USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 802 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 52 SER OG : rot 180:sc= -0.444 USER MOD Set 1.2: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 14 CYS SG : rot 16:sc= -4.11! USER MOD Set 2.2: A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -119:sc= 0.093 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0917 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 170:sc= -2.17 (180deg=-2.49) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 37 ASN : amide:sc= -3.77! C(o=-3.8!,f=-4!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ -163:sc= -0.012 (180deg=-0.166) USER MOD Single : A 73 ASN : amide:sc= -5.12! C(o=-5.1!,f=-5.5!) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.037) USER MOD Single : A 76 SER OG : rot 180:sc= 0.0932 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HE2:sc= -3.64! C(o=-3.6!,f=-9.9!) USER MOD Single : A 87 GLN : amide:sc= -3.2! C(o=-3.2!,f=-6.4!) USER MOD Single : A 91 SER OG : rot -52:sc= 1.19 USER MOD Single : A 95 THR OG1 : rot -35:sc= 0.128 USER MOD Single : A 101 CYS SG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -26.361 17.772 2.705 1.00 0.00 N ATOM 2 CA GLY A 1 -26.463 18.793 1.678 1.00 0.00 C ATOM 3 C GLY A 1 -25.477 18.578 0.547 1.00 0.00 C ATOM 4 O GLY A 1 -24.693 17.630 0.570 1.00 0.00 O ATOM 0 H1 GLY A 1 -27.265 17.263 2.780 1.00 0.00 H new ATOM 0 H2 GLY A 1 -25.606 17.102 2.454 1.00 0.00 H new ATOM 0 H3 GLY A 1 -26.138 18.218 3.618 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -27.476 18.800 1.276 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -26.291 19.772 2.125 1.00 0.00 H new ATOM 8 N SER A 2 -25.517 19.460 -0.446 1.00 0.00 N ATOM 9 CA SER A 2 -24.624 19.360 -1.594 1.00 0.00 C ATOM 10 C SER A 2 -23.210 18.995 -1.152 1.00 0.00 C ATOM 11 O SER A 2 -22.561 18.140 -1.754 1.00 0.00 O ATOM 12 CB SER A 2 -24.604 20.679 -2.369 1.00 0.00 C ATOM 13 OG SER A 2 -23.935 21.691 -1.636 1.00 0.00 O ATOM 0 H SER A 2 -26.159 20.252 -0.479 1.00 0.00 H new ATOM 0 HA SER A 2 -24.998 18.570 -2.246 1.00 0.00 H new ATOM 0 HB2 SER A 2 -24.109 20.533 -3.329 1.00 0.00 H new ATOM 0 HB3 SER A 2 -25.625 20.995 -2.582 1.00 0.00 H new ATOM 0 HG SER A 2 -23.934 22.523 -2.153 1.00 0.00 H new ATOM 19 N SER A 3 -22.739 19.651 -0.096 1.00 0.00 N ATOM 20 CA SER A 3 -21.401 19.399 0.426 1.00 0.00 C ATOM 21 C SER A 3 -21.141 17.901 0.555 1.00 0.00 C ATOM 22 O SER A 3 -21.596 17.260 1.502 1.00 0.00 O ATOM 23 CB SER A 3 -21.225 20.078 1.786 1.00 0.00 C ATOM 24 OG SER A 3 -21.179 21.488 1.649 1.00 0.00 O ATOM 0 H SER A 3 -23.264 20.361 0.415 1.00 0.00 H new ATOM 0 HA SER A 3 -20.679 19.816 -0.276 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.048 19.800 2.444 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.307 19.725 2.256 1.00 0.00 H new ATOM 0 HG SER A 3 -21.068 21.899 2.532 1.00 0.00 H new ATOM 30 N GLY A 4 -20.405 17.350 -0.405 1.00 0.00 N ATOM 31 CA GLY A 4 -20.097 15.932 -0.382 1.00 0.00 C ATOM 32 C GLY A 4 -19.201 15.553 0.781 1.00 0.00 C ATOM 33 O GLY A 4 -19.404 16.011 1.905 1.00 0.00 O ATOM 0 H GLY A 4 -20.017 17.860 -1.198 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.025 15.363 -0.323 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.611 15.653 -1.317 1.00 0.00 H new ATOM 37 N SER A 5 -18.208 14.712 0.511 1.00 0.00 N ATOM 38 CA SER A 5 -17.281 14.267 1.545 1.00 0.00 C ATOM 39 C SER A 5 -15.892 14.856 1.319 1.00 0.00 C ATOM 40 O SER A 5 -15.306 14.700 0.248 1.00 0.00 O ATOM 41 CB SER A 5 -17.202 12.739 1.566 1.00 0.00 C ATOM 42 OG SER A 5 -18.259 12.184 2.329 1.00 0.00 O ATOM 0 H SER A 5 -18.025 14.325 -0.415 1.00 0.00 H new ATOM 0 HA SER A 5 -17.653 14.618 2.507 1.00 0.00 H new ATOM 0 HB2 SER A 5 -17.245 12.356 0.547 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.245 12.427 1.984 1.00 0.00 H new ATOM 0 HG SER A 5 -18.187 11.207 2.325 1.00 0.00 H new ATOM 48 N SER A 6 -15.371 15.534 2.337 1.00 0.00 N ATOM 49 CA SER A 6 -14.052 16.150 2.250 1.00 0.00 C ATOM 50 C SER A 6 -13.234 15.863 3.505 1.00 0.00 C ATOM 51 O SER A 6 -13.742 15.304 4.476 1.00 0.00 O ATOM 52 CB SER A 6 -14.184 17.661 2.048 1.00 0.00 C ATOM 53 OG SER A 6 -14.895 18.258 3.119 1.00 0.00 O ATOM 0 H SER A 6 -15.842 15.671 3.231 1.00 0.00 H new ATOM 0 HA SER A 6 -13.533 15.720 1.393 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.193 18.109 1.971 1.00 0.00 H new ATOM 0 HB3 SER A 6 -14.699 17.862 1.109 1.00 0.00 H new ATOM 0 HG SER A 6 -14.964 19.224 2.967 1.00 0.00 H new ATOM 59 N GLY A 7 -11.962 16.249 3.477 1.00 0.00 N ATOM 60 CA GLY A 7 -11.093 16.025 4.617 1.00 0.00 C ATOM 61 C GLY A 7 -9.625 16.167 4.264 1.00 0.00 C ATOM 62 O GLY A 7 -9.247 16.199 3.093 1.00 0.00 O ATOM 0 H GLY A 7 -11.518 16.713 2.685 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.344 16.734 5.406 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.273 15.027 5.016 1.00 0.00 H new ATOM 66 N PRO A 8 -8.771 16.255 5.294 1.00 0.00 N ATOM 67 CA PRO A 8 -7.323 16.397 5.112 1.00 0.00 C ATOM 68 C PRO A 8 -6.681 15.128 4.562 1.00 0.00 C ATOM 69 O PRO A 8 -7.235 14.036 4.686 1.00 0.00 O ATOM 70 CB PRO A 8 -6.814 16.684 6.526 1.00 0.00 C ATOM 71 CG PRO A 8 -7.835 16.078 7.427 1.00 0.00 C ATOM 72 CD PRO A 8 -9.152 16.224 6.716 1.00 0.00 C ATOM 0 HA PRO A 8 -7.077 17.176 4.390 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -5.830 16.244 6.690 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -6.717 17.755 6.702 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -7.611 15.029 7.622 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -7.854 16.584 8.392 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -9.821 15.392 6.935 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -9.670 17.136 7.013 1.00 0.00 H new ATOM 80 N GLY A 9 -5.509 15.279 3.953 1.00 0.00 N ATOM 81 CA GLY A 9 -4.811 14.136 3.394 1.00 0.00 C ATOM 82 C GLY A 9 -3.305 14.258 3.519 1.00 0.00 C ATOM 83 O GLY A 9 -2.612 13.267 3.754 1.00 0.00 O ATOM 0 H GLY A 9 -5.030 16.172 3.837 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -5.142 13.229 3.900 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -5.078 14.030 2.342 1.00 0.00 H new ATOM 87 N LEU A 10 -2.797 15.475 3.361 1.00 0.00 N ATOM 88 CA LEU A 10 -1.362 15.723 3.456 1.00 0.00 C ATOM 89 C LEU A 10 -0.940 15.926 4.907 1.00 0.00 C ATOM 90 O LEU A 10 -0.095 16.770 5.206 1.00 0.00 O ATOM 91 CB LEU A 10 -0.981 16.950 2.625 1.00 0.00 C ATOM 92 CG LEU A 10 -1.866 18.184 2.805 1.00 0.00 C ATOM 93 CD1 LEU A 10 -3.065 18.122 1.872 1.00 0.00 C ATOM 94 CD2 LEU A 10 -2.320 18.308 4.252 1.00 0.00 C ATOM 0 H LEU A 10 -3.357 16.305 3.167 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.840 14.850 3.064 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.045 17.225 2.869 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.994 16.669 1.572 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.280 19.068 2.552 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.683 19.008 2.014 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.720 18.082 0.839 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.652 17.231 2.093 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.949 19.192 4.362 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.888 17.421 4.532 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.448 18.400 4.900 1.00 0.00 H new ATOM 106 N ARG A 11 -1.532 15.146 5.805 1.00 0.00 N ATOM 107 CA ARG A 11 -1.217 15.239 7.226 1.00 0.00 C ATOM 108 C ARG A 11 -0.445 14.009 7.693 1.00 0.00 C ATOM 109 O ARG A 11 -0.682 12.898 7.219 1.00 0.00 O ATOM 110 CB ARG A 11 -2.499 15.392 8.046 1.00 0.00 C ATOM 111 CG ARG A 11 -3.175 16.742 7.872 1.00 0.00 C ATOM 112 CD ARG A 11 -4.490 16.809 8.634 1.00 0.00 C ATOM 113 NE ARG A 11 -4.306 17.287 10.001 1.00 0.00 N ATOM 114 CZ ARG A 11 -5.212 17.135 10.961 1.00 0.00 C ATOM 115 NH1 ARG A 11 -6.359 16.521 10.704 1.00 0.00 N ATOM 116 NH2 ARG A 11 -4.972 17.598 12.181 1.00 0.00 N ATOM 0 H ARG A 11 -2.233 14.442 5.574 1.00 0.00 H new ATOM 0 HA ARG A 11 -0.591 16.118 7.377 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -3.198 14.606 7.762 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -2.266 15.245 9.101 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -2.510 17.531 8.222 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -3.357 16.925 6.813 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -5.180 17.469 8.109 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -4.948 15.820 8.654 1.00 0.00 H new ATOM 0 HE ARG A 11 -3.434 17.764 10.232 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -6.548 16.164 9.767 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -7.053 16.406 11.443 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -4.091 18.071 12.383 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -5.668 17.481 12.917 1.00 0.00 H new ATOM 130 N GLU A 12 0.480 14.216 8.626 1.00 0.00 N ATOM 131 CA GLU A 12 1.287 13.123 9.156 1.00 0.00 C ATOM 132 C GLU A 12 0.401 12.010 9.707 1.00 0.00 C ATOM 133 O GLU A 12 -0.256 12.176 10.736 1.00 0.00 O ATOM 134 CB GLU A 12 2.223 13.636 10.253 1.00 0.00 C ATOM 135 CG GLU A 12 3.290 12.634 10.660 1.00 0.00 C ATOM 136 CD GLU A 12 4.235 13.183 11.711 1.00 0.00 C ATOM 137 OE1 GLU A 12 4.512 14.400 11.682 1.00 0.00 O ATOM 138 OE2 GLU A 12 4.697 12.395 12.562 1.00 0.00 O ATOM 0 H GLU A 12 0.689 15.129 9.030 1.00 0.00 H new ATOM 0 HA GLU A 12 1.884 12.717 8.339 1.00 0.00 H new ATOM 0 HB2 GLU A 12 2.707 14.550 9.908 1.00 0.00 H new ATOM 0 HB3 GLU A 12 1.631 13.900 11.130 1.00 0.00 H new ATOM 0 HG2 GLU A 12 2.810 11.733 11.043 1.00 0.00 H new ATOM 0 HG3 GLU A 12 3.862 12.341 9.780 1.00 0.00 H new ATOM 145 N LEU A 13 0.387 10.875 9.016 1.00 0.00 N ATOM 146 CA LEU A 13 -0.418 9.734 9.435 1.00 0.00 C ATOM 147 C LEU A 13 0.457 8.645 10.048 1.00 0.00 C ATOM 148 O LEU A 13 1.684 8.695 9.953 1.00 0.00 O ATOM 149 CB LEU A 13 -1.196 9.169 8.245 1.00 0.00 C ATOM 150 CG LEU A 13 -2.583 9.766 8.005 1.00 0.00 C ATOM 151 CD1 LEU A 13 -3.038 9.502 6.578 1.00 0.00 C ATOM 152 CD2 LEU A 13 -3.586 9.202 9.000 1.00 0.00 C ATOM 0 H LEU A 13 0.924 10.721 8.163 1.00 0.00 H new ATOM 0 HA LEU A 13 -1.123 10.077 10.192 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.599 9.314 7.345 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.305 8.094 8.385 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.524 10.844 8.152 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -4.027 9.934 6.426 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.333 9.955 5.881 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -3.081 8.427 6.403 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.567 9.638 8.814 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.642 8.119 8.886 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -3.268 9.444 10.014 1.00 0.00 H new ATOM 164 N CYS A 14 -0.181 7.663 10.675 1.00 0.00 N ATOM 165 CA CYS A 14 0.539 6.561 11.302 1.00 0.00 C ATOM 166 C CYS A 14 -0.299 5.287 11.292 1.00 0.00 C ATOM 167 O CYS A 14 -1.521 5.336 11.436 1.00 0.00 O ATOM 168 CB CYS A 14 0.918 6.925 12.739 1.00 0.00 C ATOM 169 SG CYS A 14 2.246 5.911 13.430 1.00 0.00 S ATOM 0 H CYS A 14 -1.196 7.608 10.763 1.00 0.00 H new ATOM 0 HA CYS A 14 1.448 6.380 10.728 1.00 0.00 H new ATOM 0 HB2 CYS A 14 1.221 7.972 12.770 1.00 0.00 H new ATOM 0 HB3 CYS A 14 0.036 6.830 13.372 1.00 0.00 H new ATOM 0 HG CYS A 14 2.861 5.288 12.469 1.00 0.00 H new ATOM 175 N ILE A 15 0.365 4.150 11.118 1.00 0.00 N ATOM 176 CA ILE A 15 -0.320 2.863 11.088 1.00 0.00 C ATOM 177 C ILE A 15 0.198 1.939 12.184 1.00 0.00 C ATOM 178 O ILE A 15 1.402 1.712 12.300 1.00 0.00 O ATOM 179 CB ILE A 15 -0.151 2.168 9.724 1.00 0.00 C ATOM 180 CG1 ILE A 15 -0.607 3.094 8.595 1.00 0.00 C ATOM 181 