H new ATOM 1287 N THR A 120 -8.352 7.976 1.026 1.00 0.00 N ATOM 1288 CA THR A 120 -7.306 8.742 0.287 1.00 0.00 C ATOM 1289 C THR A 120 -6.499 7.840 -0.654 1.00 0.00 C ATOM 1290 O THR A 120 -5.960 8.296 -1.642 1.00 0.00 O ATOM 1291 CB THR A 120 -6.403 9.314 1.378 1.00 0.00 C ATOM 1292 OG1 THR A 120 -6.100 8.295 2.320 1.00 0.00 O ATOM 1293 CG2 THR A 120 -7.117 10.466 2.085 1.00 0.00 C ATOM 0 H THR A 120 -7.997 7.264 1.664 1.00 0.00 H new ATOM 0 HA THR A 120 -7.748 9.513 -0.344 1.00 0.00 H new ATOM 0 HB THR A 120 -5.481 9.683 0.929 1.00 0.00 H new ATOM 0 HG1 THR A 120 -5.519 8.659 3.020 1.00 0.00 H new ATOM 0 HG21 THR A 120 -6.470 10.872 2.863 1.00 0.00 H new ATOM 0 HG22 THR A 120 -7.350 11.248 1.362 1.00 0.00 H new ATOM 0 HG23 THR A 120 -8.040 10.101 2.535 1.00 0.00 H new ATOM 1301 N LYS A 121 -6.390 6.575 -0.357 1.00 0.00 N ATOM 1302 CA LYS A 121 -5.589 5.684 -1.252 1.00 0.00 C ATOM 1303 C LYS A 121 -6.357 4.406 -1.581 1.00 0.00 C ATOM 1304 O LYS A 121 -7.524 4.284 -1.289 1.00 0.00 O ATOM 1305 CB LYS A 121 -4.334 5.349 -0.447 1.00 0.00 C ATOM 1306 CG LYS A 121 -4.741 4.839 0.935 1.00 0.00 C ATOM 1307 CD LYS A 121 -3.504 4.319 1.669 1.00 0.00 C ATOM 1308 CE LYS A 121 -3.651 4.590 3.167 1.00 0.00 C ATOM 1309 NZ LYS A 121 -2.629 5.630 3.472 1.00 0.00 N ATOM 0 H LYS A 121 -6.813 6.122 0.453 1.00 0.00 H new ATOM 0 HA LYS A 121 -5.362 6.165 -2.203 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.745 4.593 -0.967 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -3.704 6.233 -0.350 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -5.207 5.641 1.508 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -5.481 4.044 0.838 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.385 3.250 1.492 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -2.608 4.808 1.286 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -4.655 4.940 3.408 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -3.480 3.685 3.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -2.668 5.869 4.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.683 5.266 3.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -2.821 6.482 2.907 1.00 0.00 H new ATOM 1323 N PHE A 122 -5.704 3.446 -2.179 1.00 0.00 N ATOM 1324 CA PHE A 122 -6.392 2.172 -2.507 1.00 0.00 C ATOM 1325 C PHE A 122 -5.378 1.028 -2.458 1.00 0.00 C ATOM 1326 O PHE A 122 -4.218 1.234 -2.154 1.00 0.00 O ATOM 1327 CB PHE A 122 -7.000 2.351 -3.909 1.00 0.00 C ATOM 1328 CG PHE A 122 -5.987 2.877 -4.911 1.00 0.00 C ATOM 1329 CD1 PHE A 122 -5.380 4.132 -4.733 1.00 0.00 C ATOM 1330 CD2 PHE A 122 -5.678 2.112 -6.045 1.00 0.00 C ATOM 1331 CE1 PHE A 122 -4.471 4.611 -5.684 1.00 0.00 C ATOM 1332 CE2 PHE A 122 -4.766 2.594 -6.992 1.00 0.00 C ATOM 1333 CZ PHE A 122 -4.164 3.842 -6.812 1.00 0.00 C ATOM 0 H PHE A 122 -4.723 3.493 -2.453 1.00 0.00 H new ATOM 0 HA PHE A 122 -7.181 1.927 -1.796 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -7.391 1.395 -4.258 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -7.843 3.039 -3.852 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -5.615 4.727 -3.863 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -6.145 1.149 -6.188 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -4.006 5.576 -5.547 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -4.528 2.001 -7.862 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.462 4.213 -7.544 1.00 0.00 H new ATOM 1343 N THR A 123 -5.790 -0.176 -2.736 1.00 0.00 N ATOM 1344 CA THR A 123 -4.836 -1.297 -2.677 1.00 0.00 C ATOM 1345 C THR A 123 -5.308 -2.438 -3.574 1.00 0.00 C ATOM 1346 O THR A 123 -6.436 -2.461 -4.014 1.00 0.00 O ATOM 1347 CB THR A 123 -4.791 -1.712 -1.201 1.00 0.00 C ATOM 1348 OG1 THR A 123 -3.520 -2.278 -0.910 1.00 0.00 O ATOM 1349 CG2 THR A 123 -5.886 -2.739 -0.900 1.00 0.00 C ATOM 0 H THR A 123 -6.744 -0.424 -3.000 1.00 0.00 H new ATOM 0 HA THR A 123 -3.844 -1.022 -3.035 1.00 0.00 H new ATOM 0 HB THR A 123 -4.956 -0.830 -0.582 1.00 0.00 H new ATOM 0 HG1 THR A 123 -3.170 -2.724 -1.709 1.00 0.00 H new ATOM 0 HG21 THR A 123 -5.840 -3.023 0.151 1.00 0.00 H new ATOM 0 HG22 THR A 123 -6.862 -2.304 -1.116 1.00 0.00 H new ATOM 0 HG23 THR A 123 -5.737 -3.622 -1.521 1.00 0.00 H new ATOM 1357 N ILE A 124 -4.452 -3.375 -3.858 1.00 0.00 N ATOM 1358 CA ILE A 124 -4.856 -4.497 -4.744 1.00 0.00 C ATOM 1359 C ILE A 124 -4.404 -5.837 -4.152 1.00 0.00 C ATOM 1360 O ILE A 124 -3.354 -5.939 -3.549 1.00 0.00 O ATOM 1361 CB ILE A 124 -4.138 -4.210 -6.063 1.00 0.00 C ATOM 1362 CG1 ILE A 124 -4.535 -2.818 -6.575 1.00 0.00 C ATOM 1363 CG2 ILE A 124 -4.539 -5.264 -7.097 1.00 0.00 C ATOM 1364 CD1 ILE A 124 -3.763 -1.731 -5.814 1.00 0.00 C ATOM 0 H ILE A 124 -3.492 -3.413 -3.516 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.936 -4.569 -4.869 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.060 -4.243 -5.903 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.326 -2.742 -7.642 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.607 -2.668 -6.448 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -4.029 -5.062 -8.039 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -4.257 -6.253 -6.736 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.617 -5.228 -7.254 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -4.054 -0.749 -6.187 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.993 -1.798 -4.751 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -2.693 -1.873 -5.963 1.00 0.00 H new ATOM 1376 N THR A 125 -5.193 -6.864 -4.320 1.00 0.00 N ATOM 1377 CA THR A 125 -4.814 -8.198 -3.769 1.00 0.00 C ATOM 1378 C THR A 125 -4.783 -9.241 -4.886 1.00 0.00 C ATOM 1379 O THR A 125 -4.864 -8.918 -6.055 1.00 0.00 O ATOM 1380 CB THR A 125 -5.906 -8.536 -2.751 1.00 0.00 C ATOM 1381 OG1 THR A 125 -5.569 -9.743 -2.080 1.00 0.00 O ATOM 1382 CG2 THR A 125 -7.242 -8.710 -3.475 1.00 0.00 C ATOM 0 H THR A 125 -6.084 -6.837 -4.815 1.00 0.00 H new ATOM 0 HA THR A 125 -3.823 -8.188 -3.314 1.00 0.00 H new ATOM 0 HB THR A 125 -5.990 -7.727 -2.025 1.00 0.00 H new ATOM 0 HG1 THR A 125 -6.266 -9.960 -1.427 1.00 0.00 H new ATOM 0 HG21 THR A 125 -8.020 -8.951 -2.750 1.00 0.00 H new ATOM 0 HG22 THR A 125 -7.500 -7.785 -3.990 1.00 0.00 H new ATOM 0 HG23 THR A 125 -7.160 -9.519 -4.201 1.00 0.00 H new ATOM 1390 N SER A 126 -4.663 -10.492 -4.538 1.00 0.00 N ATOM 1391 CA SER A 126 -4.622 -11.557 -5.581 1.00 0.00 C ATOM 1392 C SER A 126 -5.795 -12.521 -5.407 1.00 0.00 C ATOM 1393 O SER A 126 -6.658 -12.628 -6.255 1.00 0.00 O ATOM 1394 CB SER A 126 -3.299 -12.282 -5.351 1.00 0.00 C ATOM 1395 OG SER A 126 -3.385 -13.594 -5.893 1.00 0.00 O ATOM 0 H SER A 126 -4.591 -10.824 -3.576 1.00 0.00 H new ATOM 0 HA SER A 126 -4.697 -11.148 -6.588 1.00 0.00 H new ATOM 0 HB2 SER A 126 -2.483 -11.734 -5.822 1.00 0.00 H new ATOM 0 HB3 SER A 126 -3.077 -12.330 -4.285 1.00 0.00 H new ATOM 0 HG SER A 126 -3.426 -13.542 -6.871 1.00 0.00 H new