USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 525 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 41 THR OG1 : rot 160:sc= 0.786 USER MOD Set 1.2: A 45 SER OG : rot 180:sc= -0.582 USER MOD Set 2.1: A 12 LYS NZ :NH3+ 141:sc= -1.01 (180deg=-1.42) USER MOD Set 2.2: A 14 ASN : amide:sc= -1.58 K(o=-2.6,f=-4.9!) USER MOD Single : A 1 THR N :NH3+ 165:sc= 0.00683 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= -0.738 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 HIS : no HE2:sc= -0.474 K(o=-0.47,f=-1.3) USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 10 LYS NZ :NH3+ -162:sc= -0.0533 (180deg=-0.451) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0867 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 85:sc= 1.23 USER MOD Single : A 21 GLN : amide:sc=0.000481 X(o=0.00048,f=0) USER MOD Single : A 25 ASN : amide:sc= -0.0377 K(o=-0.038,f=-1.6!) USER MOD Single : A 29 HIS : no HD1:sc= -0.0258 X(o=-0.026,f=-0.026) USER MOD Single : A 30 SER OG : rot 150:sc= -0.0306 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.765 K(o=-0.76,f=-5.3!) USER MOD Single : A 33 ASN : amide:sc= -0.0136 X(o=-0.014,f=-0.021) USER MOD Single : A 39 SER OG : rot 62:sc= 1.2 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -0.76 K(o=-0.76,f=-5.4!) USER MOD Single : A 46 ASN : amide:sc= -0.645 K(o=-0.64,f=-5!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 30:sc= -0.19 USER MOD Single : A 50 LYS NZ :NH3+ -154:sc= -0.178 (180deg=-1.13) USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 LYS NZ :NH3+ -165:sc= -0.0134 (180deg=-0.293) USER MOD Single : A 63 ASN : amide:sc= -2.62 K(o=-2.6,f=-9.2!) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -3.523 -3.774 -0.400 1.00 0.00 N ATOM 2 CA THR A 1 -2.089 -3.955 -0.041 1.00 0.00 C ATOM 3 C THR A 1 -1.713 -2.941 1.041 1.00 0.00 C ATOM 4 O THR A 1 -2.405 -1.940 1.229 1.00 0.00 O ATOM 5 CB THR A 1 -1.229 -3.759 -1.299 1.00 0.00 C ATOM 6 OG1 THR A 1 -0.339 -4.857 -1.436 1.00 0.00 O ATOM 7 CG2 THR A 1 -0.424 -2.459 -1.205 1.00 0.00 C ATOM 0 H1 THR A 1 -3.722 -4.269 -1.293 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.122 -4.166 0.354 1.00 0.00 H new ATOM 0 H3 THR A 1 -3.727 -2.761 -0.513 1.00 0.00 H new ATOM 0 HA THR A 1 -1.916 -4.959 0.347 1.00 0.00 H new ATOM 0 HB THR A 1 -1.885 -3.701 -2.167 1.00 0.00 H new ATOM 0 HG1 THR A 1 0.210 -4.735 -2.239 1.00 0.00 H new ATOM 0 HG21 THR A 1 0.179 -2.338 -2.105 1.00 0.00 H new ATOM 0 HG22 THR A 1 -1.107 -1.615 -1.109 1.00 0.00 H new ATOM 0 HG23 THR A 1 0.230 -2.498 -0.334 1.00 0.00 H new ATOM 17 N PRO A 2 -0.640 -3.180 1.750 1.00 0.00 N ATOM 18 CA PRO A 2 -0.174 -2.267 2.835 1.00 0.00 C ATOM 19 C PRO A 2 0.461 -0.993 2.283 1.00 0.00 C ATOM 20 O PRO A 2 0.957 -0.973 1.156 1.00 0.00 O ATOM 21 CB PRO A 2 0.853 -3.107 3.594 1.00 0.00 C ATOM 22 CG PRO A 2 1.379 -4.084 2.596 1.00 0.00 C ATOM 23 CD PRO A 2 0.249 -4.344 1.597 1.00 0.00 C ATOM 0 HA PRO A 2 -0.996 -1.921 3.462 1.00 0.00 H new ATOM 0 HB2 PRO A 2 1.653 -2.484 3.993 1.00 0.00 H new ATOM 0 HB3 PRO A 2 0.395 -3.618 4.441 1.00 0.00 H new ATOM 0 HG2 PRO A 2 2.258 -3.685 2.090 1.00 0.00 H new ATOM 0 HG3 PRO A 2 1.684 -5.009 3.084 1.00 0.00 H new ATOM 0 HD2 PRO A 2 0.628 -4.425 0.578 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -0.272 -5.275 1.818 