CG2 ILE A 15 -0.933 0.863 9.694 1.00 0.00 C ATOM 182 CD1 ILE A 15 -0.685 2.411 7.247 1.00 0.00 C ATOM 0 H ILE A 15 1.376 4.093 10.996 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.378 3.064 11.256 1.00 0.00 H new ATOM 0 HB ILE A 15 0.905 1.940 9.578 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -1.587 3.502 8.844 1.00 0.00 H new ATOM 0 HG13 ILE A 15 0.081 3.937 8.527 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -0.804 0.384 8.724 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -0.566 0.201 10.478 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -1.991 1.069 9.859 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.015 3.127 6.495 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.299 2.027 6.976 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.395 1.586 7.298 1.00 0.00 H new ATOM 194 N GLN A 16 -0.720 1.407 12.985 1.00 0.00 N ATOM 195 CA GLN A 16 -0.355 0.506 14.072 1.00 0.00 C ATOM 196 C GLN A 16 -0.526 -0.950 13.652 1.00 0.00 C ATOM 197 O GLN A 16 -1.642 -1.413 13.417 1.00 0.00 O ATOM 198 CB GLN A 16 -1.206 0.796 15.310 1.00 0.00 C ATOM 199 CG GLN A 16 -0.573 1.797 16.263 1.00 0.00 C ATOM 200 CD GLN A 16 -1.602 2.604 17.030 1.00 0.00 C ATOM 201 OE1 GLN A 16 -2.075 2.184 18.086 1.00 0.00 O ATOM 202 NE2 GLN A 16 -1.954 3.770 16.502 1.00 0.00 N ATOM 0 H GLN A 16 -1.721 1.584 12.902 1.00 0.00 H new ATOM 0 HA GLN A 16 0.694 0.674 14.314 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.178 1.174 14.992 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.386 -0.137 15.844 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.067 1.267 16.969 1.00 0.00 H new ATOM 0 HG3 GLN A 16 0.068 2.475 15.699 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.536 4.079 15.624 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.642 4.357 16.974 1.00 0.00 H new ATOM 211 N LYS A 17 0.588 -1.668 13.560 1.00 0.00 N ATOM 212 CA LYS A 17 0.563 -3.073 13.170 1.00 0.00 C ATOM 213 C LYS A 17 1.257 -3.941 14.215 1.00 0.00 C ATOM 214 O LYS A 17 1.897 -3.430 15.133 1.00 0.00 O ATOM 215 CB LYS A 17 1.237 -3.257 11.809 1.00 0.00 C ATOM 216 CG LYS A 17 2.737 -3.479 11.898 1.00 0.00 C ATOM 217 CD LYS A 17 3.434 -3.113 10.598 1.00 0.00 C ATOM 218 CE LYS A 17 3.319 -1.625 10.304 1.00 0.00 C ATOM 219 NZ LYS A 17 3.593 -0.798 11.511 1.00 0.00 N ATOM 0 H LYS A 17 1.520 -1.300 13.750 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.479 -3.386 13.098 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.782 -4.106 11.300 1.00 0.00 H new ATOM 0 HB3 LYS A 17 1.044 -2.377 11.196 1.00 0.00 H new ATOM 0 HG2 LYS A 17 3.146 -2.881 12.712 1.00 0.00 H new ATOM 0 HG3 LYS A 17 2.937 -4.523 12.138 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.486 -3.393 10.656 1.00 0.00 H new ATOM 0 HD3 LYS A 17 2.998 -3.682 9.777 1.00 0.00 H new ATOM 0 HE2 LYS A 17 4.019 -1.356 9.513 1.00 0.00 H new ATOM 0 HE3 LYS A 17 2.318 -1.405 9.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 3.672 0.202 11.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 2.815 -0.909 12.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.484 -1.108 11.949 1.00 0.00 H new ATOM 233 N ALA A 18 1.127 -5.255 14.067 1.00 0.00 N ATOM 234 CA ALA A 18 1.745 -6.193 14.996 1.00 0.00 C ATOM 235 C ALA A 18 3.206 -5.835 15.247 1.00 0.00 C ATOM 236 O ALA A 18 3.796 -5.009 14.551 1.00 0.00 O ATOM 237 CB ALA A 18 1.631 -7.614 14.465 1.00 0.00 C ATOM 0 H ALA A 18 0.599 -5.694 13.313 1.00 0.00 H new ATOM 0 HA ALA A 18 1.214 -6.128 15.946 1.00 0.00 H new ATOM 0 HB1 ALA A 18 2.097 -8.304 15.169 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.579 -7.874 14.344 1.00 0.00 H new ATOM 0 HB3 ALA A 18 2.135 -7.684 13.501 1.00 0.00 H new ATOM 243 N PRO A 19 3.805 -6.470 16.265 1.00 0.00 N ATOM 244 CA PRO A 19 5.205 -6.234 16.631 1.00 0.00 C ATOM 245 C PRO A 19 6.176 -6.781 15.591 1.00 0.00 C ATOM 246 O PRO A 19 7.392 -6.705 15.762 1.00 0.00 O ATOM 247 CB PRO A 19 5.357 -6.989 17.954 1.00 0.00 C ATOM 248 CG PRO A 19 4.315 -8.052 17.906 1.00 0.00 C ATOM 249 CD PRO A 19 3.162 -7.467 17.137 1.00 0.00 C ATOM 0 HA PRO A 19 5.434 -5.171 16.702 1.00 0.00 H new ATOM 0 HB2 PRO A 19 6.355 -7.417 18.053 1.00 0.00 H new ATOM 0 HB3 PRO A 19 5.208 -6.327 18.807 1.00 0.00 H new ATOM 0 HG2 PRO A 19 4.695 -8.949 17.417 1.00 0.00 H new ATOM 0 HG3 PRO A 19 4.007 -8.342 18.910 1.00 0.00 H new ATOM 0 HD2 PRO A 19 2.637 -8.228 16.559 1.00 0.00 H new ATOM 0 HD3 PRO A 19 2.429 -7.008 17.800 1.00 0.00 H new ATOM 257 N GLY A 20 5.631 -7.332 14.510 1.00 0.00 N ATOM 258 CA GLY A 20 6.464 -7.883 13.458 1.00 0.00 C ATOM 259 C GLY A 20 5.663 -8.286 12.236 1.00 0.00 C ATOM 260 O GLY A 20 5.936 -9.316 11.620 1.00 0.00 O ATOM 0 H GLY A 20 4.627 -7.406 14.345 1.00 0.00 H new ATOM 0 HA2 GLY A 20 7.215 -7.147 13.170 1.00 0.00 H new ATOM 0 HA3 GLY A 20 7.000 -8.752 13.840 1.00 0.00 H new ATOM 264 N GLU A 21 4.671 -7.474 11.885 1.00 0.00 N ATOM 265 CA GLU A 21 3.827 -7.754 10.730 1.00 0.00 C ATOM 266 C GLU A 21 4.237 -6.898 9.535 1.00 0.00 C ATOM 267 O GLU A 21 4.634 -5.743 9.693 1.00 0.00 O ATOM 268 CB GLU A 21 2.357 -7.501 11.071 1.00 0.00 C ATOM 269 CG GLU A 21 1.419 -7.669 9.887 1.00 0.00 C ATOM 270 CD GLU A 21 1.521 -9.043 9.253 1.00 0.00 C ATOM 271 OE1 GLU A 21 1.624 -10.037 10.003 1.00 0.00 O ATOM 272 OE2 GLU A 21 1.497 -9.124 8.007 1.00 0.00 O ATOM 0 H GLU A 21 4.432 -6.617 12.384 1.00 0.00 H new ATOM 0 HA GLU A 21 3.956 -8.803 10.465 1.00 0.00 H new ATOM 0 HB2 GLU A 21 2.054 -8.185 11.864 1.00 0.00 H new ATOM 0 HB3 GLU A 21 2.253 -6.490 11.465 1.00 0.00 H new ATOM 0 HG2 GLU A 21 0.393 -7.499 10.214 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.645 -6.910 9.138 1.00 0.00 H new ATOM 279 N ARG A 22 4.140 -7.473 8.341 1.00 0.00 N ATOM 280 CA ARG A 22 4.503 -6.765 7.120 1.00 0.00 C ATOM 281 C ARG A 22 3.345 -5.901 6.628 1.00 0.00 C ATOM 282 O ARG A 22 2.260 -6.406 6.338 1.00 0.00 O ATOM 283 CB ARG A 22 4.912 -7.758 6.031 1.00 0.00 C ATOM 284 CG ARG A 22 6.330 -8.283 6.186 1.00 0.00 C ATOM 285 CD ARG A 22 6.466 -9.692 5.632 1.00 0.00 C ATOM 286 NE ARG A 22 7.838 -10.185 5.719 1.00 0.00 N ATOM 287 CZ ARG A 22 8.833 -9.726 4.968 1.00 0.00 C ATOM 288 NH1 ARG A 22 8.609 -8.769 4.078 1.00 0.00 N ATOM 289 NH2 ARG A 22 10.055 -10.225 5.106 1.00 0.00 N ATOM 0 H ARG A 22 3.813 -8.428 8.193 1.00 0.00 H new ATOM 0 HA ARG A 22 5.349 -6.115 7.345 1.00 0.00 H new ATOM 0 HB2 ARG A 22 4.219 -8.599 6.040 1.00 0.00 H new ATOM 0 HB3 ARG A 22 4.816 -7.277 5.058 1.00 0.00 H new ATOM 0 HG2 ARG A 22 7.023 -7.619 5.669 1.00 0.00 H new ATOM 0 HG3 ARG A 22 6.608 -8.277 7.240 1.00 0.00 H new ATOM 0 HD2 ARG A 22 5.805 -10.362 6.181 1.00 0.00 H new ATOM 0 HD3 ARG A 22 6.142 -9.705 4.592 1.00 0.00 H new ATOM 0 HE ARG A 22 8.043 -10.922 6.393 1.00 0.00 H new ATOM 0 HH11 ARG A 22 7.671 -8.384 3.969 1.00 0.00 H new ATOM 0 HH12 ARG A 22 9.375 -8.418 3.503 1.00 0.00 H new ATOM 0 HH21 ARG A 22 10.231 -10.962 5.789 1.00 0.00 H new ATOM 0 HH22 ARG A 22 10.818 -9.872 4.529 1.00 0.00 H new ATOM 303 N LEU A 23 3.583 -4.598 6.536 1.00 0.00 N ATOM 304 CA LEU A 23 2.560 -3.663 6.079 1.00 0.00 C ATOM 305 C LEU A 23 1.666 -4.308 5.025 1.00 0.00 C ATOM 306 O LEU A 23 0.440 -4.255 5.119 1.00 0.00 O ATOM 307 CB LEU A 23 3.211 -2.402 5.510 1.00 0.00 C ATOM 308 CG LEU A 23 2.446 -1.096 5.726 1.00 0.00 C ATOM 309 CD1 LEU A 23 1.006 -1.237 5.260 1.00 0.00 C ATOM 310 CD2 LEU A 23 2.497 -0.684 7.191 1.00 0.00 C ATOM 0 H LEU A 23 4.475 -4.164 6.772 1.00 0.00 H new ATOM 0 HA LEU A 23 1.943 -3.390 6.935 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.201 -2.297 5.953 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.354 -2.543 4.439 1.00 0.00 H new ATOM 0 HG LEU A 23 2.923 -0.316 5.133 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.478 -0.297 5.422 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.990 -1.484 4.199 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.517 -2.030 5.825 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.947 0.248 7.326 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.046 -1.464 7.804 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.535 -0.540 7.493 1.00 0.00 H new ATOM 322 N GLY A 24 2.288 -4.918 4.020 1.00 0.00 N ATOM 323 CA GLY A 24 1.534 -5.566 2.964 1.00 0.00 C ATOM 324 C GLY A 24 0.965 -4.576 1.967 1.00 0.00 C ATOM 325 O GLY A 24 -0.185 -4.701 1.545 1.00 0.00 O ATOM 0 H GLY A 24 3.301 -4.975 3.919 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.179 -6.273 2.442 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.720 -6.142 3.404 1.00 0.00 H new ATOM 329 N ILE A 25 1.772 -3.590 1.589 1.00 0.00 N ATOM 330 CA ILE A 25 1.342 -2.575 0.636 1.00 0.00 C ATOM 331 C ILE A 25 2.271 -2.527 -0.573 1.00 0.00 C ATOM 332 O ILE A 25 3.400 -3.014 -0.520 1.00 0.00 O ATOM 333 CB ILE A 25 1.290 -1.179 1.285 1.00 0.00 C ATOM 334 CG1 ILE A 25 2.474 -0.990 2.234 1.00 0.00 C ATOM 335 CG2 ILE A 25 -0.025 -0.988 2.025 1.00 0.00 C ATOM 336 CD1 ILE A 25 2.872 0.458 2.423 1.00 0.00 C ATOM 0 H ILE A 25 2.727 -3.473 1.928 1.00 0.00 H new ATOM 0 HA ILE A 25 0.340 -2.853 0.310 1.00 0.00 H new ATOM 0 HB ILE A 25 1.355 -0.426 0.499 1.00 0.00 H new ATOM 0 HG12 ILE A 25 2.224 -1.419 3.204 1.00 0.00 H new ATOM 0 HG13 ILE A 25 3.329 -1.546 1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -0.047 0.003 2.478 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.854 -1.085 1.324 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -0.118 -1.745 2.804 1.00 0.00 H new ATOM 0 HD11 ILE A 25 3.718 0.516 3.108 1.00 0.00 H new ATOM 0 HD12 ILE A 25 3.154 0.886 1.461 1.00 0.00 H new ATOM 0 HD13 ILE A 25 2.031 1.015 2.836 1.00 0.00 H new ATOM 348 N SER A 26 1.788 -1.934 -1.660 1.00 0.00 N ATOM 349 CA SER A 26 2.574 -1.824 -2.883 1.00 0.00 C ATOM 350 C SER A 26 2.797 -0.361 -3.256 1.00 0.00 C ATOM 351 O SER A 26 2.072 0.523 -2.801 1.00 0.00 O ATOM 352 CB SER A 26 1.875 -2.554 -4.032 1.00 0.00 C ATOM 353 OG SER A 26 2.816 -3.061 -4.962 1.00 0.00 O ATOM 0 H SER A 26 0.857 -1.523 -1.719 1.00 0.00 H new ATOM 0 HA SER A 26 3.544 -2.288 -2.704 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.274 -3.372 -3.635 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.191 -1.872 -4.537 1.00 0.00 H new ATOM 0 HG SER A 26 2.344 -3.524 -5.685 1.00 0.00 H new ATOM 359 N ILE A 27 3.805 -0.116 -4.086 1.00 0.00 N ATOM 360 CA ILE A 27 4.123 1.238 -4.521 1.00 0.00 C ATOM 361 C ILE A 27 4.771 1.235 -5.901 1.00 0.00 C ATOM 362 O ILE A 27 5.494 0.303 -6.257 1.00 0.00 O ATOM 363 CB ILE A 27 5.065 1.942 -3.526 1.00 0.00 C ATOM 364 CG1 ILE A 27 6.480 1.369 -3.636 1.00 0.00 C ATOM 365 CG2 ILE A 27 4.539 1.799 -2.106 1.00 0.00 C ATOM 366 CD1 ILE A 27 7.518 2.175 -2.889 1.00 0.00 C ATOM 0 H ILE A 27 4.415 -0.837 -4.471 1.00 0.00 H new ATOM 0 HA ILE A 27 3.181 1.784 -4.566 1.00 0.00 H new ATOM 0 HB ILE A 27 5.103 3.003 -3.773 1.00 0.00 H new ATOM 0 HG12 ILE A 27 6.480 0.348 -3.254 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.761 1.316 -4.688 1.00 0.00 H new ATOM 0 HG21 ILE A 27 5.216 2.302 -1.415 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.549 2.250 -2.037 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.475 0.742 -1.847 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.496 1.710 -3.011 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.546 3.190 -3.286 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.261 2.207 -1.830 1.00 0.00 H new ATOM 378 N ARG A 28 4.508 2.283 -6.675 1.00 0.00 N ATOM 379 CA ARG A 28 5.066 2.401 -8.017 1.00 0.00 C ATOM 380 C ARG A 28 5.820 3.718 -8.178 1.00 0.00 C ATOM 381 O ARG A 28 5.377 4.761 -7.701 1.00 0.00 O ATOM 382 CB ARG A 28 3.955 2.306 -9.064 1.00 0.00 C ATOM 383 CG ARG A 28 2.909 3.402 -8.945 1.00 0.00 C ATOM 384 CD ARG A 28 2.154 3.596 -10.250 1.00 0.00 C ATOM 385 NE ARG A 28 0.803 4.106 -10.030 1.00 0.00 N ATOM 386 CZ ARG A 28 -0.240 3.329 -9.758 1.00 0.00 C ATOM 387 NH1 ARG A 28 -0.088 2.015 -9.672 1.00 0.00 N ATOM 388 NH2 ARG A 28 -1.438 3.867 -9.570 1.00 0.00 N ATOM 0 H ARG A 28 3.912 3.062 -6.396 1.00 0.00 H new ATOM 0 HA ARG A 28 5.767 1.580 -8.166 1.00 0.00 H new ATOM 0 HB2 ARG A 28 4.400 2.347 -10.058 1.00 0.00 H new ATOM 0 HB3 ARG A 28 3.465 1.337 -8.974 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.206 3.151 -8.151 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.391 4.337 -8.660 1.00 0.00 H new ATOM 0 HD2 ARG A 28 2.704 4.289 -10.887 1.00 0.00 H new ATOM 0 HD3 ARG A 28 2.101 2.647 -10.783 1.00 0.00 H new ATOM 0 HE ARG A 28 0.652 5.113 -10.088 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.832 1.598 -9.815 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -0.891 1.421 -9.463 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.559 4.878 -9.634 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.238 3.270 -9.361 1.00 0.00 H new ATOM 402 N GLY A 29 6.963 3.660 -8.855 1.00 0.00 N ATOM 403 CA GLY A 29 7.761 4.854 -9.066 1.00 0.00 C ATOM 404 C GLY A 29 9.244 4.602 -8.877 1.00 0.00 C ATOM 405 O GLY A 29 9.729 3.498 -9.121 1.00 0.00 O ATOM 0 H GLY A 29 7.350 2.808 -9.261 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.585 5.231 -10.073 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.437 5.631 -8.374 1.00 0.00 H new ATOM 409 N GLY A 30 9.966 5.629 -8.440 1.00 0.00 N ATOM 410 CA GLY A 30 11.395 5.494 -8.228 1.00 0.00 C ATOM 411 C GLY A 30 12.206 6.369 -9.162 1.00 0.00 C ATOM 412 O GLY A 30 11.860 6.527 -10.332 1.00 0.00 O ATOM 0 H GLY A 30 9.587 6.552 -8.229 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.632 5.753 -7.196 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.683 4.452 -8.370 1.00 0.00 H new ATOM 416 N ALA A 31 13.288 6.942 -8.644 1.00 0.00 N ATOM 417 CA ALA A 31 14.151 7.806 -9.441 1.00 0.00 C ATOM 418 C ALA A 31 14.789 7.034 -10.591 1.00 0.00 C ATOM 419 O ALA A 31 15.435 7.620 -11.460 1.00 0.00 O ATOM 420 CB ALA A 31 15.224 8.433 -8.564 1.00 0.00 C ATOM 0 H ALA A 31 13.588 6.823 -7.676 1.00 0.00 H new ATOM 0 HA ALA A 31 13.537 8.599 -9.867 1.00 0.00 H new ATOM 0 HB1 ALA A 31 15.861 9.075 -9.172 1.00 0.00 H new ATOM 0 HB2 ALA A 31 14.753 9.026 -7.780 1.00 0.00 H new ATOM 0 HB3 ALA A 31 15.828 7.647 -8.111 1.00 0.00 H new ATOM 426 N ARG A 32 14.605 5.718 -10.589 1.00 0.00 N ATOM 427 CA ARG A 32 15.164 4.867 -11.632 1.00 0.00 C ATOM 428 C ARG A 32 14.082 3.996 -12.263 1.00 0.00 C ATOM 429 O ARG A 32 14.369 2.942 -12.828 1.00 0.00 O ATOM 430 CB ARG A 32 16.274 3.984 -11.058 1.00 0.00 C ATOM 431 CG ARG A 32 17.618 4.686 -10.952 1.00 0.00 C ATOM 432 CD ARG A 32 18.729 3.711 -10.594 1.00 0.00 C ATOM 433 NE ARG A 32 20.049 4.240 -10.925 1.00 0.00 N ATOM 434 CZ ARG A 32 21.155 3.505 -10.932 1.00 0.00 C ATOM 435 NH1 ARG A 32 21.100 2.215 -10.628 1.00 0.00 N ATOM 436 NH2 ARG A 32 22.320 4.059 -11.243 1.00 0.00 N ATOM 0 H ARG A 32 14.073 5.218 -9.877 1.00 0.00 H new ATOM 0 HA ARG A 32 15.583 5.511 -12.405 1.00 0.00 H new ATOM 0 HB2 ARG A 32 15.976 3.637 -10.069 1.00 0.00 H new ATOM 0 HB3 ARG A 32 16.384 3.100 -11.686 1.00 0.00 H new ATOM 0 HG2 ARG A 32 17.851 5.173 -11.899 1.00 0.00 H new ATOM 0 HG3 ARG A 32 17.562 5.469 -10.196 1.00 0.00 H new ATOM 0 HD2 ARG A 32 18.685 3.487 -9.528 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.572 2.772 -11.124 1.00 0.00 H new ATOM 0 HE ARG A 32 20.126 5.229 -11.164 1.00 0.00 H new ATOM 0 HH11 ARG A 32 20.207 1.785 -10.388 1.00 0.00 H new ATOM 0 HH12 ARG A 32 21.951 1.653 -10.634 1.00 0.00 H new ATOM 0 HH21 ARG A 32 22.367 5.051 -11.477 1.00 0.00 H new ATOM 0 HH22 ARG A 32 23.169 3.493 -11.248 1.00 0.00 H new ATOM 450 N GLY A 33 12.834 4.446 -12.161 1.00 0.00 N ATOM 451 CA GLY A 33 11.728 3.696 -12.725 1.00 0.00 C ATOM 452 C GLY A 33 10.862 4.539 -13.640 1.00 0.00 C ATOM 453 O GLY A 33 11.042 5.754 -13.731 1.00 0.00 O ATOM 0 H GLY A 33 12.570 5.316 -11.698 1.00 0.00 H new ATOM 0 HA2 GLY A 33 12.118 2.844 -13.282 1.00 0.00 H new ATOM 0 HA3 GLY A 33 11.115 3.296 -11.917 1.00 0.00 H new ATOM 457 N HIS A 34 9.919 3.895 -14.321 1.00 0.00 N ATOM 458 CA HIS A 34 9.022 4.594 -15.234 1.00 0.00 C ATOM 459 C HIS A 34 7.938 5.343 -14.464 1.00 0.00 C ATOM 460 O HIS A 34 7.218 4.755 -13.658 1.00 0.00 O ATOM 461 CB HIS A 34 8.382 3.607 -16.210 1.00 0.00 C ATOM 462 CG HIS A 34 9.374 2.882 -17.066 1.00 0.00 C ATOM 463 ND1 HIS A 34 9.111 1.663 -17.656 1.00 0.00 N ATOM 464 CD2 HIS A 34 10.635 3.211 -17.432 1.00 0.00 C ATOM 465 CE1 HIS A 34 10.168 1.274 -18.346 1.00 0.00 C ATOM 466 NE2 HIS A 34 11.106 2.196 -18.227 1.00 0.00 N ATOM 0 H HIS A 34 9.757 2.890 -14.258 1.00 0.00 H new ATOM 0 HA HIS A 34 9.610 5.319 -15.797 1.00 0.00 H new ATOM 0 HB2 HIS A 34 7.799 2.878 -15.647 1.00 0.00 H new ATOM 0 HB3 HIS A 34 7.685 4.145 -16.852 1.00 0.00 H new ATOM 0 HD2 HIS A 34 11.171 4.106 -17.151 1.00 0.00 H new ATOM 0 HE1 HIS A 34 10.251 0.358 -18.911 1.00 0.00 H new ATOM 0 HE2 HIS A 34 12.031 2.160 -18.656 1.00 0.00 H new ATOM 475 N ALA A 35 7.830 6.643 -14.718 1.00 0.00 N ATOM 476 CA ALA A 35 6.833 7.471 -14.050 1.00 0.00 C ATOM 477 C ALA A 35 5.540 6.696 -13.821 1.00 0.00 C ATOM 478 O ALA A 35 4.915 6.218 -14.767 1.00 0.00 O ATOM 479 CB ALA A 35 6.561 8.728 -14.862 1.00 0.00 C ATOM 0 H ALA A 35 8.420 7.145 -15.381 1.00 0.00 H new ATOM 0 HA ALA A 35 7.230 7.760 -13.077 1.00 0.00 H new ATOM 0 HB1 ALA A 35 5.815 9.337 -14.351 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.483 9.299 -14.969 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.190 8.451 -15.849 1.00 0.00 H new ATOM 485 N GLY A 36 5.143 6.575 -12.557 1.00 0.00 N ATOM 486 CA GLY A 36 3.927 5.856 -12.228 1.00 0.00 C ATOM 487 C GLY A 36 2.840 6.048 -13.267 1.00 0.00 C ATOM 488 O GLY A 36 2.274 5.078 -13.769 1.00 0.00 O ATOM 0 H GLY A 36 5.642 6.962 -11.756 1.00 0.00 H new ATOM 0 HA2 GLY A 36 4.151 4.794 -12.134 1.00 0.00 H new ATOM 0 HA3 GLY A 36 3.561 6.192 -11.258 1.00 0.00 H new ATOM 492 N ASN A 37 2.547 7.303 -13.589 1.00 0.00 N ATOM 493 CA ASN A 37 1.519 7.619 -14.574 1.00 0.00 C ATOM 494 C ASN A 37 2.109 7.671 -15.980 1.00 0.00 C ATOM 495 O ASN A 37 3.161 8.265 -16.216 1.00 0.00 O ATOM 496 CB ASN A 37 0.855 8.957 -14.238 1.00 0.00 C ATOM 497 CG ASN A 37 -0.593 9.012 -14.685 1.00 0.00 C ATOM 498 OD1 ASN A 37 -1.349 8.059 -14.496 1.00 0.00 O ATOM 499 ND2 ASN A 37 -0.986 10.132 -15.281 1.00 0.00 N ATOM 0 H ASN A 37 3.007 8.118 -13.183 1.00 0.00 H new ATOM 0 HA ASN A 37 0.768 6.830 -14.544 1.00 0.00 H new ATOM 0 HB2 ASN A 37 0.907 9.125 -13.162 1.00 0.00 H new ATOM 0 HB3 ASN A 37 1.410 9.765 -14.714 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -1.949 10.227 -15.603 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -0.325 10.897 -15.417 1.00 0.00 H new ATOM 506 N PRO A 38 1.417 7.034 -16.936 1.00 0.00 N ATOM 507 CA PRO A 38 1.853 6.993 -18.335 1.00 0.00 C ATOM 508 C PRO A 38 1.737 8.352 -19.018 1.00 0.00 C ATOM 509 O PRO A 38 2.087 8.500 -20.189 1.00 0.00 O ATOM 510 CB PRO A 38 0.894 5.988 -18.976 1.00 0.00 C ATOM 511 CG PRO A 38 -0.327 6.031 -18.123 1.00 0.00 C ATOM 512 CD PRO A 38 0.155 6.305 -16.725 1.00 0.00 C ATOM 0 HA PRO A 38 2.904 6.718 -18.427 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.666 6.260 -20.007 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.326 4.988 -18.998 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -1.011 6.810 -18.460 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -0.870 5.087 -18.171 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -0.564 6.900 -16.162 1.00 0.00 H new ATOM 0 HD3 PRO A 38 0.312 5.382 -16.166 1.00 0.00 H new ATOM 520 N ARG A 39 1.243 9.340 -18.279 1.00 0.00 N ATOM 521 CA ARG A 39 1.080 10.686 -18.815 1.00 0.00 C ATOM 522 C ARG A 39 2.435 11.317 -19.123 1.00 0.00 C ATOM 523 O ARG A 39 2.652 11.844 -20.214 1.00 0.00 O ATOM 524 CB ARG A 39 0.311 11.563 -17.824 1.00 0.00 C ATOM 525 CG ARG A 39 -0.355 12.768 -18.467 1.00 0.00 C ATOM 526 CD ARG A 39 -1.630 12.375 -19.198 1.00 0.00 C ATOM 527 NE ARG A 39 -2.743 12.155 -18.277 1.00 0.00 N ATOM 528 CZ ARG A 39 -3.507 13.132 -17.802 1.00 0.00 C ATOM 529 NH1 ARG A 39 -3.281 14.389 -18.158 1.00 0.00 N ATOM 530 NH2 ARG A 39 -4.501 12.852 -16.968 1.00 0.00 N ATOM 0 H ARG A 39 0.949 9.234 -17.308 1.00 0.00 H new ATOM 0 HA ARG A 39 0.513 10.614 -19.743 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -0.450 10.958 -17.331 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.996 11.907 -17.049 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -0.587 13.509 -17.702 1.00 0.00 H new ATOM 0 HG3 ARG A 39 0.337 13.238 -19.166 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -1.897 13.158 -19.908 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -1.452 11.468 -19.775 1.00 0.00 H new ATOM 0 HE ARG A 39 -2.944 11.199 -17.983 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -2.518 14.608 -18.799 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -3.870 15.137 -17.791 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -4.678 11.886 -16.692 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -5.088 13.603 -16.603 1.00 0.00 H new ATOM 544 N ASP A 40 3.343 11.258 -18.155 1.00 0.00 N ATOM 545 CA ASP A 40 4.677 11.823 -18.323 1.00 0.00 C ATOM 546 C ASP A 40 5.734 10.911 -17.707 1.00 0.00 C ATOM 547 O ASP A 40 5.806 10.737 -16.490 1.00 0.00 O ATOM 548 CB ASP A 40 4.750 13.211 -17.686 1.00 0.00 C ATOM 549 CG ASP A 40 3.826 14.206 -18.360 1.00 0.00 C ATOM 550 OD1 ASP A 40 4.168 14.681 -19.463 1.00 0.00 O ATOM 551 OD2 ASP A 40 2.760 14.510 -17.784 1.00 0.00 O ATOM 0 H ASP A 40 3.180 10.825 -17.246 1.00 0.00 H new ATOM 0 HA ASP A 40 4.876 11.911 -19.391 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.491 13.137 -16.630 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.775 13.578 -17.738 1.00 0.00 H new ATOM 556 N PRO A 41 6.573 10.313 -18.566 1.00 0.00 N ATOM 557 CA PRO A 41 7.641 9.409 -18.129 1.00 0.00 C ATOM 558 C PRO A 41 8.758 10.143 -17.396 1.00 0.00 C ATOM 559 O PRO A 41 9.735 9.532 -16.959 1.00 0.00 O ATOM 560 CB PRO A 41 8.162 8.816 -19.441 1.00 0.00 C ATOM 561 CG PRO A 41 7.830 9.836 -20.476 1.00 0.00 C ATOM 562 CD PRO A 41 6.545 10.475 -20.029 1.00 0.00 C ATOM 0 HA PRO A 41 7.279 8.663 -17.421 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.236 8.634 -19.394 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.686 7.860 -19.660 1.00 0.00 H new ATOM 0 HG2 PRO A 41 8.625 10.577 -20.563 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.716 9.374 -21.457 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.498 11.526 -20.316 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.678 9.985 -20.471 1.00 0.00 H new ATOM 570 N THR A 42 8.609 11.457 -17.262 1.00 0.00 N ATOM 571 CA THR A 42 9.606 12.274 -16.582 1.00 0.00 C ATOM 572 C THR A 42 9.166 12.608 -15.161 1.00 0.00 C ATOM 573 O THR A 42 9.202 13.767 -14.746 1.00 0.00 O ATOM 574 CB THR A 42 9.874 13.585 -17.346 1.00 0.00 C ATOM 575 OG1 THR A 42 8.658 14.328 -17.485 1.00 0.00 O ATOM 576 CG2 THR A 42 10.461 13.300 -18.720 1.00 0.00 C ATOM 0 H THR A 42 7.807 11.978 -17.616 1.00 0.00 H new ATOM 0 HA THR A 42 10.525 11.688 -16.547 1.00 0.00 H new ATOM 0 HB THR A 42 10.594 14.172 -16.776 1.00 0.00 H new ATOM 0 HG1 THR A 42 8.837 15.161 -17.970 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.642 14.240 -19.241 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.401 12.760 -18.609 1.00 0.00 H new ATOM 0 HG23 THR A 42 9.761 12.695 -19.296 1.00 0.00 H new ATOM 584 N ASP A 43 8.751 11.587 -14.420 1.00 0.00 N ATOM 585 CA ASP A 43 8.306 11.773 -13.043 1.00 0.00 C ATOM 586 C ASP A 43 8.825 10.652 -12.149 1.00 0.00 C ATOM 587 O ASP A 43 8.408 9.501 -12.275 1.00 0.00 O ATOM 588 CB ASP A 