1.00 0.00 H new ATOM 31 N ILE A 3 0.441 0.067 3.084 1.00 0.00 N ATOM 32 CA ILE A 3 1.017 1.339 2.664 1.00 0.00 C ATOM 33 C ILE A 3 2.436 1.139 2.143 1.00 0.00 C ATOM 34 O ILE A 3 3.224 0.397 2.729 1.00 0.00 O ATOM 35 CB ILE A 3 1.037 2.317 3.840 1.00 0.00 C ATOM 36 CG1 ILE A 3 1.459 3.702 3.344 1.00 0.00 C ATOM 37 CG2 ILE A 3 2.035 1.829 4.892 1.00 0.00 C ATOM 38 CD1 ILE A 3 0.319 4.327 2.537 1.00 0.00 C ATOM 0 H ILE A 3 0.036 0.071 4.020 1.00 0.00 H new ATOM 0 HA ILE A 3 0.402 1.747 1.862 1.00 0.00 H new ATOM 0 HB ILE A 3 0.042 2.375 4.281 1.00 0.00 H new ATOM 0 HG12 ILE A 3 1.712 4.341 4.190 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.354 3.621 2.727 1.00 0.00 H new ATOM 0 HG21 ILE A 3 2.050 2.526 5.730 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.737 0.842 5.246 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.030 1.771 4.451 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.621 5.313 2.184 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.087 3.691 1.682 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.564 4.422 3.169 1.00 0.00 H new ATOM 50 N GLU A 4 2.754 1.805 1.038 1.00 0.00 N ATOM 51 CA GLU A 4 4.082 1.692 0.446 1.00 0.00 C ATOM 52 C GLU A 4 5.141 2.244 1.394 1.00 0.00 C ATOM 53 O GLU A 4 4.841 3.055 2.271 1.00 0.00 O ATOM 54 CB GLU A 4 4.130 2.459 -0.877 1.00 0.00 C ATOM 55 CG GLU A 4 3.885 3.946 -0.615 1.00 0.00 C ATOM 56 CD GLU A 4 3.892 4.716 -1.931 1.00 0.00 C ATOM 57 OE1 GLU A 4 4.028 4.082 -2.965 1.00 0.00 O ATOM 58 OE2 GLU A 4 3.762 5.928 -1.886 1.00 0.00 O ATOM 0 H GLU A 4 2.116 2.424 0.538 1.00 0.00 H new ATOM 0 HA GLU A 4 4.289 0.638 0.263 1.00 0.00 H new ATOM 0 HB2 GLU A 4 5.099 2.318 -1.356 1.00 0.00 H new ATOM 0 HB3 GLU A 4 3.376 2.071 -1.562 1.00 0.00 H new ATOM 0 HG2 GLU A 4 2.929 4.082 -0.110 1.00 0.00 H new ATOM 0 HG3 GLU A 4 4.655 4.338 0.049 1.00 0.00 H new ATOM 65 N SER A 5 6.380 1.799 1.213 1.00 0.00 N ATOM 66 CA SER A 5 7.477 2.255 2.059 1.00 0.00 C ATOM 67 C SER A 5 7.824 3.707 1.748 1.00 0.00 C ATOM 68 O SER A 5 7.421 4.245 0.717 1.00 0.00 O ATOM 69 CB SER A 5 8.707 1.376 1.836 1.00 0.00 C ATOM 70 OG SER A 5 9.227 1.616 0.535 1.00 0.00 O ATOM 0 H SER A 5 6.649 1.128 0.493 1.00 0.00 H new ATOM 0 HA SER A 5 7.163 2.183 3.100 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.465 1.593 2.589 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.441 0.325 1.946 1.00 0.00 H new ATOM 0 HG SER A 5 10.017 1.055 0.390 1.00 0.00 H new ATOM 76 N HIS A 6 8.575 4.336 2.647 1.00 0.00 N ATOM 77 CA HIS A 6 8.972 5.727 2.457 1.00 0.00 C ATOM 78 C HIS A 6 10.293 5.816 1.694 1.00 0.00 C ATOM 79 O HIS A 6 10.981 6.835 1.748 1.00 0.00 O ATOM 80 CB HIS A 6 9.120 6.415 3.816 1.00 0.00 C ATOM 81 CG HIS A 6 10.177 5.712 4.622 1.00 0.00 C ATOM 82 ND1 HIS A 6 11.526 6.004 4.488 1.00 0.00 N ATOM 83 CD2 HIS A 6 10.101 4.726 5.574 1.00 0.00 C ATOM 84 CE1 HIS A 6 12.200 5.209 5.338 1.00 0.00 C ATOM 85 NE2 HIS A 6 11.379 4.410 6.025 1.00 0.00 N ATOM 0 H HIS A 6 8.918 3.909 3.507 1.00 0.00 H new ATOM 0 HA HIS A 6 8.198 6.227 1.874 1.00 0.00 H new ATOM 0 HB2 HIS A 6 9.389 7.462 3.678 1.00 0.00 H new ATOM 0 HB3 HIS A 6 8.170 6.398 4.349 1.00 0.00 H new ATOM 0 HD1 HIS A 6 11.933 6.696 3.859 1.00 0.00 H new ATOM 0 HD2 HIS A 6 9.188 4.265 5.921 1.00 0.00 H new ATOM 0 HE1 HIS A 6 