43 6.778 11.825 -12.982 1.00 0.00 C ATOM 589 CG ASP A 43 6.273 12.537 -11.743 1.00 0.00 C ATOM 590 OD1 ASP A 43 7.010 12.569 -10.735 1.00 0.00 O ATOM 591 OD2 ASP A 43 5.140 13.061 -11.780 1.00 0.00 O ATOM 0 H ASP A 43 8.713 10.622 -14.749 1.00 0.00 H new ATOM 0 HA ASP A 43 8.709 12.719 -12.681 1.00 0.00 H new ATOM 0 HB2 ASP A 43 6.399 12.332 -13.869 1.00 0.00 H new ATOM 0 HB3 ASP A 43 6.382 10.810 -13.001 1.00 0.00 H new ATOM 596 N GLU A 44 9.738 10.997 -11.246 1.00 0.00 N ATOM 597 CA GLU A 44 10.315 10.018 -10.331 1.00 0.00 C ATOM 598 C GLU A 44 9.427 9.829 -9.105 1.00 0.00 C ATOM 599 O GLU A 44 9.769 9.088 -8.185 1.00 0.00 O ATOM 600 CB GLU A 44 11.715 10.456 -9.898 1.00 0.00 C ATOM 601 CG GLU A 44 12.718 10.507 -11.039 1.00 0.00 C ATOM 602 CD GLU A 44 12.589 11.766 -11.873 1.00 0.00 C ATOM 603 OE1 GLU A 44 12.874 12.861 -11.344 1.00 0.00 O ATOM 604 OE2 GLU A 44 12.203 11.657 -13.056 1.00 0.00 O ATOM 0 H GLU A 44 10.094 11.946 -11.128 1.00 0.00 H new ATOM 0 HA GLU A 44 10.386 9.066 -10.856 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.652 11.442 -9.437 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.081 9.770 -9.134 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.728 10.446 -10.633 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.579 9.636 -11.679 1.00 0.00 H new ATOM 611 N GLY A 45 8.283 10.508 -9.100 1.00 0.00 N ATOM 612 CA GLY A 45 7.363 10.402 -7.982 1.00 0.00 C ATOM 613 C GLY A 45 6.991 8.966 -7.671 1.00 0.00 C ATOM 614 O GLY A 45 7.026 8.105 -8.550 1.00 0.00 O ATOM 0 H GLY A 45 7.977 11.129 -9.849 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.814 10.856 -7.100 1.00 0.00 H new ATOM 0 HA3 GLY A 45 6.459 10.968 -8.205 1.00 0.00 H new ATOM 618 N ILE A 46 6.636 8.707 -6.417 1.00 0.00 N ATOM 619 CA ILE A 46 6.257 7.365 -5.992 1.00 0.00 C ATOM 620 C ILE A 46 4.864 7.358 -5.372 1.00 0.00 C ATOM 621 O ILE A 46 4.621 8.013 -4.359 1.00 0.00 O ATOM 622 CB ILE A 46 7.262 6.791 -4.976 1.00 0.00 C ATOM 623 CG1 ILE A 46 8.682 6.843 -5.545 1.00 0.00 C ATOM 624 CG2 ILE A 46 6.886 5.364 -4.608 1.00 0.00 C ATOM 625 CD1 ILE A 46 9.758 6.648 -4.501 1.00 0.00 C ATOM 0 H ILE A 46 6.603 9.409 -5.678 1.00 0.00 H new ATOM 0 HA ILE A 46 6.258 6.739 -6.884 1.00 0.00 H new ATOM 0 HB ILE A 46 7.230 7.400 -4.072 1.00 0.00 H new ATOM 0 HG12 ILE A 46 8.786 6.074 -6.311 1.00 0.00 H new ATOM 0 HG13 ILE A 46 8.833 7.804 -6.036 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.606 4.972 -3.889 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.889 5.353 -4.167 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.893 4.743 -5.504 1.00 0.00 H new ATOM 0 HD11 ILE A 46 10.738 6.697 -4.975 1.00 0.00 H new ATOM 0 HD12 ILE A 46 9.680 7.432 -3.747 1.00 0.00 H new ATOM 0 HD13 ILE A 46 9.633 5.675 -4.027 1.00 0.00 H new ATOM 637 N PHE A 47 3.953 6.611 -5.987 1.00 0.00 N ATOM 638 CA PHE A 47 2.583 6.517 -5.495 1.00 0.00 C ATOM 639 C PHE A 47 2.156 5.060 -5.350 1.00 0.00 C ATOM 640 O PHE A 47 2.589 4.196 -6.114 1.00 0.00 O ATOM 641 CB PHE A 47 1.628 7.249 -6.441 1.00 0.00 C ATOM 642 CG PHE A 47 2.032 8.667 -6.722 1.00 0.00 C ATOM 643 CD1 PHE A 47 3.246 8.948 -7.328 1.00 0.00 C ATOM 644 CD2 PHE A 47 1.199 9.720 -6.380 1.00 0.00 C ATOM 645 CE1 PHE A 47 3.622 10.253 -7.589 1.00 0.00 C ATOM 646 CE2 PHE A 47 1.569 11.027 -6.639 1.00 0.00 C ATOM 647 CZ PHE A 47 2.782 11.293 -7.243 1.00 0.00 C ATOM 0 H PHE A 47 4.138 6.062 -6.827 1.00 0.00 H new ATOM 0 HA PHE A 47 2.543 6.988 -4.513 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.572 6.702 -7.382 1.00 0.00 H new ATOM 0 HB3 PHE A 47 0.627 7.244 -6.009 1.00 0.00 H new ATOM 0 HD1 PHE A 47 3.907 8.138 -7.600 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.250 9.518 -5.906 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.571 10.458 -8.062 1.00 0.00 H new ATOM 0 HE2 PHE A 47 0.910 11.839 -6.369 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.073 12.313 -7.445 1.00 0.00 H new ATOM 657 N ILE A 48 1.305 4.794 -4.365 1.00 0.00 N ATOM 658 CA ILE A 48 0.819 3.442 -4.120 1.00 0.00 C ATOM 659 C ILE A 48 0.168 2.857 -5.368 1.00 0.00 C ATOM 660 O ILE A 48 -0.610 3.527 -6.047 1.00 0.00 O ATOM 661 CB ILE A 48 -0.196 3.410 -2.962 1.00 0.00 C ATOM 662 CG1 ILE A 48 0.465 3.874 -1.662 1.00 0.00 C ATOM 663 CG2 ILE A 48 -0.771 2.010 -2.800 1.00 0.00 C ATOM 664 CD1 ILE A 48 -0.515 4.091 -0.530 1.00 0.00 C ATOM 0 H ILE A 48 0.938 5.497 -3.724 1.00 0.00 H new ATOM 0 HA ILE A 48 1.686 2.839 -3.849 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.013 4.093 -3.196 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.204 3.134 -1.355 1.00 0.00 H new ATOM 0 HG13 ILE A 48 1.003 4.803 -1.849 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -1.487 2.003 -1.978 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -1.274 1.714 -3.721 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.035 1.308 -2.585 1.00 0.00 H new ATOM 0 HD11 ILE A 48 0.023 4.419 0.359 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -1.240 4.853 -0.817 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -1.036 3.158 -0.316 1.00 0.00 H new ATOM 676 N SER A 49 0.490 1.602 -5.664 1.00 0.00 N ATOM 677 CA SER A 49 -0.063 0.926 -6.833 1.00 0.00 C ATOM 678 C SER A 49 -0.970 -0.227 -6.415 1.00 0.00 C ATOM 679 O SER A 49 -1.721 -0.768 -7.227 1.00 0.00 O ATOM 680 CB SER A 49 1.064 0.405 -7.727 1.00 0.00 C ATOM 681 OG SER A 49 1.730 -0.690 -7.123 1.00 0.00 O ATOM 0 H SER A 49 1.131 1.032 -5.111 1.00 0.00 H new ATOM 0 HA SER A 49 -0.657 1.648 -7.393 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.656 0.100 -8.691 1.00 0.00 H new ATOM 0 HB3 SER A 49 1.777 1.206 -7.922 1.00 0.00 H new ATOM 0 HG SER A 49 2.445 -1.005 -7.715 1.00 0.00 H new ATOM 687 N LYS A 50 -0.894 -0.600 -5.142 1.00 0.00 N ATOM 688 CA LYS A 50 -1.708 -1.688 -4.613 1.00 0.00 C ATOM 689 C LYS A 50 -1.605 -1.755 -3.093 1.00 0.00 C ATOM 690 O LYS A 50 -0.672 -1.213 -2.499 1.00 0.00 O ATOM 691 CB LYS A 50 -1.272 -3.022 -5.224 1.00 0.00 C ATOM 692 CG LYS A 50 -2.067 -4.212 -4.716 1.00 0.00 C ATOM 693 CD LYS A 50 -1.805 -5.455 -5.550 1.00 0.00 C ATOM 694 CE LYS A 50 -2.677 -5.484 -6.796 1.00 0.00 C ATOM 695 NZ LYS A 50 -4.101 -5.770 -6.469 1.00 0.00 N ATOM 0 H LYS A 50 -0.276 -0.164 -4.457 1.00 0.00 H new ATOM 0 HA LYS A 50 -2.747 -1.495 -4.881 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.371 -2.965 -6.308 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -0.216 -3.183 -5.009 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -1.805 -4.409 -3.676 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -3.131 -3.976 -4.738 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -0.754 -5.486 -5.839 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -1.997 -6.344 -4.950 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -2.608 -4.525 -7.310 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -2.303 -6.242 -7.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -4.603 -6.065 -7.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -4.149 -6.532 -5.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -4.548 -4.913 -6.084 1.00 0.00 H new ATOM 709 N VAL A 51 -2.568 -2.425 -2.468 1.00 0.00 N ATOM 710 CA VAL A 51 -2.584 -2.566 -1.017 1.00 0.00 C ATOM 711 C VAL A 51 -3.250 -3.871 -0.598 1.00 0.00 C ATOM 712 O VAL A 51 -4.412 -4.119 -0.922 1.00 0.00 O ATOM 713 CB VAL A 51 -3.318 -1.389 -0.347 1.00 0.00 C ATOM 714 CG1 VAL A 51 -3.375 -1.584 1.161 1.00 0.00 C ATOM 715 CG2 VAL A 51 -2.644 -0.072 -0.698 1.00 0.00 C ATOM 0 H VAL A 51 -3.348 -2.879 -2.944 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.545 -2.571 -0.688 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.340 -1.359 -0.724 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.897 -0.743 1.617 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.907 -2.508 1.389 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.362 -1.641 1.559 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.176 0.749 -0.216 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.611 -0.088 -0.351 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.662 0.069 -1.779 1.00 0.00 H new ATOM 725 N SER A 52 -2.508 -4.704 0.125 1.00 0.00 N ATOM 726 CA SER A 52 -3.025 -5.986 0.586 1.00 0.00 C ATOM 727 C SER A 52 -4.120 -5.787 1.629 1.00 0.00 C ATOM 728 O SER A 52 -4.029 -4.926 2.505 1.00 0.00 O ATOM 729 CB SER A 52 -1.896 -6.836 1.171 1.00 0.00 C ATOM 730 OG SER A 52 -2.295 -8.188 1.312 1.00 0.00 O ATOM 0 H SER A 52 -1.546 -4.513 0.404 1.00 0.00 H new ATOM 0 HA SER A 52 -3.454 -6.505 -0.271 1.00 0.00 H new ATOM 0 HB2 SER A 52 -1.020 -6.778 0.524 1.00 0.00 H new ATOM 0 HB3 SER A 52 -1.602 -6.437 2.142 1.00 0.00 H new ATOM 0 HG SER A 52 -1.555 -8.710 1.686 1.00 0.00 H new ATOM 736 N PRO A 53 -5.182 -6.601 1.535 1.00 0.00 N ATOM 737 CA PRO A 53 -6.315 -6.535 2.462 1.00 0.00 C ATOM 738 C PRO A 53 -5.948 -7.015 3.862 1.00 0.00 C ATOM 739 O PRO A 53 -6.514 -6.559 4.856 1.00 0.00 O ATOM 740 CB PRO A 53 -7.347 -7.472 1.829 1.00 0.00 C ATOM 741 CG PRO A 53 -6.542 -8.428 1.018 1.00 0.00 C ATOM 742 CD PRO A 53 -5.357 -7.650 0.516 1.00 0.00 C ATOM 0 HA PRO A 53 -6.672 -5.514 2.596 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -7.930 -7.991 2.590 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -8.053 -6.922 1.207 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.223 -9.279 1.620 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.127 -8.826 0.189 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -4.471 -8.279 0.430 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -5.544 -7.225 -0.470 1.00 0.00 H new ATOM 750 N THR A 54 -4.994 -7.939 3.935 1.00 0.00 N ATOM 751 CA THR A 54 -4.552 -8.482 5.213 1.00 0.00 C ATOM 752 C THR A 54 -3.359 -7.704 5.757 1.00 0.00 C ATOM 753 O THR A 54 -2.789 -8.062 6.787 1.00 0.00 O ATOM 754 CB THR A 54 -4.168 -9.968 5.090 1.00 0.00 C ATOM 755 OG1 THR A 54 -2.900 -10.094 4.437 1.00 0.00 O ATOM 756 CG2 THR A 54 -5.224 -10.737 4.310 1.00 0.00 C ATOM 0 H THR A 54 -4.513 -8.327 3.123 1.00 0.00 H new ATOM 0 HA THR A 54 -5.390 -8.387 5.903 1.00 0.00 H new ATOM 0 HB THR A 54 -4.103 -10.388 6.094 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.662 -11.042 4.364 1.00 0.00 H new ATOM 0 HG21 THR A 54 -4.931 -11.784 4.236 1.00 0.00 H new ATOM 0 HG22 THR A 54 -6.182 -10.664 4.825 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.317 -10.315 3.309 1.00 0.00 H new ATOM 764 N GLY A 55 -2.985 -6.637 5.057 1.00 0.00 N ATOM 765 CA GLY A 55 -1.861 -5.825 5.486 1.00 0.00 C ATOM 766 C GLY A 55 -2.262 -4.770 6.499 1.00 0.00 C ATOM 767 O GLY A 55 -3.439 -4.435 6.624 1.00 0.00 O ATOM 0 H GLY A 55 -3.440 -6.321 4.201 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.096 -6.469 5.920 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.415 -5.340 4.618 1.00 0.00 H new ATOM 771 N ALA A 56 -1.279 -4.245 7.224 1.00 0.00 N ATOM 772 CA ALA A 56 -1.535 -3.222 8.230 1.00 0.00 C ATOM 773 C ALA A 56 -2.354 -2.074 7.650 1.00 0.00 C ATOM 774 O ALA A 56 -3.245 -1.539 8.310 1.00 0.00 O ATOM 775 CB ALA A 56 -0.223 -2.702 8.799 1.00 0.00 C ATOM 0 H ALA A 56 -0.299 -4.511 7.133 1.00 0.00 H new ATOM 0 HA ALA A 56 -2.113 -3.676 9.035 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.429 -1.939 9.549 1.00 0.00 H new ATOM 0 HB2 ALA A 56 0.325 -3.524 9.259 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.376 -2.270 7.997 1.00 0.00 H new ATOM 781 N ALA A 57 -2.047 -1.700 6.412 1.00 0.00 N ATOM 782 CA ALA A 57 -2.756 -0.617 5.743 1.00 0.00 C ATOM 783 C ALA A 57 -4.181 -1.030 5.389 1.00 0.00 C ATOM 784 O ALA A 57 -5.146 -0.406 5.829 1.00 0.00 O ATOM 785 CB ALA A 57 -2.003 -0.185 4.494 1.00 0.00 C ATOM 0 H ALA A 57 -1.312 -2.132 5.852 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.811 0.227 6.430 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.544 0.625 4.005 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -1.007 0.160 4.771 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -1.918 -1.030 3.810 1.00 0.00 H new ATOM 791 N GLY A 58 -4.305 -2.084 4.589 1.00 0.00 N ATOM 792 CA GLY A 58 -5.615 -2.562 4.188 1.00 0.00 C ATOM 793 C GLY A 58 -6.629 -2.486 5.312 1.00 0.00 C ATOM 794 O GLY A 58 -7.774 -2.089 5.099 1.00 0.00 O ATOM 0 H GLY A 58 -3.521 -2.616 4.211 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -5.970 -1.973 3.342 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -5.533 -3.594 3.846 1.00 0.00 H new ATOM 798 N ARG A 59 -6.207 -2.868 6.513 1.00 0.00 N ATOM 799 CA ARG A 59 -7.088 -2.845 7.675 1.00 0.00 C ATOM 800 C ARG A 59 -7.142 -1.448 8.288 1.00 0.00 C ATOM 801 O ARG A 59 -8.153 -1.053 8.868 1.00 0.00 O ATOM 802 CB ARG A 59 -6.613 -3.854 8.722 1.00 0.00 C ATOM 803 CG ARG A 59 -5.308 -3.464 9.396 1.00 0.00 C ATOM 804 CD ARG A 59 -4.884 -4.498 10.428 1.00 0.00 C ATOM 805 NE ARG A 59 -3.988 -3.932 11.433 1.00 0.00 N ATOM 806 CZ ARG A 59 -3.556 -4.605 12.494 1.00 0.00 C ATOM 807 NH1 ARG A 59 -3.935 -5.861 12.687 1.00 0.00 N ATOM 808 NH2 ARG A 59 -2.742 -4.021 13.364 1.00 0.00 N ATOM 0 H ARG A 59 -5.261 -3.197 6.707 1.00 0.00 H new ATOM 0 HA ARG A 59 -8.090 -3.118 7.345 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -7.386 -3.966 9.483 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -6.490 -4.827 8.247 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.526 -3.357 8.644 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.422 -2.493 9.878 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.768 -4.905 10.919 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.388 -5.329 9.926 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.677 -2.968 11.314 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.560 -6.313 12.020 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.601 -6.375 13.503 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.448 -3.055 13.218 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -2.410 -4.538 14.178 1.00 0.00 H new ATOM 822 N ASP A 60 -6.048 -0.707 8.155 1.00 0.00 N ATOM 823 CA ASP A 60 -5.971 0.646 8.694 1.00 0.00 C ATOM 824 C ASP A 60 -7.229 1.439 8.354 1.00 0.00 C ATOM 825 O ASP A 60 -7.912 1.949 9.242 1.00 0.00 O ATOM 826 CB ASP A 60 -4.736 1.366 8.149 1.00 0.00 C ATOM 827 CG ASP A 60 -4.550 2.740 8.762 1.00 0.00 C ATOM 828 OD1 ASP A 60 -5.140 2.998 9.832 1.00 0.00 O ATOM 829 OD2 ASP A 60 -3.812 3.557 8.172 1.00 0.00 O ATOM 0 H ASP A 60 -5.202 -1.020 7.679 1.00 0.00 H new ATOM 0 HA ASP A 60 -5.891 0.574 9.779 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -3.851 0.761 8.344 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.823 1.463 7.067 1.00 0.00 H new ATOM 834 N GLY A 61 -7.527 1.541 7.063 1.00 0.00 N ATOM 835 CA GLY A 61 -8.702 2.275 6.628 1.00 0.00 C ATOM 836 C GLY A 61 -8.355 3.629 6.042 1.00 0.00 C ATOM 837 O GLY A 61 -9.148 4.215 5.304 1.00 0.00 O ATOM 0 H GLY A 61 -6.976 1.129 6.310 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -9.239 1.687 5.884 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.376 2.410 7.474 1.00 0.00 H new ATOM 841 N ARG A 62 -7.168 4.128 6.371 1.00 0.00 N ATOM 842 CA ARG A 62 -6.720 5.423 5.874 1.00 0.00 C ATOM 843 C ARG A 62 -5.838 5.256 4.639 1.00 0.00 C ATOM 844 O ARG A 62 -5.664 6.191 3.856 1.00 0.00 O ATOM 845 CB ARG A 62 -5.953 6.174 6.964 1.00 0.00 C ATOM 846 CG ARG A 62 -6.505 5.949 8.362 1.00 0.00 C ATOM 847 CD ARG A 62 -7.746 6.792 8.613 1.00 0.00 C ATOM 848 NE ARG A 62 -8.841 6.434 7.716 1.00 0.00 N ATOM 849 CZ ARG A 62 -9.935 7.172 7.562 1.00 0.00 C ATOM 850 NH1 ARG A 62 -10.078 8.301 8.241 1.00 0.00 N ATOM 851 NH2 ARG A 62 -10.889 6.779 6.727 1.00 0.00 N ATOM 0 H ARG A 62 -6.500 3.655 6.979 1.00 0.00 H new ATOM 0 HA ARG A 62 -7.601 6.001 5.595 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.908 5.864 6.941 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.974 7.241 6.742 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.747 4.894 8.493 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.741 6.195 9.100 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -8.068 6.665 9.647 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.501 7.846 8.483 1.00 0.00 H new ATOM 0 HE ARG A 62 -8.762 5.571 7.179 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.347 8.606 8.884 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.919 8.865 8.121 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -10.782 5.910 6.203 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.729 7.346 6.609 1.00 0.00 H new ATOM 865 N LEU A 63 -5.283 4.061 4.473 1.00 0.00 N ATOM 866 CA LEU A 63 -4.419 3.771 3.334 1.00 0.00 C ATOM 867 C LEU A 63 -5.231 3.251 2.152 1.00 0.00 C ATOM 868 O LEU A 63 -6.093 2.387 2.311 1.00 0.00 O ATOM 869 CB LEU A 63 -3.353 2.745 3.726 1.00 0.00 C ATOM 870 CG LEU A 63 -2.061 2.775 2.909 1.00 0.00 C ATOM 871 CD1 LEU A 63 -2.291 2.194 1.523 1.00 0.00 C ATOM 872 CD2 LEU A 63 -1.524 4.196 2.811 1.00 0.00 C ATOM 0 H LEU A 63 -5.416 3.277 5.112 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.930 4.698 3.035 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -3.100 2.897 4.775 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.788 1.749 3.644 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.318 2.161 3.419 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.360 2.224 0.957 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.628 1.161 1.613 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.050 2.780 1.004 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.604 4.198 2.226 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.264 4.832 2.325 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -1.319 4.577 3.811 1.00 0.00 H new ATOM 884 N ARG A 64 -4.947 3.781 0.967 1.00 0.00 N ATOM 885 CA ARG A 64 -5.650 3.370 -0.242 1.00 0.00 C ATOM 886 C ARG A 64 -4.703 3.339 -1.438 1.00 0.00 C ATOM 887 O ARG A 64 -3.696 4.047 -1.464 1.00 0.00 O ATOM 888 CB ARG A 64 -6.817 4.317 -0.526 1.00 0.00 C ATOM 889 CG ARG A 64 -7.764 4.487 0.651 1.00 0.00 C ATOM 890 CD ARG A 64 -8.886 3.461 0.616 1.00 0.00 C ATOM 891 NE ARG A 64 -9.997 3.893 -0.228 1.00 0.00 N ATOM 892 CZ ARG A 64 -10.807 4.899 0.082 1.00 0.00 C ATOM 893 NH1 ARG A 64 -10.630 5.574 1.209 1.00 0.00 N ATOM 894 NH2 ARG A 64 -11.796 5.232 -0.738 1.00 0.00 N ATOM 0 H ARG A 64 -4.235 4.496 0.818 1.00 0.00 H new ATOM 0 HA ARG A 64 -6.038 2.364 -0.082 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.422 5.293 -0.807 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -7.378 3.942 -1.382 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.208 4.388 1.584 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.187 5.491 0.637 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.498 2.512 0.246 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.248 3.285 1.629 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.160 3.395 -1.103 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -9.870 5.321 1.841 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -11.254 6.346 1.444 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -11.934 4.715 -1.607 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -12.418 6.005 -0.500 1.00 0.00 H new ATOM 908 N VAL A 65 -5.033 2.514 -2.427 1.00 0.00 N ATOM 909 CA VAL A 65 -4.213 2.391 -3.626 1.00 0.00 C ATOM 910 C VAL A 65 -4.306 3.647 -4.486 1.00 0.00 C ATOM 911 O VAL A 65 -5.131 3.729 -5.395 1.00 0.00 O ATOM 912 CB VAL A 65 -4.631 1.172 -4.469 1.00 0.00 C ATOM 913 CG1 VAL A 65 -3.627 0.926 -5.586 1.00 0.00 C ATOM 914 CG2 VAL A 65 -4.774 -0.060 -3.589 1.00 0.00 C ATOM 0 H VAL A 65 -5.863 1.921 -2.421 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.184 2.257 -3.294 1.00 0.00 H new ATOM 0 HB VAL A 65 -5.600 1.381 -4.923 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -3.939 0.061 -6.171 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.579 1.803 -6.232 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.643 0.738 -5.156 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.070 -0.912 -4.201 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -3.821 -0.274 -3.105 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.534 0.122 -2.829 1.00 0.00 H new ATOM 924 N GLY A 66 -3.452 4.623 -4.193 1.00 0.00 N ATOM 925 CA GLY A 66 -3.454 5.862 -4.949 1.00 0.00 C ATOM 926 C GLY A 66 -2.832 7.011 -4.181 1.00 0.00 C ATOM 927 O GLY A 66 -2.466 8.032 -4.764 1.00 0.00 O ATOM 0 H GLY A 66 -2.759 4.578 -3.446 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.909 5.716 -5.882 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.479 6.120 -5.215 1.00 0.00 H new ATOM 931 N LEU A 67 -2.713 6.847 -2.868 1.00 0.00 N ATOM 932 CA LEU A 67 -2.132 7.880 -2.017 1.00 0.00 C ATOM 933 C LEU A 67 -0.644 8.049 -2.305 1.00 0.00 C ATOM 934 O LEU A 67 0.124 7.089 -2.238 1.00 0.00 O ATOM 935 CB LEU A 67 -2.342 7.532 -0.543 1.00 0.00 C ATOM 936 CG LEU A 67 -3.759 7.116 -0.146 1.00 0.00 C ATOM 937 CD1 LEU A 67 -3.878 6.996 1.365 1.00 0.00 C ATOM 938 CD2 LEU A 67 -4.777 8.111 -0.685 1.00 0.00 C ATOM 0 H LEU A 67 -3.011 6.009 -2.369 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.635 8.822 -2.236 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.661 6.723 -0.281 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.057 8.396 0.058 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.966 6.140 -0.584 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.893 6.699 1.628 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.175 6.245 1.727 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.651 7.957 1.825 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.780 7.800 -0.393 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -4.571 9.100 -0.276 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.710 8.147 -1.772 1.00 0.00 H new ATOM 950 N ARG A 68 -0.243 9.276 -2.623 1.00 0.00 N ATOM 951 CA ARG A 68 1.153 9.571 -2.919 1.00 0.00 C ATOM 952 C ARG A 68 2.000 9.522 -1.651 1.00 0.00 C ATOM 953 O ARG A 68 1.765 10.276 -0.705 1.00 0.00 O ATOM 954 CB ARG A 68 1.278 10.946 -3.576 1.00 0.00 C ATOM 955 CG ARG A 68 2.701 11.306 -3.971 1.00 0.00 C ATOM 956 CD ARG A 68 2.815 12.769 -4.369 1.00 0.00 C ATOM 957 NE ARG A 68 3.942 13.005 -5.268 1.00 0.00 N ATOM 958 CZ ARG A 68 4.356 14.216 -5.626 1.00 0.00 C ATOM 959 NH1 ARG A 68 3.740 15.295 -5.162 1.00 0.00 N ATOM 960 NH2 ARG A 68 5.388 14.349 -6.448 1.00 0.00 N ATOM 0 H ARG A 68 -0.866 10.082 -2.682 1.00 0.00 H new ATOM 0 HA ARG A 68 1.520 8.812 -3.610 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.646 10.974 -4.463 1.00 0.00 H new ATOM 0 HB3 ARG A 68 0.898 11.703 -2.890 1.00 0.00 H new ATOM 0 HG2 ARG A 68 3.374 11.101 -3.138 1.00 0.00 H new ATOM 0 HG3 ARG A 68 3.020 10.676 -4.801 1.00 0.00 H new ATOM 0 HD2 ARG A 68 1.892 13.086 -4.854 1.00 0.00 H new ATOM 0 HD3 ARG A 68 2.931 13.380 -3.474 1.00 0.00 H new ATOM 0 HE ARG A 68 4.438 12.196 -5.641 1.00 0.00 H new ATOM 0 HH11 ARG A 68 2.946 15.197 -4.529 1.00 0.00 H new ATOM 0 HH12 ARG A 68 4.060 16.223 -5.438 1.00 0.00 H new ATOM 0 HH21 ARG A 68 5.865 13.521 -6.806 1.00 0.00 H new ATOM 0 HH22 ARG A 68 5.705 15.279 -6.722 1.00 0.00 H new ATOM 974 N LEU A 69 2.986 8.632 -1.637 1.00 0.00 N ATOM 975 CA LEU A 69 3.868 8.484 -0.485 1.00 0.00 C ATOM 976 C LEU A 69 4.734 9.726 -0.300 1.00 0.00 C ATOM 977 O LEU A 69 5.619 10.006 -1.111 1.00 0.00 O ATOM 978 CB LEU A 69 4.756 7.249 -0.652 1.00 0.00 C ATOM 979 CG LEU A 69 4.283 5.982 0.060 1.00 0.00 C ATOM 980 CD1 LEU A 69 4.632 6.039 1.539 1.00 0.00 C ATOM 981 CD2 LEU A 69 2.786 5.790 -0.130 1.00 0.00 C ATOM 0 H LEU A 69 3.195 8.002 -2.411 1.00 0.00 H new ATOM 0 HA LEU A 69 3.248 