13.274 5.216 5.451 1.00 0.00 H new ATOM 94 N GLN A 7 10.642 4.746 0.984 1.00 0.00 N ATOM 95 CA GLN A 7 11.882 4.723 0.216 1.00 0.00 C ATOM 96 C GLN A 7 11.856 5.786 -0.876 1.00 0.00 C ATOM 97 O GLN A 7 10.858 5.942 -1.580 1.00 0.00 O ATOM 98 CB GLN A 7 12.078 3.343 -0.415 1.00 0.00 C ATOM 99 CG GLN A 7 13.386 3.322 -1.208 1.00 0.00 C ATOM 100 CD GLN A 7 13.599 1.943 -1.825 1.00 0.00 C ATOM 101 OE1 GLN A 7 12.705 1.412 -2.484 1.00 0.00 O ATOM 102 NE2 GLN A 7 14.737 1.329 -1.650 1.00 0.00 N ATOM 0 H GLN A 7 10.089 3.891 0.925 1.00 0.00 H new ATOM 0 HA GLN A 7 12.711 4.935 0.892 1.00 0.00 H new ATOM 0 HB2 GLN A 7 12.099 2.577 0.360 1.00 0.00 H new ATOM 0 HB3 GLN A 7 11.239 3.110 -1.071 1.00 0.00 H new ATOM 0 HG2 GLN A 7 13.358 4.080 -1.991 1.00 0.00 H new ATOM 0 HG3 GLN A 7 14.222 3.570 -0.554 1.00 0.00 H new ATOM 0 HE21 GLN A 7 15.476 1.771 -1.104 1.00 0.00 H new ATOM 0 HE22 GLN A 7 14.887 0.407 -2.060 1.00 0.00 H new ATOM 111 N VAL A 8 12.959 6.515 -1.013 1.00 0.00 N ATOM 112 CA VAL A 8 13.051 7.561 -2.023 1.00 0.00 C ATOM 113 C VAL A 8 12.667 7.014 -3.394 1.00 0.00 C ATOM 114 O VAL A 8 13.086 5.922 -3.777 1.00 0.00 O ATOM 115 CB VAL A 8 14.474 8.117 -2.072 1.00 0.00 C ATOM 116 CG1 VAL A 8 15.436 7.021 -2.534 1.00 0.00 C ATOM 117 CG2 VAL A 8 14.530 9.290 -3.053 1.00 0.00 C ATOM 0 H VAL A 8 13.796 6.401 -0.441 1.00 0.00 H new ATOM 0 HA VAL A 8 12.360 8.361 -1.756 1.00 0.00 H new ATOM 0 HB VAL A 8 14.764 8.459 -1.078 1.00 0.00 H new ATOM 0 HG11 VAL A 8 16.450 7.418 -2.569 1.00 0.00 H new ATOM 0 HG12 VAL A 8 15.397 6.185 -1.836 1.00 0.00 H new ATOM 0 HG13 VAL A 8 15.147 6.678 -3.527 1.00 0.00 H new ATOM 0 HG21 VAL A 8 15.545 9.687 -3.088 1.00 0.00 H new ATOM 0 HG22 VAL A 8 14.240 8.948 -4.046 1.00 0.00 H new ATOM 0 HG23 VAL A 8 13.846 10.072 -2.724 1.00 0.00 H new ATOM 127 N GLU A 9 11.867 7.780 -4.128 1.00 0.00 N ATOM 128 CA GLU A 9 11.431 7.361 -5.455 1.00 0.00 C ATOM 129 C GLU A 9 11.274 8.568 -6.375 1.00 0.00 C ATOM 130 O GLU A 9 11.231 9.709 -5.915 1.00 0.00 O ATOM 131 CB GLU A 9 10.099 6.611 -5.358 1.00 0.00 C ATOM 132 CG GLU A 9 9.023 7.538 -4.784 1.00 0.00 C ATOM 133 CD GLU A 9 8.356 8.326 -5.907 1.00 0.00 C ATOM 134 OE1 GLU A 9 8.129 7.747 -6.957 1.00 0.00 O ATOM 135 OE2 GLU A 9 8.082 9.497 -5.701 1.00 0.00 O ATOM 0 H GLU A 9 11.510 8.688 -3.830 1.00 0.00 H new ATOM 0 HA GLU A 9 12.189 6.698 -5.872 1.00 0.00 H new ATOM 0 HB2 GLU A 9 9.798 6.256 -6.344 1.00 0.00 H new ATOM 0 HB3 GLU A 9 10.211 5.732 -4.723 1.00 0.00 H new ATOM 0 HG2 GLU A 9 8.277 6.953 -4.247 1.00 0.00 H new ATOM 0 HG3 GLU A 9 9.469 8.224 -4.064 1.00 0.00 H new ATOM 142 N LYS A 10 11.191 8.307 -7.675 1.00 0.00 N ATOM 143 CA LYS A 10 11.039 9.379 -8.651 1.00 0.00 C ATOM 144 C LYS A 10 10.040 8.984 -9.732 1.00 0.00 C ATOM 145 O LYS A 10 9.750 7.803 -9.922 1.00 0.00 O ATOM 146 CB LYS A 10 12.390 9.695 -9.295 1.00 0.00 C ATOM 147 CG LYS A 10 12.905 8.460 -10.036 1.00 0.00 C ATOM 148 CD LYS A 10 14.237 8.789 -10.710 1.00 0.00 C ATOM 149 CE LYS A 10 14.737 7.564 -11.477 1.00 0.00 C ATOM 150 NZ LYS A 10 15.027 6.461 -10.516 1.00 0.00 N ATOM 0 H LYS A 10 11.226 7.369 -8.075 1.00 0.00 H new ATOM 0 HA LYS A 10 10.666 10.263 -8.134 1.00 0.00 H new ATOM 0 HB2 LYS A 10 12.288 10.531 -9.987 1.00 0.00 H new ATOM 0 HB3 LYS A 10 13.106 9.999 -8.532 1.00 0.00 H new ATOM 0 HG2 LYS A 10 13.033 7.632 -9.339 1.00 0.00 H new ATOM 0 HG3 LYS A 10 12.177 8.140 -10.782 1.00 0.00 H new ATOM 0 HD2 LYS A 10 14.114 9.632 -11.390 1.00 0.00 H new ATOM 0 HD3 LYS A 10 14.971 9.088 -9.962 1.00 0.00 H new ATOM 0 HE2 LYS A 10 13.987 7.243 -12.200 1.00 0.00 H new ATOM 0 HE3 LYS A 10 15.636 7.816 -12.