8.360 0.403 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.846 7.032 -1.716 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.755 7.493 -0.291 1.00 0.00 H new ATOM 0 HG LEU A 69 4.797 5.128 -0.381 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.288 5.129 2.029 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.712 6.127 1.655 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.147 6.902 1.994 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.467 4.883 0.384 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.254 6.647 0.283 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.562 5.702 -1.193 1.00 0.00 H new ATOM 993 N LEU A 70 4.476 10.466 0.772 1.00 0.00 N ATOM 994 CA LEU A 70 5.234 11.678 1.066 1.00 0.00 C ATOM 995 C LEU A 70 6.493 11.353 1.863 1.00 0.00 C ATOM 996 O LEU A 70 7.599 11.721 1.470 1.00 0.00 O ATOM 997 CB LEU A 70 4.366 12.670 1.842 1.00 0.00 C ATOM 998 CG LEU A 70 3.562 13.661 1.000 1.00 0.00 C ATOM 999 CD1 LEU A 70 4.445 14.298 -0.062 1.00 0.00 C ATOM 1000 CD2 LEU A 70 2.368 12.970 0.359 1.00 0.00 C ATOM 0 H LEU A 70 3.748 10.249 1.452 1.00 0.00 H new ATOM 0 HA LEU A 70 5.532 12.129 0.120 1.00 0.00 H new ATOM 0 HB2 LEU A 70 3.671 12.105 2.464 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.010 13.235 2.516 1.00 0.00 H new ATOM 0 HG LEU A 70 3.191 14.449 1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.856 15.000 -0.652 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.267 14.828 0.419 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.846 13.523 -0.715 1.00 0.00 H new ATOM 0 HD21 LEU A 70 1.807 13.690 -0.236 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.717 12.162 -0.284 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.723 12.562 1.137 1.00 0.00 H new ATOM 1012 N GLU A 71 6.315 10.660 2.984 1.00 0.00 N ATOM 1013 CA GLU A 71 7.438 10.285 3.835 1.00 0.00 C ATOM 1014 C GLU A 71 7.091 9.068 4.688 1.00 0.00 C ATOM 1015 O GLU A 71 6.020 9.004 5.292 1.00 0.00 O ATOM 1016 CB GLU A 71 7.838 11.455 4.736 1.00 0.00 C ATOM 1017 CG GLU A 71 7.876 12.792 4.014 1.00 0.00 C ATOM 1018 CD GLU A 71 8.328 13.927 4.913 1.00 0.00 C ATOM 1019 OE1 GLU A 71 8.967 13.644 5.948 1.00 0.00 O ATOM 1020 OE2 GLU A 71 8.042 15.096 4.582 1.00 0.00 O ATOM 0 H GLU A 71 5.405 10.348 3.323 1.00 0.00 H new ATOM 0 HA GLU A 71 8.279 10.029 3.191 1.00 0.00 H new ATOM 0 HB2 GLU A 71 7.136 11.520 5.567 1.00 0.00 H new ATOM 0 HB3 GLU A 71 8.820 11.254 5.164 1.00 0.00 H new ATOM 0 HG2 GLU A 71 8.549 12.720 3.159 1.00 0.00 H new ATOM 0 HG3 GLU A 71 6.884 13.017 3.621 1.00 0.00 H new ATOM 1027 N VAL A 72 8.004 8.103 4.733 1.00 0.00 N ATOM 1028 CA VAL A 72 7.796 6.888 5.512 1.00 0.00 C ATOM 1029 C VAL A 72 8.660 6.886 6.768 1.00 0.00 C ATOM 1030 O VAL A 72 9.883 6.778 6.692 1.00 0.00 O ATOM 1031 CB VAL A 72 8.112 5.629 4.683 1.00 0.00 C ATOM 1032 CG1 VAL A 72 7.935 4.376 5.526 1.00 0.00 C ATOM 1033 CG2 VAL A 72 7.234 5.575 3.441 1.00 0.00 C ATOM 0 H VAL A 72 8.896 8.139 4.239 1.00 0.00 H new ATOM 0 HA VAL A 72 6.744 6.871 5.798 1.00 0.00 H new ATOM 0 HB VAL A 72 9.153 5.678 4.363 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.163 3.497 4.923 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.610 4.414 6.381 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.905 4.317 5.879 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.471 4.679 2.867 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.185 5.550 3.738 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.416 6.458 2.828 1.00 0.00 H new ATOM 1043 N ASN A 73 8.015 7.007 7.923 1.00 0.00 N ATOM 1044 CA ASN A 73 8.724 7.019 9.197 1.00 0.00 C ATOM 1045 C ASN A 73 9.624 8.246 9.307 1.00 0.00 C ATOM 1046 O ASN A 73 10.753 8.157 9.789 1.00 0.00 O ATOM 1047 CB ASN A 73 9.558 5.745 9.353 1.00 0.00 C ATOM 1048 CG ASN A 73 8.808 4.650 10.086 1.00 0.00 C ATOM 1049 OD1 ASN A 73 8.169 4.897 11.109 1.00 0.00 O ATOM 1050 ND2 ASN A 73 8.884 3.430 9.565 1.00 0.00 N ATOM 0 H ASN A 73 7.002 7.098 8.003 1.00 0.00 H new ATOM 0 HA ASN A 73 7.984 7.060 9.996 1.00 0.00 H new ATOM 0 HB2 ASN A 73 9.852 5.383 8.368 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.475 5.978 9.894 1.00 0.00 H new ATOM 0 HD21 ASN A 73 8.401 2.652 10.015 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.425 3.271 8.715 1.00 0.00 H new ATOM 1057 N GLN A 74 9.116 9.388 8.857 1.00 0.00 N ATOM 1058 CA GLN A 74 9.874 10.633 8.905 1.00 0.00 C ATOM 1059 C GLN A 74 11.116 10.548 8.024 1.00 0.00 C ATOM 1060 O GLN A 74 12.141 11.161 8.319 1.00 0.00 O ATOM 1061 CB GLN A 74 10.278 10.954 10.345 1.00 0.00 C ATOM 1062 CG GLN A 74 9.108 11.351 11.231 1.00 0.00 C ATOM 1063 CD GLN A 74 9.401 11.161 12.706 1.00 0.00 C ATOM 1064 OE1 GLN A 74 10.063 11.990 13.331 1.00 0.00 O ATOM 1065 NE2 GLN A 74 8.909 10.064 13.271 1.00 0.00 N ATOM 0 H GLN A 74 8.183 9.477 8.455 1.00 0.00 H new ATOM 0 HA GLN A 74 9.236 11.432 8.527 1.00 0.00 H new ATOM 0 HB2 GLN A 74 10.772 10.084 10.778 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.008 11.763 10.337 1.00 0.00 H new ATOM 0 HG2 GLN A 74 8.856 12.395 11.046 1.00 0.00 H new ATOM 0 HG3 GLN A 74 8.234 10.759 10.959 1.00 0.00 H new ATOM 0 HE21 GLN A 74 8.366 9.404 12.715 1.00 0.00 H new ATOM 0 HE22 GLN A 74 9.075 9.882 14.261 1.00 0.00 H new ATOM 1074 N GLN A 75 11.016 9.783 6.941 1.00 0.00 N ATOM 1075 CA GLN A 75 12.132 9.618 6.017 1.00 0.00 C ATOM 1076 C GLN A 75 11.692 9.876 4.580 1.00 0.00 C ATOM 1077 O GLN A 75 11.247 8.964 3.884 1.00 0.00 O ATOM 1078 CB GLN A 75 12.717 8.210 6.139 1.00 0.00 C ATOM 1079 CG GLN A 75 13.268 7.897 7.521 1.00 0.00 C ATOM 1080 CD GLN A 75 14.324 6.809 7.496 1.00 0.00 C ATOM 1081 OE1 GLN A 75 15.379 6.966 6.881 1.00 0.00 O ATOM 1082 NE2 GLN A 75 14.044 5.697 8.165 1.00 0.00 N ATOM 0 H GLN A 75 10.174 9.268 6.682 1.00 0.00 H new ATOM 0 HA GLN A 75 12.899 10.347 6.279 1.00 0.00 H new ATOM 0 HB2 GLN A 75 11.944 7.482 5.892 1.00 0.00 H new ATOM 0 HB3 GLN A 75 13.513 8.092 5.404 1.00 0.00 H new ATOM 0 HG2 GLN A 75 13.695 8.803 7.951 1.00 0.00 H new ATOM 0 HG3 GLN A 75 12.450 7.589 8.173 1.00 0.00 H new ATOM 0 HE21 GLN A 75 13.157 5.610 8.661 1.00 0.00 H new ATOM 0 HE22 GLN A 75 14.716 4.930 8.183 1.00 0.00 H new ATOM 1091 N SER A 76 11.820 11.125 4.143 1.00 0.00 N ATOM 1092 CA SER A 76 11.431 11.504 2.790 1.00 0.00 C ATOM 1093 C SER A 76 11.967 10.503 1.770 1.00 0.00 C ATOM 1094 O SER A 76 13.104 10.042 1.874 1.00 0.00 O ATOM 1095 CB SER A 76 11.946 12.907 2.463 1.00 0.00 C ATOM 1096 OG SER A 76 11.629 13.269 1.130 1.00 0.00 O ATOM 0 H SER A 76 12.190 11.891 4.706 1.00 0.00 H new ATOM 0 HA SER A 76 10.342 11.503 2.738 1.00 0.00 H new ATOM 0 HB2 SER A 76 11.508 13.628 3.153 1.00 0.00 H new ATOM 0 HB3 SER A 76 13.026 12.944 2.606 1.00 0.00 H new ATOM 0 HG SER A 76 11.967 14.170 0.946 1.00 0.00 H new ATOM 1102 N LEU A 77 11.140 10.172 0.785 1.00 0.00 N ATOM 1103 CA LEU A 77 11.528 9.226 -0.255 1.00 0.00 C ATOM 1104 C LEU A 77 12.147 9.950 -1.447 1.00 0.00 C ATOM 1105 O LEU A 77 12.454 9.336 -2.469 1.00 0.00 O ATOM 1106 CB LEU A 77 10.316 8.413 -0.711 1.00 0.00 C ATOM 1107 CG LEU A 77 9.413 7.874 0.399 1.00 0.00 C ATOM 1108 CD1 LEU A 77 8.297 7.023 -0.187 1.00 0.00 C ATOM 1109 CD2 LEU A 77 10.225 7.073 1.405 1.00 0.00 C ATOM 0 H LEU A 77 10.196 10.545 0.685 1.00 0.00 H new ATOM 0 HA LEU A 77 12.274 8.550 0.164 1.00 0.00 H new ATOM 0 HB2 LEU A 77 9.713 9.036 -1.372 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.671 7.570 -1.304 1.00 0.00 H new ATOM 0 HG LEU A 77 8.962 8.720 0.918 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.665 6.648 0.618 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.698 7.627 -0.868 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.728 6.183 -0.731 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.566 6.697 2.188 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.704 6.234 0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 77 10.988 7.713 1.849 1.00 0.00 H new ATOM 1121 N LEU A 78 12.328 11.259 -1.308 1.00 0.00 N ATOM 1122 CA LEU A 78 12.912 12.068 -2.372 1.00 0.00 C ATOM 1123 C LEU A 78 14.419 11.848 -2.458 1.00 0.00 C ATOM 1124 O LEU A 78 15.154 12.135 -1.514 1.00 0.00 O ATOM 1125 CB LEU A 78 12.614 13.549 -2.136 1.00 0.00 C ATOM 1126 CG LEU A 78 12.502 14.419 -3.388 1.00 0.00 C ATOM 1127 CD1 LEU A 78 13.790 14.362 -4.195 1.00 0.00 C ATOM 1128 CD2 LEU A 78 11.319 13.981 -4.238 1.00 0.00 C ATOM 0 H LEU A 78 12.079 11.783 -0.469 1.00 0.00 H new ATOM 0 HA LEU A 78 12.464 11.760 -3.317 1.00 0.00 H new ATOM 0 HB2 LEU A 78 11.680 13.627 -1.579 1.00 0.00 H new ATOM 0 HB3 LEU A 78 13.399 13.960 -1.501 1.00 0.00 H new ATOM 0 HG LEU A 78 12.338 15.450 -3.076 1.00 0.00 H new ATOM 0 HD11 LEU A 78 13.691 14.987 -5.082 1.00 0.00 H new ATOM 0 HD12 LEU A 78 14.618 14.725 -3.586 1.00 0.00 H new ATOM 0 HD13 LEU A 78 13.985 13.333 -4.496 1.00 0.00 H new ATOM 0 HD21 LEU A 78 11.255 14.611 -5.125 1.00 0.00 H new ATOM 0 HD22 LEU A 78 11.453 12.942 -4.540 1.00 0.00 H new ATOM 0 HD23 LEU A 78 10.400 14.075 -3.659 1.00 0.00 H new ATOM 1140 N GLY A 79 14.874 11.339 -3.599 1.00 0.00 N ATOM 1141 CA GLY A 79 16.291 11.091 -3.788 1.00 0.00 C ATOM 1142 C GLY A 79 16.601 9.622 -3.998 1.00 0.00 C ATOM 1143 O GLY A 79 17.449 9.269 -4.819 1.00 0.00 O ATOM 0 H GLY A 79 14.286 11.094 -4.396 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.644 11.660 -4.648 1.00 0.00 H new ATOM 0 HA3 GLY A 79 16.839 11.454 -2.919 1.00 0.00 H new ATOM 1147 N LEU A 80 15.914 8.763 -3.254 1.00 0.00 N ATOM 1148 CA LEU A 80 16.120 7.322 -3.360 1.00 0.00 C ATOM 1149 C LEU A 80 15.324 6.743 -4.525 1.00 0.00 C ATOM 1150 O LEU A 80 14.452 7.407 -5.087 1.00 0.00 O ATOM 1151 CB LEU A 80 15.715 6.631 -2.057 1.00 0.00 C ATOM 1152 CG LEU A 80 14.586 7.295 -1.268 1.00 0.00 C ATOM 1153 CD1 LEU A 80 13.798 6.255 -0.487 1.00 0.00 C ATOM 1154 CD2 LEU A 80 15.142 8.359 -0.333 1.00 0.00 C ATOM 0 H LEU A 80 15.209 9.039 -2.570 1.00 0.00 H new ATOM 0 HA LEU A 80 17.180 7.144 -3.544 1.00 0.00 H new ATOM 0 HB2 LEU A 80 15.417 5.609 -2.289 1.00 0.00 H new ATOM 0 HB3 LEU A 80 16.593 6.569 -1.414 1.00 0.00 H new ATOM 0 HG LEU A 80 13.911 7.778 -1.974 1.00 0.00 H new ATOM 0 HD11 LEU A 80 12.999 6.746 0.068 1.00 0.00 H new ATOM 0 HD12 LEU A 80 13.368 5.530 -1.178 1.00 0.00 H new ATOM 0 HD13 LEU A 80 14.462 5.743 0.209 1.00 0.00 H new ATOM 0 HD21 LEU A 80 14.324 8.821 0.220 1.00 0.00 H new ATOM 0 HD22 LEU A 80 15.840 7.900 0.367 1.00 0.00 H new ATOM 0 HD23 LEU A 80 15.661 9.120 -0.916 1.00 0.00 H new ATOM 1166 N THR A 81 15.629 5.499 -4.883 1.00 0.00 N ATOM 1167 CA THR A 81 14.942 4.829 -5.980 1.00 0.00 C ATOM 1168 C THR A 81 13.932 3.813 -5.458 1.00 0.00 C ATOM 1169 O THR A 81 13.996 3.399 -4.300 1.00 0.00 O ATOM 1170 CB THR A 81 15.937 4.114 -6.913 1.00 0.00 C ATOM 1171 OG1 THR A 81 16.615 3.073 -6.201 1.00 0.00 O ATOM 1172 CG2 THR A 81 16.953 5.097 -7.475 1.00 0.00 C ATOM 0 H THR A 81 16.348 4.935 -4.429 1.00 0.00 H new ATOM 0 HA THR A 81 14.418 5.601 -6.543 1.00 0.00 H new ATOM 0 HB THR A 81 15.377 3.681 -7.742 1.00 0.00 H new ATOM 0 HG1 THR A 81 17.245 2.622 -6.802 1.00 0.00 H new ATOM 0 HG21 THR A 81 17.645 4.569 -8.131 1.00 0.00 H new ATOM 0 HG22 THR A 81 16.435 5.871 -8.041 1.00 0.00 H new ATOM 0 HG23 THR A 81 17.507 5.555 -6.656 1.00 0.00 H new ATOM 1180 N HIS A 82 13.001 3.415 -6.319 1.00 0.00 N ATOM 1181 CA HIS A 82 11.978 2.445 -5.944 1.00 0.00 C ATOM 1182 C HIS A 82 12.533 1.425 -4.955 1.00 0.00 C ATOM 1183 O HIS A 82 11.994 1.247 -3.863 1.00 0.00 O ATOM 1184 CB HIS A 82 11.443 1.731 -7.185 1.00 0.00 C ATOM 1185 CG HIS A 82 10.014 1.300 -7.059 1.00 0.00 C ATOM 1186 ND1 HIS A 82 9.582 0.027 -7.368 1.00 0.00 N ATOM 1187 CD2 HIS A 82 8.917 1.980 -6.653 1.00 0.00 C ATOM 1188 CE1 HIS A 82 8.280 -0.056 -7.159 1.00 0.00 C ATOM 1189 NE2 HIS A 