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 15.639 5.755 -10.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 15.509 6.847 -9.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 14.136 6.011 -10.225 1.00 0.00 H new ATOM 164 N ARG A 11 9.519 9.981 -10.439 1.00 0.00 N ATOM 165 CA ARG A 11 8.554 9.729 -11.503 1.00 0.00 C ATOM 166 C ARG A 11 8.737 10.731 -12.640 1.00 0.00 C ATOM 167 O ARG A 11 7.845 11.527 -12.933 1.00 0.00 O ATOM 168 CB ARG A 11 7.104 9.788 -10.975 1.00 0.00 C ATOM 169 CG ARG A 11 6.959 10.758 -9.785 1.00 0.00 C ATOM 170 CD ARG A 11 6.994 12.207 -10.278 1.00 0.00 C ATOM 171 NE ARG A 11 8.371 12.673 -10.403 1.00 0.00 N ATOM 172 CZ ARG A 11 9.075 13.078 -9.343 1.00 0.00 C ATOM 173 NH1 ARG A 11 8.549 13.066 -8.144 1.00 0.00 N ATOM 174 NH2 ARG A 11 10.304 13.488 -9.503 1.00 0.00 N ATOM 0 H ARG A 11 9.747 10.965 -10.296 1.00 0.00 H new ATOM 0 HA ARG A 11 8.736 8.723 -11.882 1.00 0.00 H new ATOM 0 HB2 ARG A 11 6.438 10.100 -11.780 1.00 0.00 H new ATOM 0 HB3 ARG A 11 6.789 8.790 -10.669 1.00 0.00 H new ATOM 0 HG2 ARG A 11 6.022 10.566 -9.262 1.00 0.00 H new ATOM 0 HG3 ARG A 11 7.764 10.590 -9.069 1.00 0.00 H new ATOM 0 HD2 ARG A 11 6.490 12.281 -11.242 1.00 0.00 H new ATOM 0 HD3 ARG A 11 6.449 12.847 -9.583 1.00 0.00 H new ATOM 0 HE ARG A 11 8.808 12.690 -11.325 1.00 0.00 H new ATOM 0 HH11 ARG A 11 7.590 12.745 -8.011 1.00 0.00 H new ATOM 0 HH12 ARG A 11 9.098 13.378 -7.343 1.00 0.00 H new ATOM 0 HH21 ARG A 11 10.721 13.498 -10.434 1.00 0.00 H new ATOM 0 HH22 ARG A 11 10.847 13.799 -8.697 1.00 0.00 H new ATOM 188 N LYS A 12 9.900 10.685 -13.282 1.00 0.00 N ATOM 189 CA LYS A 12 10.187 11.593 -14.386 1.00 0.00 C ATOM 190 C LYS A 12 9.074 11.539 -15.428 1.00 0.00 C ATOM 191 O LYS A 12 8.435 10.504 -15.617 1.00 0.00 O ATOM 192 CB LYS A 12 11.522 11.223 -15.037 1.00 0.00 C ATOM 193 CG LYS A 12 11.455 9.792 -15.574 1.00 0.00 C ATOM 194 CD LYS A 12 12.799 9.423 -16.207 1.00 0.00 C ATOM 195 CE LYS A 12 12.796 7.942 -16.590 1.00 0.00 C ATOM 196 NZ LYS A 12 11.749 7.697 -17.621 1.00 0.00 N ATOM 0 H LYS A 12 10.653 10.034 -13.059 1.00 0.00 H new ATOM 0 HA LYS A 12 10.248 12.607 -13.990 1.00 0.00 H new ATOM 0 HB2 LYS A 12 11.746 11.916 -15.848 1.00 0.00 H new ATOM 0 HB3 LYS A 12 12.329 11.311 -14.310 1.00 0.00 H new ATOM 0 HG2 LYS A 12 11.219 9.099 -14.766 1.00 0.00 H new ATOM 0 HG3 LYS A 12 10.657 9.706 -16.312 1.00 0.00 H new ATOM 0 HD2 LYS A 12 12.978 10.037 -17.090 1.00 0.00 H new ATOM 0 HD3 LYS A 12 13.610 9.627 -15.508 1.00 0.00 H new ATOM 0 HE2 LYS A 12 13.774 7.653 -16.974 1.00 0.00 H new ATOM 0 HE3 LYS A 12 12.605 7.328 -15.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 12.105 7.016 -18.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 10.897 7.312 -17.