82 7.852 1.115 -6.725 1.00 0.00 N ATOM 0 H HIS A 82 12.934 3.749 -7.280 1.00 0.00 H new ATOM 0 HA HIS A 82 11.161 2.983 -5.463 1.00 0.00 H new ATOM 0 HB2 HIS A 82 11.540 2.394 -8.045 1.00 0.00 H new ATOM 0 HB3 HIS A 82 12.061 0.856 -7.386 1.00 0.00 H new ATOM 0 HD1 HIS A 82 10.175 -0.732 -7.705 1.00 0.00 H new ATOM 0 HD2 HIS A 82 8.885 3.011 -6.332 1.00 0.00 H new ATOM 0 HE1 HIS A 82 7.670 -0.933 -7.316 1.00 0.00 H new ATOM 1198 N GLY A 83 13.614 0.756 -5.345 1.00 0.00 N ATOM 1199 CA GLY A 83 14.223 -0.238 -4.482 1.00 0.00 C ATOM 1200 C GLY A 83 14.505 0.295 -3.091 1.00 0.00 C ATOM 1201 O GLY A 83 14.226 -0.372 -2.096 1.00 0.00 O ATOM 0 H GLY A 83 14.079 0.885 -6.244 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.565 -1.104 -4.409 1.00 0.00 H new ATOM 0 HA3 GLY A 83 15.154 -0.583 -4.931 1.00 0.00 H new ATOM 1205 N GLU A 84 15.062 1.501 -3.023 1.00 0.00 N ATOM 1206 CA GLU A 84 15.384 2.122 -1.744 1.00 0.00 C ATOM 1207 C GLU A 84 14.113 2.501 -0.988 1.00 0.00 C ATOM 1208 O GLU A 84 13.966 2.191 0.194 1.00 0.00 O ATOM 1209 CB GLU A 84 16.252 3.363 -1.959 1.00 0.00 C ATOM 1210 CG GLU A 84 17.742 3.068 -1.976 1.00 0.00 C ATOM 1211 CD GLU A 84 18.328 2.938 -0.583 1.00 0.00 C ATOM 1212 OE1 GLU A 84 18.050 3.815 0.262 1.00 0.00 O ATOM 1213 OE2 GLU A 84 19.064 1.959 -0.339 1.00 0.00 O ATOM 0 H GLU A 84 15.299 2.066 -3.838 1.00 0.00 H new ATOM 0 HA GLU A 84 15.939 1.398 -1.147 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.972 3.833 -2.902 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.042 4.084 -1.169 1.00 0.00 H new ATOM 0 HG2 GLU A 84 17.919 2.145 -2.528 1.00 0.00 H new ATOM 0 HG3 GLU A 84 18.260 3.864 -2.511 1.00 0.00 H new ATOM 1220 N ALA A 85 13.199 3.173 -1.679 1.00 0.00 N ATOM 1221 CA ALA A 85 11.941 3.593 -1.074 1.00 0.00 C ATOM 1222 C ALA A 85 11.203 2.407 -0.463 1.00 0.00 C ATOM 1223 O ALA A 85 10.701 2.486 0.658 1.00 0.00 O ATOM 1224 CB ALA A 85 11.065 4.287 -2.107 1.00 0.00 C ATOM 0 H ALA A 85 13.306 3.438 -2.658 1.00 0.00 H new ATOM 0 HA ALA A 85 12.168 4.297 -0.274 1.00 0.00 H new ATOM 0 HB1 ALA A 85 10.129 4.595 -1.642 1.00 0.00 H new ATOM 0 HB2 ALA A 85 11.584 5.164 -2.494 1.00 0.00 H new ATOM 0 HB3 ALA A 85 10.854 3.599 -2.926 1.00 0.00 H new ATOM 1230 N VAL A 86 11.139 1.308 -1.208 1.00 0.00 N ATOM 1231 CA VAL A 86 10.462 0.105 -0.739 1.00 0.00 C ATOM 1232 C VAL A 86 11.053 -0.379 0.581 1.00 0.00 C ATOM 1233 O VAL A 86 10.346 -0.496 1.582 1.00 0.00 O ATOM 1234 CB VAL A 86 10.553 -1.031 -1.775 1.00 0.00 C ATOM 1235 CG1 VAL A 86 9.902 -2.297 -1.240 1.00 0.00 C ATOM 1236 CG2 VAL A 86 9.911 -0.606 -3.088 1.00 0.00 C ATOM 0 H VAL A 86 11.548 1.226 -2.139 1.00 0.00 H new ATOM 0 HA VAL A 86 9.415 0.369 -0.591 1.00 0.00 H new ATOM 0 HB VAL A 86 11.605 -1.244 -1.962 1.00 0.00 H new ATOM 0 HG11 VAL A 86 9.977 -3.088 -1.986 1.00 0.00 H new ATOM 0 HG12 VAL A 86 10.410 -2.610 -0.328 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.852 -2.102 -1.022 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.984 -1.420 -3.809 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.862 -0.364 -2.919 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.427 0.271 -3.478 1.00 0.00 H new ATOM 1246 N GLN A 87 12.352 -0.658 0.575 1.00 0.00 N ATOM 1247 CA GLN A 87 13.037 -1.130 1.773 1.00 0.00 C ATOM 1248 C GLN A 87 12.770 -0.202 2.953 1.00 0.00 C ATOM 1249 O GLN A 87 12.892 -0.603 4.112 1.00 0.00 O ATOM 1250 CB GLN A 87 14.542 -1.231 1.518 1.00 0.00 C ATOM 1251 CG GLN A 87 14.913 -2.261 0.464 1.00 0.00 C ATOM 1252 CD GLN A 87 14.149 -3.560 0.623 1.00 0.00 C ATOM 1253 OE1 GLN A 87 14.337 -4.289 1.597 1.00 0.00 O ATOM 1254 NE2 GLN A 87 13.280 -3.858 -0.337 1.00 0.00 N ATOM 0 H GLN A 87 12.951 -0.566 -0.245 1.00 0.00 H new ATOM 0 HA GLN A 87 12.650 -2.119 2.018 1.00 0.00 H new ATOM 0 HB2 GLN A 87 14.916 -0.255 1.208 1.00 0.00 H new ATOM 0 HB3 GLN A 87 15.044 -1.482 2.452 1.00 0.00 H new ATOM 0 HG2 GLN A 87 14.718 -1.848 -0.526 1.00 0.00 H new ATOM 0 HG3 GLN A 87 15.982 -2.464 0.520 1.00 0.00 H new ATOM 0 HE21 GLN A 87 13.156 -3.225 -1.127 1.00 0.00 H new ATOM 0 HE22 GLN A 87 12.737 -4.720 -0.284 1.00 0.00 H new ATOM 1263 N LEU A 88 12.406 1.040 2.653 1.00 0.00 N ATOM 1264 CA LEU A 88 12.122 2.026 3.690 1.00 0.00 C ATOM 1265 C LEU A 88 10.725 1.822 4.267 1.00 0.00 C ATOM 1266 O LEU A 88 10.466 2.149 5.426 1.00 0.00 O ATOM 1267 CB LEU A 88 12.252 3.441 3.125 1.00 0.00 C ATOM 1268 CG LEU A 88 12.733 4.513 4.103 1.00 0.00 C ATOM 1269 CD1 LEU A 88 12.853 5.859 3.404 1.00 0.00 C ATOM 1270 CD2 LEU A 88 11.790 4.611 5.293 1.00 0.00 C ATOM 0 H LEU A 88 12.301 1.388 1.700 1.00 0.00 H new ATOM 0 HA LEU A 88 12.849 1.894 4.492 1.00 0.00 H new ATOM 0 HB2 LEU A 88 12.942 3.412 2.281 1.00 0.00 H new ATOM 0 HB3 LEU A 88 11.281 3.745 2.733 1.00 0.00 H new ATOM 0 HG LEU A 88 13.719 4.227 4.469 1.00 0.00 H new ATOM 0 HD11 LEU A 88 13.197 6.609 4.116 1.00 0.00 H new ATOM 0 HD12 LEU A 88 13.568 5.781 2.585 1.00 0.00 H new ATOM 0 HD13 LEU A 88 11.880 6.152 3.009 1.00 0.00 H new ATOM 0 HD21 LEU A 88 12.148 5.379 5.979 1.00 0.00 H new ATOM 0 HD22 LEU A 88 10.791 4.873 4.945 1.00 0.00 H new ATOM 0 HD23 LEU A 88 11.755 3.652 5.809 1.00 0.00 H new ATOM 1282 N LEU A 89 9.828 1.279 3.452 1.00 0.00 N ATOM 1283 CA LEU A 89 8.456 1.029 3.882 1.00 0.00 C ATOM 1284 C LEU A 89 8.353 -0.297 4.629 1.00 0.00 C ATOM 1285 O LEU A 89 7.463 -0.486 5.458 1.00 0.00 O ATOM 1286 CB LEU A 89 7.516 1.022 2.675 1.00 0.00 C ATOM 1287 CG LEU A 89 7.313 -0.330 1.989 1.00 0.00 C ATOM 1288 CD1 LEU A 89 6.149 -1.079 2.620 1.00 0.00 C ATOM 1289 CD2 LEU A 89 7.083 -0.142 0.497 1.00 0.00 C ATOM 0 H LEU A 89 10.025 1.003 2.490 1.00 0.00 H new ATOM 0 HA LEU A 89 8.161 1.830 4.560 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.543 1.394 2.996 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.899 1.727 1.937 1.00 0.00 H new ATOM 0 HG LEU A 89 8.217 -0.924 2.124 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.019 -2.038 2.119 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.354 -1.246 3.677 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.238 -0.490 2.516 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.941 -1.114 0.025 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.195 0.471 0.340 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.948 0.352 0.055 1.00 0.00 H new ATOM 1301 N ARG A 90 9.270 -1.212 4.330 1.00 0.00 N ATOM 1302 CA ARG A 90 9.282 -2.520 4.974 1.00 0.00 C ATOM 1303 C ARG A 90 10.249 -2.535 6.154 1.00 0.00 C ATOM 1304 O ARG A 90 10.414 -3.557 6.821 1.00 0.00 O ATOM 1305 CB ARG A 90 9.672 -3.604 3.967 1.00 0.00 C ATOM 1306 CG ARG A 90 10.935 -3.282 3.185 1.00 0.00 C ATOM 1307 CD ARG A 90 11.354 -4.446 2.301 1.00 0.00 C ATOM 1308 NE ARG A 90 12.104 -5.456 3.044 1.00 0.00 N ATOM 1309 CZ ARG A 90 12.478 -6.621 2.528 1.00 0.00 C ATOM 1310 NH1 ARG A 90 12.173 -6.923 1.273 1.00 0.00 N ATOM 1311 NH2 ARG A 90 13.158 -7.488 3.268 1.00 0.00 N ATOM 0 H ARG A 90 10.014 -1.071 3.646 1.00 0.00 H new ATOM 0 HA ARG A 90 8.278 -2.724 5.346 1.00 0.00 H new ATOM 0 HB2 ARG A 90 9.813 -4.546 4.496 1.00 0.00 H new ATOM 0 HB3 ARG A 90 8.849 -3.751 3.267 1.00 0.00 H new ATOM 0 HG2 ARG A 90 10.768 -2.398 2.570 1.00 0.00 H new ATOM 0 HG3 ARG A 90 11.742 -3.041 3.877 1.00 0.00 H new ATOM 0 HD2 ARG A 90 10.468 -4.904 1.860 1.00 0.00 H new ATOM 0 HD3 ARG A 90 11.964 -4.075 1.478 1.00 0.00 H new ATOM 0 HE ARG A 90 12.354 -5.255 4.012 1.00 0.00 H new ATOM 0 HH11 ARG A 90 11.650 -6.260 0.702 1.00 0.00 H new ATOM 0 HH12 ARG A 90 12.462 -7.819 0.879 1.00 0.00 H new ATOM 0 HH21 ARG A 90 13.394 -7.260 4.234 1.00 0.00 H new ATOM 0 HH22 ARG A 90 13.445 -8.383 2.871 1.00 0.00 H new ATOM 1325 N SER A 91 10.884 -1.396 6.407 1.00 0.00 N ATOM 1326 CA SER A 91 11.838 -1.279 7.504 1.00 0.00 C ATOM 1327 C SER A 91 11.155 -0.755 8.764 1.00 0.00 C ATOM 1328 O SER A 91 11.785 -0.113 9.604 1.00 0.00 O ATOM 1329 CB SER A 91 12.989 -0.352 7.111 1.00 0.00 C ATOM 1330 OG SER A 91 13.868 -0.139 8.202 1.00 0.00 O ATOM 0 H SER A 91 10.755 -0.540 5.867 1.00 0.00 H new ATOM 0 HA SER A 91 12.237 -2.272 7.713 1.00 0.00 H new ATOM 0 HB2 SER A 91 13.539 -0.785 6.276 1.00 0.00 H new ATOM 0 HB3 SER A 91 12.590 0.603 6.769 1.00 0.00 H new ATOM 0 HG SER A 91 13.354 0.153 8.984 1.00 0.00 H new ATOM 1336 N VAL A 92 9.861 -1.033 8.887 1.00 0.00 N ATOM 1337 CA VAL A 92 9.091 -0.591 10.044 1.00 0.00 C ATOM 1338 C VAL A 92 9.067 -1.661 11.130 1.00 0.00 C ATOM 1339 O VAL A 92 9.112 -2.855 10.840 1.00 0.00 O ATOM 1340 CB VAL A 92 7.643 -0.239 9.653 1.00 0.00 C ATOM 1341 CG1 VAL A 92 6.928 0.442 10.810 1.00 0.00 C ATOM 1342 CG2 VAL A 92 7.626 0.642 8.413 1.00 0.00 C ATOM 0 H VAL A 92 9.324 -1.562 8.200 1.00 0.00 H new ATOM 0 HA VAL A 92 9.583 0.302 10.429 1.00 0.00 H new ATOM 0 HB VAL A 92 7.112 -1.163 9.422 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.907 0.683 10.515 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.909 -0.227 11.670 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.455 1.359 11.075 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.595 0.881 8.151 1.00 0.00 H new ATOM 0 HG22 VAL A 92 8.173 1.563 8.614 1.00 0.00 H new ATOM 0 HG23 VAL A 92 8.098 0.114 7.585 1.00 0.00 H new ATOM 1352 N GLY A 93 8.996 -1.223 12.383 1.00 0.00 N ATOM 1353 CA GLY A 93 8.967 -2.156 13.494 1.00 0.00 C ATOM 1354 C GLY A 93 7.559 -2.588 13.852 1.00 0.00 C ATOM 1355 O GLY A 93 7.132 -3.688 13.503 1.00 0.00 O ATOM 0 H GLY A 93 8.958 -0.239 12.649 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.560 -3.035 13.242 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.434 -1.695 14.364 1.00 0.00 H new ATOM 1359 N ASP A 94 6.836 -1.720 14.552 1.00 0.00 N ATOM 1360 CA ASP A 94 5.467 -2.018 14.958 1.00 0.00 C ATOM 1361 C ASP A 94 4.511 -0.928 14.486 1.00 0.00 C ATOM 1362 O ASP A 94 3.297 -1.130 14.434 1.00 0.00 O ATOM 1363 CB ASP A 94 5.384 -2.163 16.478 1.00 0.00 C ATOM 1364 CG ASP A 94 6.489 -3.038 17.038 1.00 0.00 C ATOM 1365 OD1 ASP A 94 7.195 -3.686 16.238 1.00 0.00 O ATOM 1366 OD2 ASP A 94 6.647 -3.073 18.276 1.00 0.00 O ATOM 0 H ASP A 94 7.175 -0.805 14.850 1.00 0.00 H new ATOM 0 HA ASP A 94 5.173 -2.960 14.494 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.438 -1.176 16.938 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.417 -2.588 16.747 1.00 0.00 H new ATOM 1371 N THR A 95 5.065 0.231 14.142 1.00 0.00 N ATOM 1372 CA THR A 95 4.262 1.354 13.677 1.00 0.00 C ATOM 1373 C THR A 95 5.104 2.334 12.866 1.00 0.00 C ATOM 1374 O THR A 95 6.234 2.651 13.238 1.00 0.00 O ATOM 1375 CB THR A 95 3.611 2.106 14.853 1.00 0.00 C ATOM 1376 OG1 THR A 95 3.088 1.170 15.803 1.00 0.00 O ATOM 1377 CG2 THR A 95 2.495 3.016 14.363 1.00 0.00 C ATOM 0 H THR A 95 6.068 0.416 14.177 1.00 0.00 H new ATOM 0 HA THR A 95 3.478 0.940 13.042 1.00 0.00 H new ATOM 0 HB THR A 95 4.375 2.720 15.330 1.00 0.00 H new ATOM 0 HG1 THR A 95 2.750 0.380 15.332 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.051 3.536 15.212 1.00 0.00 H new ATOM 0 HG22 THR A 95 2.902 3.746 13.663 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.732 2.419 13.863 1.00 0.00 H new ATOM 1385 N LEU A 96 4.546 2.810 11.759 1.00 0.00 N ATOM 1386 CA LEU A 96 5.246 3.755 10.895 1.00 0.00 C ATOM 1387 C LEU A 96 4.439 5.038 10.725 1.00 0.00 C ATOM 1388 O LEU A 96 3.230 5.060 10.962 1.00 0.00 O ATOM 1389 CB LEU A 96 5.516 3.123 9.528 1.00 0.00 C ATOM 1390 CG LEU A 96 4.468 3.389 8.447 1.00 0.00 C ATOM 1391 CD1 LEU A 96 5.040 3.104 7.067 1.00 0.00 C ATOM 1392 CD2 LEU A 96 3.223 2.550 8.694 1.00 0.00 C ATOM 0 H LEU A 96 3.611 2.558 11.438 1.00 0.00 H new ATOM 0 HA LEU A 96 6.196 4.006 11.366 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.480 3.483 9.168 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.607 2.045 9.660 1.00 0.00 H new ATOM 0 