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 11.513 8.592 -18.096 1.00 0.00 H new ATOM 210 N CYS A 13 8.845 12.664 -16.099 1.00 0.00 N ATOM 211 CA CYS A 13 7.803 12.739 -17.117 1.00 0.00 C ATOM 212 C CYS A 13 8.164 11.876 -18.323 1.00 0.00 C ATOM 213 O CYS A 13 8.805 12.342 -19.266 1.00 0.00 O ATOM 214 CB CYS A 13 7.608 14.191 -17.560 1.00 0.00 C ATOM 215 SG CYS A 13 5.952 14.749 -17.089 1.00 0.00 S ATOM 0 H CYS A 13 9.363 13.531 -15.957 1.00 0.00 H new ATOM 0 HA CYS A 13 6.874 12.365 -16.686 1.00 0.00 H new ATOM 0 HB2 CYS A 13 8.363 14.828 -17.098 1.00 0.00 H new ATOM 0 HB3 CYS A 13 7.738 14.274 -18.639 1.00 0.00 H new ATOM 220 N ASN A 14 7.747 10.615 -18.287 1.00 0.00 N ATOM 221 CA ASN A 14 8.031 9.697 -19.384 1.00 0.00 C ATOM 222 C ASN A 14 6.751 9.348 -20.142 1.00 0.00 C ATOM 223 O ASN A 14 6.783 9.113 -21.350 1.00 0.00 O ATOM 224 CB ASN A 14 8.676 8.418 -18.845 1.00 0.00 C ATOM 225 CG ASN A 14 7.852 7.863 -17.687 1.00 0.00 C ATOM 226 OD1 ASN A 14 6.710 7.445 -17.880 1.00 0.00 O ATOM 227 ND2 ASN A 14 8.366 7.834 -16.488 1.00 0.00 N ATOM 0 H ASN A 14 7.216 10.208 -17.517 1.00 0.00 H new ATOM 0 HA ASN A 14 8.721 10.188 -20.071 1.00 0.00 H new ATOM 0 HB2 ASN A 14 8.748 7.675 -19.639 1.00 0.00 H new ATOM 0 HB3 ASN A 14 9.692 8.627 -18.511 1.00 0.00 H new ATOM 0 HD21 ASN A 14 7.822 7.465 -15.709 1.00 0.00 H new ATOM 0 HD22 ASN A 14 9.312 8.181 -16.330 1.00 0.00 H new ATOM 234 N THR A 15 5.629 9.307 -19.425 1.00 0.00 N ATOM 235 CA THR A 15 4.348 8.978 -20.042 1.00 0.00 C ATOM 236 C THR A 15 4.138 9.786 -21.319 1.00 0.00 C ATOM 237 O THR A 15 4.559 10.938 -21.415 1.00 0.00 O ATOM 238 CB THR A 15 3.203 9.260 -19.061 1.00 0.00 C ATOM 239 OG1 THR A 15 1.961 9.136 -19.740 1.00 0.00 O ATOM 240 CG2 THR A 15 3.335 10.677 -18.490 1.00 0.00 C ATOM 0 H THR A 15 5.582 9.496 -18.424 1.00 0.00 H new ATOM 0 HA THR A 15 4.355 7.918 -20.296 1.00 0.00 H new ATOM 0 HB THR A 15 3.249 8.542 -18.242 1.00 0.00 H new ATOM 0 HG1 THR A 15 1.227 9.314 -19.115 1.00 0.00 H new ATOM 0 HG21 THR A 15 2.517 10.867 -17.795 1.00 0.00 H new ATOM 0 HG22 THR A 15 4.286 10.771 -17.966 1.00 0.00 H new ATOM 0 HG23 THR A 15 3.296 11.402 -19.303 1.00 0.00 H new ATOM 248 N ALA A 16 3.490 9.166 -22.300 1.00 0.00 N ATOM 249 CA ALA A 16 3.233 9.824 -23.577 1.00 0.00 C ATOM 250 C ALA A 16 2.290 11.012 -23.406 1.00 0.00 C ATOM 251 O ALA A 16 2.264 11.916 -24.242 1.00 0.00 O ATOM 252 CB ALA A 16 2.618 8.825 -24.559 1.00 0.00 C ATOM 0 H ALA A 16 3.134 8.212 -22.236 1.00 0.00 H new ATOM 0 HA ALA A 16 4.183 10.191 -23.966 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.428 9.321 -25.511 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.308 7.995 -24.713 1.00 0.00 H new ATOM 0 HB3 ALA A 16 1.680 8.447 -24.153 1.00 0.00 H new ATOM 258 N THR A 17 1.517 11.009 -22.325 1.00 0.00 N ATOM 259 CA THR A 17 0.578 12.097 -22.069 1.00 0.00 C ATOM 260 C THR A 17 1.321 13.373 -21.685 1.00 0.00 C ATOM 261 O THR A 17 0.967 14.467 -22.126 1.00 0.00 O ATOM 262 CB THR A 17 -0.383 11.705 -20.944 1.00 0.00 C ATOM 263 OG1 THR A 17 -1.100 10.538 -21.322 1.00 0.00 O ATOM 264 CG2 THR A 17 -1.365 12.849 -20.688 1.00 0.00 C ATOM 0 H THR A 17 1.521 10.274 -21.618 1.00 0.00 H new ATOM 0 HA THR A 17 0.013 12.283 -22.982 1.00 0.00 H new ATOM 0 HB THR A 17 0.183 11.505 -20.034 1.00 0.00 H new ATOM 0 HG1 THR A 17 -1.715 10.284 -20.602 1.00 0.00 H new ATOM 0 HG21 THR A 17 -2.049 12.569 -19.887 1.00 0.00 H new ATOM 0 HG22 THR A 17 -0.814 13.744 -20.399 1.00 0.00 H new ATOM 0 HG23 THR A 17 -1.933 13.051 -21.596 1.00 0.00 H new ATOM 272 N CYS A 18 2.350 13.227 -20.857 1.00 0.00 N ATOM 273 CA CYS A 18 3.133 14.375 -20.415 1.00 0.00 C ATOM 274 C CYS A 18 3.808 15.058 -21.600 1.00 0.00 C ATOM 275 O CYS A 18 3.756 16.280 -21.737 1.00 0.00 O ATOM 276 CB CYS A 18 4.195 13.924 -19.410 1.00 0.00 C ATOM 277 SG CYS A 18 5.124 15.364 -18.826 1.00 0.00 S ATOM 0 H CYS A 18 2.660 12.331 -20.480 1.00 0.00 H new ATOM 0 HA CYS A 18 2.459 15.088 -19.939 1.00 0.00 H new ATOM 0 HB2 CYS A 18 3.723 13.417 -18.569 1.00 0.00 H new ATOM 0 HB3 CYS A 18 4.871 13.207 -19.876 1.00 0.00 H new ATOM 282 N ALA A 19 4.446 14.263 -22.452 1.00 0.00 N ATOM 283 CA ALA A 19 5.133 14.805 -23.619 1.00 0.00 C ATOM 284 C ALA A 19 4.148 15.494 -24.560 1.00 0.00 C ATOM 285 O ALA A 19 4.476 16.502 -25.184 1.00 0.00 O ATOM 286 CB ALA A 19 5.858 13.685 -24.366 1.00 0.00 C ATOM 0 H ALA A 19 4.502 13.249 -22.358 1.00 0.00 H new ATOM 0 HA ALA A 19 5.858 15.542 -23.275 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.368 14.099 -25.236 1.00 0.00 H new ATOM 0 HB2 ALA A 19 6.588 13.220 -23.704 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.135 12.937 -24.691 1.00 0.00 H new ATOM 292 N THR A 20 2.946 14.939 -24.666 1.00 0.00 N ATOM 293 CA THR A 20 1.926 15.503 -25.545 1.00 0.00 C ATOM 294 C THR A 20 1.767 17.005 -25.321 1.00 0.00 C ATOM 295 O THR A 20 1.690 17.777 -26.277 1.00 0.00 O ATOM 296 CB THR A 20 0.584 14.810 -25.295 1.00 0.00 C ATOM 297 OG1 THR A 20 0.718 13.418 -25.545 1.00 0.00 O ATOM 298 CG2 THR A 20 -0.478 15.396 -26.227 1.00 0.00 C ATOM 0 H THR A 20 2.654 14.104 -24.158 1.00 0.00 H new ATOM 0 HA THR A 20 2.244 15.340 -26.575 1.00 0.00 H new ATOM 0 HB THR A 20 0.282 14.967 -24.260 1.00 0.00 H new ATOM 0 HG1 THR A 20 1.058 12.973 -24.741 1.00 0.00 H new ATOM 0 HG21 THR A 20 -1.433 14.901 -26.047 1.00 0.00 H new ATOM 0 HG22 THR A 20 -0.581 16.464 -26.035 1.00 0.00 H new ATOM 0 HG23 THR A 20 -0.178 15.241 -27.263 1.00 0.00 H new ATOM 306 N GLN A 21 1.703 17.414 -24.058 1.00 0.00 N ATOM 307 CA GLN A 21 1.536 18.828 -23.736 1.00 0.00 C ATOM 308 C GLN A 21 2.790 19.627 -24.085 1.00 0.00 C ATOM 309 O GLN A 21 2.711 20.822 -24.371 1.00 0.00 O ATOM 310 CB GLN A 21 1.212 18.993 -22.246 1.00 0.00 C ATOM 311 CG GLN A 21 2.500 19.234 -21.454 1.00 0.00 C ATOM 312 CD GLN A 21 2.233 19.061 -19.963 1.00 0.00 C ATOM 313 OE1 GLN A 21 1.386 19.754 -19.398 1.00 0.00 O ATOM 314 NE2 GLN A 21 2.909 18.172 -19.287 1.00 0.00 N ATOM 0 H GLN A 21 1.763 16.796 -23.249 1.00 0.00 H new ATOM 0 HA GLN A 21 0.709 19.214 -24.332 1.00 0.00 H new ATOM 0 HB2 GLN A 21 0.527 19.829 -22.105 1.00 0.00 H new ATOM 0 HB3 GLN A 21 0.708 18.101 -21.874 1.00 0.00 H new ATOM 0 HG2 GLN A 21 3.272 18.536 -21.777 1.00 0.00 H new ATOM 0 HG3 GLN A 21 2.876 20.238 -21.651 1.00 0.00 H new ATOM 0 HE21 GLN A 21 3.610 17.599 -19.757 1.00 0.00 H new ATOM 0 HE22 GLN A 21 2.736 18.050 -18.289 1.00 0.00 H new ATOM 323 N ARG A 22 3.945 18.969 -24.055 1.00 0.00 N ATOM 324 CA ARG A 22 5.200 19.647 -24.366 1.00 0.00 C ATOM 325 C ARG A 22 5.324 19.893 -25.869 1.00 0.00 C ATOM 326 O ARG A 22 5.572 21.018 -26.304 1.00 0.00 O ATOM 327 CB ARG A 22 6.384 18.806 -23.873 1.00 0.00 C ATOM 328 CG ARG A 22 7.708 19.451 -24.301 1.00 0.00 C ATOM 329 CD ARG A 22 7.807 20.864 -23.721 1.00 0.00 C ATOM 330 NE ARG A 22 7.565 20.837 -22.282 1.00 0.00 N ATOM 331 CZ ARG A 22 8.509 20.463 -21.416 1.00 0.00 C ATOM 332 NH1 ARG A 22 9.696 20.101 -21.834 1.00 0.00 N ATOM 333 NH2 ARG A 22 8.247 20.457 -20.138 1.00 0.00 N ATOM 0 H ARG A 22 4.039 17.980 -23.822 1.00 0.00 H new ATOM 0 HA ARG A 22 5.207 20.611 -23.858 1.00 0.00 H new ATOM 0 HB2 ARG A 22 6.349 18.717 -22.787 1.00 0.00 H new ATOM 0 HB3 ARG A 22 6.316 17.796 -24.278 1.00 0.00 H new ATOM 0 HG2 ARG A 22 8.546 18.846 -23.955 1.00 0.00 H new ATOM 0 HG3 ARG A 22 7.770 19.489 -25.389 1.00 0.00 H new ATOM 0 HD2 ARG A 22 8.794 21.279 -23.923 1.00 0.00 H new ATOM 0 HD3 ARG A 22 7.081 21.516 -24.207 1.00 0.00 H new ATOM 0 HE ARG A 22 6.649 21.112 -21.928 1.00 0.00 H new ATOM 0 HH11 ARG A 22 9.908 20.103 -22.832 1.00 0.00 H new ATOM 0 HH12 ARG A 22 10.409 19.817 -21.162 1.00 0.00 H new ATOM 0 HH21 ARG A 22 7.324 20.737 -19.805 1.00 0.00 H new ATOM 0 HH22 ARG A 22 8.965 20.172 -19.472 1.00 0.00 H new ATOM 347 N LEU A 23 5.155 18.836 -26.656 1.00 0.00 N ATOM 348 CA LEU A 23 5.258 18.957 -28.105 1.00 0.00 C ATOM 349 C LEU A 23 4.089 19.764 -28.662 1.00 0.00 C ATOM 350 O LEU A 23 4.240 20.494 -29.642 1.00 0.00 O ATOM 351 CB LEU A 23 5.296 17.571 -28.758 1.00 0.00 C ATOM 352 CG LEU A 23 4.015 16.800 -28.432 1.00 0.00 C ATOM 353 CD1 LEU A 23 3.055 16.873 -29.623 1.00 0.00 C ATOM 354 CD2 LEU A 23 4.363 15.335 -28.149 1.00 0.00 C ATOM 0 H LEU A 23 4.948 17.896 -26.320 1.00 0.00 H new ATOM 0 HA LEU A 23 6.185 19.481 -28.337 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.404 17.672 -29.838 1.00 0.00 H new ATOM 0 HB3 LEU A 23 6.164 17.016 -28.402 1.00 0.00 H new ATOM 0 HG LEU A 23 3.539 17.240 -27.556 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.143 16.323 -29.389 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.808 17.915 -29.828 1.00 0.00 H new ATOM 0 HD13 LEU A 23 3.529 16.433 -30.500 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.452 14.783 -27.916 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.838 14.898 -29.027 1.00 0.00 H new ATOM 0 HD23 LEU A 23 5.047 15.281 -27.302 1.00 0.00 H new ATOM 366 N ALA A 24 2.924 19.628 -28.037 1.00 0.00 N ATOM 367 CA ALA A 24 1.741 20.350 -28.489 1.00 0.00 C ATOM 368 C ALA A 24 1.991 21.855 -28.481 1.00 0.00 C ATOM 369 O ALA A 24 1.669 22.550 -29.444 1.00 0.00 O ATOM 370 CB ALA A 24 0.552 20.024 -27.583 1.00 0.00 C ATOM 0 H ALA A 24 2.774 19.031 -27.224 1.00 0.00 H new ATOM 0 HA ALA A 24 1.518 20.037 -29.509 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -0.328 20.567 -27.928 1.00 0.00 H new ATOM 0 HB2 ALA A 24 0.353 18.953 -27.616 1.00 0.00 H new ATOM 0 HB3 ALA A 24 0.783 20.319 -26.559 1.00 0.00 H new ATOM 376 N ASN A 25 2.563 22.354 -27.390 1.00 0.00 N ATOM 377 CA ASN A 25 2.845 23.780 -27.277 1.00 0.00 C ATOM 378 C ASN A 25 3.867 24.213 -28.323 1.00 0.00 C ATOM 379 O ASN A 25 3.752 25.288 -28.911 1.00 0.00 O ATOM 380 CB ASN A 25 3.381 24.096 -25.880 1.00 0.00 C ATOM 381 CG ASN A 25 2.227 24.189 -24.887 1.00 0.00 C ATOM 382 OD1 ASN A 25 1.088 23.872 -25.227 1.00 0.00 O ATOM 383 ND2 ASN A 25 2.456 24.612 -23.674 1.00 0.00 N ATOM 0 H ASN A 25 2.838 21.799 -26.580 1.00 0.00 H new ATOM 0 HA ASN A 25 1.917 24.327 -27.445 1.00 0.00 H new ATOM 0 HB2 ASN A 25 4.080 23.321 -25.566 1.00 0.00 H new ATOM 0 HB3 ASN A 25 3.933 25.036 -25.897 1.00 0.00 