HG LEU A 96 4.188 4.441 8.491 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.280 3.299 6.311 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.901 3.748 6.890 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.349 2.060 7.010 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.488 2.752 7.915 1.00 0.00 H new ATOM 0 HD22 LEU A 96 3.488 1.493 8.678 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.801 2.803 9.666 1.00 0.00 H new ATOM 1404 N THR A 97 5.114 6.105 10.310 1.00 0.00 N ATOM 1405 CA THR A 97 4.460 7.392 10.107 1.00 0.00 C ATOM 1406 C THR A 97 4.452 7.777 8.632 1.00 0.00 C ATOM 1407 O THR A 97 5.429 8.323 8.118 1.00 0.00 O ATOM 1408 CB THR A 97 5.151 8.507 10.914 1.00 0.00 C ATOM 1409 OG1 THR A 97 5.508 8.022 12.213 1.00 0.00 O ATOM 1410 CG2 THR A 97 4.242 9.718 11.052 1.00 0.00 C ATOM 0 H THR A 97 6.114 6.104 10.108 1.00 0.00 H new ATOM 0 HA THR A 97 3.433 7.284 10.457 1.00 0.00 H new ATOM 0 HB THR A 97 6.052 8.808 10.379 1.00 0.00 H new ATOM 0 HG1 THR A 97 5.948 8.736 12.719 1.00 0.00 H new ATOM 0 HG21 THR A 97 4.752 10.492 11.626 1.00 0.00 H new ATOM 0 HG22 THR A 97 3.996 10.103 10.062 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.326 9.429 11.567 1.00 0.00 H new ATOM 1418 N VAL A 98 3.344 7.492 7.957 1.00 0.00 N ATOM 1419 CA VAL A 98 3.208 7.811 6.540 1.00 0.00 C ATOM 1420 C VAL A 98 2.579 9.185 6.345 1.00 0.00 C ATOM 1421 O VAL A 98 1.542 9.495 6.932 1.00 0.00 O ATOM 1422 CB VAL A 98 2.355 6.759 5.807 1.00 0.00 C ATOM 1423 CG1 VAL A 98 2.763 5.354 6.225 1.00 0.00 C ATOM 1424 CG2 VAL A 98 0.876 6.994 6.073 1.00 0.00 C ATOM 0 H VAL A 98 2.527 7.041 8.368 1.00 0.00 H new ATOM 0 HA VAL A 98 4.213 7.811 6.117 1.00 0.00 H new ATOM 0 HB VAL A 98 2.529 6.858 4.736 1.00 0.00 H new ATOM 0 HG11 VAL A 98 2.149 4.625 5.697 1.00 0.00 H new ATOM 0 HG12 VAL A 98 3.812 5.191 5.979 1.00 0.00 H new ATOM 0 HG13 VAL A 98 2.620 5.238 7.299 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.288 6.242 5.547 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.683 6.923 7.143 1.00 0.00 H new ATOM 0 HG23 VAL A 98 0.596 7.986 5.719 1.00 0.00 H new ATOM 1434 N LEU A 99 3.214 10.007 5.515 1.00 0.00 N ATOM 1435 CA LEU A 99 2.716 11.351 5.241 1.00 0.00 C ATOM 1436 C LEU A 99 1.904 11.377 3.950 1.00 0.00 C ATOM 1437 O LEU A 99 1.672 12.439 3.372 1.00 0.00 O ATOM 1438 CB LEU A 99 3.881 12.337 5.144 1.00 0.00 C ATOM 1439 CG LEU A 99 3.502 13.814 5.031 1.00 0.00 C ATOM 1440 CD1 LEU A 99 2.473 14.184 6.088 1.00 0.00 C ATOM 1441 CD2 LEU A 99 4.738 14.693 5.158 1.00 0.00 C ATOM 0 H LEU A 99 4.073 9.766 5.021 1.00 0.00 H new ATOM 0 HA LEU A 99 2.065 11.647 6.064 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.512 12.211 6.024 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.486 12.070 4.277 1.00 0.00 H new ATOM 0 HG LEU A 99 3.060 13.981 4.049 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.216 15.239 5.992 1.00 0.00 H new ATOM 0 HD12 LEU A 99 1.577 13.578 5.952 1.00 0.00 H new ATOM 0 HD13 LEU A 99 2.888 14.001 7.079 1.00 0.00 H new ATOM 0 HD21 LEU A 99 4.449 15.741 5.075 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.208 14.522 6.126 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.443 14.447 4.364 1.00 0.00 H new ATOM 1453 N VAL A 100 1.473 10.202 3.503 1.00 0.00 N ATOM 1454 CA VAL A 100 0.684 10.090 2.283 1.00 0.00 C ATOM 1455 C VAL A 100 -0.476 11.079 2.286 1.00 0.00 C ATOM 1456 O VAL A 100 -0.671 11.820 3.250 1.00 0.00 O ATOM 1457 CB VAL A 100 0.128 8.665 2.102 1.00 0.00 C ATOM 1458 CG1 VAL A 100 1.264 7.663 1.961 1.00 0.00 C ATOM 1459 CG2 VAL A 100 -0.779 8.295 3.266 1.00 0.00 C ATOM 0 H VAL A 100 1.657 9.313 3.968 1.00 0.00 H new ATOM 0 HA VAL A 100 1.352 10.320 1.453 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.464 8.638 1.187 1.00 0.00 H new ATOM 0 HG11 VAL A 100 0.852 6.662 1.834 1.00 0.00 H new ATOM 0 HG12 VAL A 100 1.869 7.919 1.092 1.00 0.00 H new ATOM 0 HG13 VAL A 100 1.885 7.689 2.856 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.163 7.285 3.121 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.213 8.338 4.196 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.612 8.996 3.315 1.00 0.00 H new ATOM 1469 N CYS A 101 -1.244 11.086 1.202 1.00 0.00 N ATOM 1470 CA CYS A 101 -2.386 11.985 1.079 1.00 0.00 C ATOM 1471 C CYS A 101 -3.265 11.588 -0.102 1.00 0.00 C ATOM 1472 O CYS A 101 -2.831 10.861 -0.996 1.00 0.00 O ATOM 1473 CB CYS A 101 -1.909 13.428 0.914 1.00 0.00 C ATOM 1474 SG CYS A 101 -1.504 13.882 -0.789 1.00 0.00 S ATOM 0 H CYS A 101 -1.097 10.479 0.396 1.00 0.00 H new ATOM 0 HA CYS A 101 -2.978 11.908 1.991 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -2.684 14.100 1.283 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -1.029 13.582 1.539 1.00 0.00 H new ATOM 0 HG CYS A 101 -1.113 15.121 -0.826 1.00 0.00 H new ATOM 1480 N ASP A 102 -4.504 12.069 -0.099 1.00 0.00 N ATOM 1481 CA ASP A 102 -5.445 11.765 -1.170 1.00 0.00 C ATOM 1482 C ASP A 102 -4.923 12.269 -2.512 1.00 0.00 C ATOM 1483 O ASP A 102 -4.993 13.462 -2.808 1.00 0.00 O ATOM 1484 CB ASP A 102 -6.809 12.389 -0.872 1.00 0.00 C ATOM 1485 CG ASP A 102 -6.692 13.768 -0.253 1.00 0.00 C ATOM 1486 OD1 ASP A 102 -5.734 14.493 -0.595 1.00 0.00 O ATOM 1487 OD2 ASP A 102 -7.558 14.122 0.574 1.00 0.00 O ATOM 0 H ASP A 102 -4.879 12.671 0.634 1.00 0.00 H new ATOM 0 HA ASP A 102 -5.555 10.682 -1.227 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -7.384 12.456 -1.795 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.364 11.737 -0.197 1.00 0.00 H new ATOM 1492 N GLY A 103 -4.399 11.353 -3.320 1.00 0.00 N ATOM 1493 CA GLY A 103 -3.872 11.724 -4.620 1.00 0.00 C ATOM 1494 C GLY A 103 -4.905 11.597 -5.723 1.00 0.00 C ATOM 1495 O GLY A 103 -5.237 12.577 -6.389 1.00 0.00 O ATOM 0 H GLY A 103 -4.330 10.360 -3.097 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -3.510 12.751 -4.582 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -3.015 11.093 -4.855 1.00 0.00 H new ATOM 1499 N PHE A 104 -5.413 10.384 -5.918 1.00 0.00 N ATOM 1500 CA PHE A 104 -6.412 10.131 -6.949 1.00 0.00 C ATOM 1501 C PHE A 104 -7.101 8.789 -6.721 1.00 0.00 C ATOM 1502 O PHE A 104 -6.478 7.733 -6.829 1.00 0.00 O ATOM 1503 CB PHE A 104 -5.763 10.154 -8.334 1.00 0.00 C ATOM 1504 CG PHE A 104 -4.338 9.680 -8.337 1.00 0.00 C ATOM 1505 CD1 PHE A 104 -3.308 10.538 -7.985 1.00 0.00 C ATOM 1506 CD2 PHE A 104 -4.028 8.376 -8.689 1.00 0.00 C ATOM 1507 CE1 PHE A 104 -1.995 10.104 -7.987 1.00 0.00 C ATOM 1508 CE2 PHE A 104 -2.717 7.937 -8.692 1.00 0.00 C ATOM 1509 CZ PHE A 104 -1.700 8.802 -8.340 1.00 0.00 C ATOM 0 H PHE A 104 -5.149 9.562 -5.376 1.00 0.00 H new ATOM 0 HA PHE A 104 -7.163 10.919 -6.893 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.347 9.529 -9.010 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -5.800 11.170 -8.727 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.533 11.557 -7.706 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -4.820 7.695 -8.964 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -1.201 10.783 -7.713 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -2.489 6.919 -8.969 1.00 0.00 H new ATOM 0 HZ PHE A 104 -0.675 8.461 -8.341 1.00 0.00 H new ATOM 1519 N GLU A 105 -8.392 8.839 -6.404 1.00 0.00 N ATOM 1520 CA GLU A 105 -9.165 7.628 -6.158 1.00 0.00 C ATOM 1521 C GLU A 105 -9.064 6.669 -7.341 1.00 0.00 C ATOM 1522 O GLU A 105 -8.677 5.511 -7.184 1.00 0.00 O ATOM 1523 CB GLU A 105 -10.631 7.977 -5.895 1.00 0.00 C ATOM 1524 CG GLU A 105 -10.878 8.570 -4.517 1.00 0.00 C ATOM 1525 CD GLU A 105 -12.207 9.294 -4.423 1.00 0.00 C ATOM 1526 OE1 GLU A 105 -12.501 10.113 -5.319 1.00 0.00 O ATOM 1527 OE2 GLU A 105 -12.952 9.042 -3.453 1.00 0.00 O ATOM 0 H GLU A 105 -8.923 9.705 -6.312 1.00 0.00 H new ATOM 0 HA GLU A 105 -8.752 7.137 -5.277 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.969 8.685 -6.652 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.236 7.077 -6.008 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.849 7.774 -3.773 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.073 9.263 -4.274 1.00 0.00 H new ATOM 1534 N SER A 106 -9.416 7.160 -8.525 1.00 0.00 N ATOM 1535 CA SER A 106 -9.370 6.347 -9.734 1.00 0.00 C ATOM 1536 C SER A 106 -10.255 5.112 -9.593 1.00 0.00 C ATOM 1537 O SER A 106 -9.816 3.989 -9.834 1.00 0.00 O ATOM 1538 CB SER A 106 -7.930 5.924 -10.035 1.00 0.00 C ATOM 1539 OG SER A 106 -7.179 7.008 -10.555 1.00 0.00 O ATOM 0 H SER A 106 -9.736 8.117 -8.672 1.00 0.00 H new ATOM 0 HA SER A 106 -9.746 6.949 -10.561 1.00 0.00 H new ATOM 0 HB2 SER A 106 -7.458 5.554 -9.125 1.00 0.00 H new ATOM 0 HB3 SER A 106 -7.931 5.102 -10.750 1.00 0.00 H new ATOM 0 HG SER A 106 -6.262 6.713 -10.738 1.00 0.00 H new ATOM 1545 N GLY A 107 -11.506 5.331 -9.200 1.00 0.00 N ATOM 1546 CA GLY A 107 -12.434 4.228 -9.032 1.00 0.00 C ATOM 1547 C GLY A 107 -13.819 4.550 -9.559 1.00 0.00 C ATOM 1548 O GLY A 107 -13.989 4.962 -10.707 1.00 0.00 O ATOM 0 H GLY A 107 -11.893 6.252 -8.995 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -12.047 3.350 -9.549 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.501 3.972 -7.975 1.00 0.00 H new ATOM 1552 N PRO A 108 -14.838 4.361 -8.709 1.00 0.00 N ATOM 1553 CA PRO A 108 -16.233 4.627 -9.073 1.00 0.00 C ATOM 1554 C PRO A 108 -16.516 6.116 -9.234 1.00 0.00 C ATOM 1555 O PRO A 108 -17.600 6.509 -9.666 1.00 0.00 O ATOM 1556 CB PRO A 108 -17.023 4.057 -7.892 1.00 0.00 C ATOM 1557 CG PRO A 108 -16.076 4.105 -6.744 1.00 0.00 C ATOM 1558 CD PRO A 108 -14.708 3.872 -7.325 1.00 0.00 C ATOM 0 HA PRO A 108 -16.495 4.183 -10.033 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -17.917 4.647 -7.692 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -17.352 3.037 -8.091 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -16.126 5.069 -6.237 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -16.321 3.343 -6.004 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -13.940 4.417 -6.776 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -14.433 2.818 -7.295 1.00 0.00 H new ATOM 1566 N SER A 109 -15.534 6.942 -8.884 1.00 0.00 N ATOM 1567 CA SER A 109 -15.680 8.389 -8.987 1.00 0.00 C ATOM 1568 C SER A 109 -16.123 8.792 -10.390 1.00 0.00 C ATOM 1569 O SER A 109 -16.794 9.808 -10.573 1.00 0.00 O ATOM 1570 CB SER A 109 -14.360 9.081 -8.638 1.00 0.00 C ATOM 1571 OG SER A 109 -13.364 8.796 -9.604 1.00 0.00 O ATOM 0 H SER A 109 -14.630 6.634 -8.527 1.00 0.00 H new ATOM 0 HA SER A 109 -16.446 8.704 -8.279 1.00 0.00 H new ATOM 0 HB2 SER A 109 -14.515 10.158 -8.578 1.00 0.00 H new ATOM 0 HB3 SER A 109 -14.022 8.752 -7.655 1.00 0.00 H new ATOM 0 HG SER A 109 -12.531 9.251 -9.359 1.00 0.00 H new ATOM 1577 N SER A 110 -15.744 7.988 -11.378 1.00 0.00 N ATOM 1578 CA SER A 110 -16.098 8.262 -12.765 1.00 0.00 C ATOM 1579 C SER A 110 -17.592 8.541 -12.899 1.00 0.00 C ATOM 1580 O SER A 110 -17.997 9.558 -13.461 1.00 0.00 O ATOM 1581 CB SER A 110 -15.707 7.082 -13.656 1.00 0.00 C ATOM 1582 OG SER A 110 -14.316 7.088 -13.930 1.00 0.00 O ATOM 0 H SER A 110 -15.192 7.141 -11.243 1.00 0.00 H new ATOM 0 HA SER A 110 -15.550 9.148 -13.086 1.00 0.00 H new ATOM 0 HB2 SER A 110 -15.980 6.147 -13.167 1.00 0.00 H new ATOM 0 HB3 SER A 110 -16.265 7.128 -14.591 1.00 0.00 H new ATOM 0 HG SER A 110 -14.092 6.323 -14.500 1.00 0.00 H new ATOM 1588 N GLY A 111 -18.408 7.629 -12.378 1.00 0.00 N ATOM 1589 CA GLY A 111 -19.848 7.795 -12.450 1.00 0.00 C ATOM 1590 C GLY A 111 -20.450 7.114 -13.663 1.00 0.00 C ATOM 1591 O GLY A 111 -20.171 5.945 -13.929 1.00 0.00 O ATOM 0 H GLY A 111 -18.097 6.779 -11.908 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -20.303 7.390 -11.546 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -20.087 8.858 -12.478 1.00 0.00 H new TER 1595 GLY A 111