H new ATOM 0 HD21 ASN A 25 1.689 24.681 -23.005 1.00 0.00 H new ATOM 0 HD22 ASN A 25 3.402 24.874 -23.395 1.00 0.00 H new ATOM 390 N PHE A 26 4.869 23.369 -28.545 1.00 0.00 N ATOM 391 CA PHE A 26 5.912 23.673 -29.518 1.00 0.00 C ATOM 392 C PHE A 26 5.325 23.792 -30.921 1.00 0.00 C ATOM 393 O PHE A 26 5.824 24.552 -31.749 1.00 0.00 O ATOM 394 CB PHE A 26 6.979 22.577 -29.499 1.00 0.00 C ATOM 395 CG PHE A 26 8.111 22.958 -30.423 1.00 0.00 C ATOM 396 CD1 PHE A 26 9.072 23.887 -30.006 1.00 0.00 C ATOM 397 CD2 PHE A 26 8.199 22.383 -31.696 1.00 0.00 C ATOM 398 CE1 PHE A 26 10.122 24.240 -30.862 1.00 0.00 C ATOM 399 CE2 PHE A 26 9.248 22.737 -32.553 1.00 0.00 C ATOM 400 CZ PHE A 26 10.210 23.665 -32.136 1.00 0.00 C ATOM 0 H PHE A 26 4.981 22.475 -28.068 1.00 0.00 H new ATOM 0 HA PHE A 26 6.365 24.627 -29.248 1.00 0.00 H new ATOM 0 HB2 PHE A 26 7.354 22.438 -28.485 1.00 0.00 H new ATOM 0 HB3 PHE A 26 6.545 21.627 -29.811 1.00 0.00 H new ATOM 0 HD1 PHE A 26 9.003 24.331 -29.024 1.00 0.00 H new ATOM 0 HD2 PHE A 26 7.458 21.666 -32.017 1.00 0.00 H new ATOM 0 HE1 PHE A 26 10.864 24.956 -30.540 1.00 0.00 H new ATOM 0 HE2 PHE A 26 9.315 22.294 -33.536 1.00 0.00 H new ATOM 0 HZ PHE A 26 11.020 23.937 -32.797 1.00 0.00 H new ATOM 410 N LEU A 27 4.268 23.031 -31.183 1.00 0.00 N ATOM 411 CA LEU A 27 3.624 23.056 -32.491 1.00 0.00 C ATOM 412 C LEU A 27 3.025 24.436 -32.760 1.00 0.00 C ATOM 413 O LEU A 27 3.413 25.121 -33.707 1.00 0.00 O ATOM 414 CB LEU A 27 2.526 21.973 -32.529 1.00 0.00 C ATOM 415 CG LEU A 27 1.725 21.984 -33.851 1.00 0.00 C ATOM 416 CD1 LEU A 27 0.550 22.973 -33.762 1.00 0.00 C ATOM 417 CD2 LEU A 27 2.627 22.349 -35.039 1.00 0.00 C ATOM 0 H LEU A 27 3.841 22.393 -30.512 1.00 0.00 H new ATOM 0 HA LEU A 27 4.362 22.851 -33.267 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.983 20.993 -32.394 1.00 0.00 H new ATOM 0 HB3 LEU A 27 1.843 22.124 -31.693 1.00 0.00 H new ATOM 0 HG LEU A 27 1.332 20.980 -34.011 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.002 22.967 -34.702 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.113 22.678 -32.949 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.932 23.976 -33.572 1.00 0.00 H new ATOM 0 HD21 LEU A 27 2.038 22.349 -35.956 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.053 23.340 -34.881 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.431 21.617 -35.124 1.00 0.00 H new ATOM 429 N VAL A 28 2.073 24.834 -31.922 1.00 0.00 N ATOM 430 CA VAL A 28 1.413 26.127 -32.078 1.00 0.00 C ATOM 431 C VAL A 28 2.395 27.286 -31.902 1.00 0.00 C ATOM 432 O VAL A 28 2.115 28.413 -32.309 1.00 0.00 O ATOM 433 CB VAL A 28 0.288 26.261 -31.050 1.00 0.00 C ATOM 434 CG1 VAL A 28 -0.739 25.147 -31.266 1.00 0.00 C ATOM 435 CG2 VAL A 28 0.868 26.151 -29.637 1.00 0.00 C ATOM 0 H VAL A 28 1.742 24.283 -31.130 1.00 0.00 H new ATOM 0 HA VAL A 28 1.007 26.172 -33.089 1.00 0.00 H new ATOM 0 HB VAL A 28 -0.196 27.230 -31.170 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.540 25.243 -30.533 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -1.155 25.225 -32.270 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.255 24.178 -31.149 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.065 26.247 -28.906 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.354 25.183 -29.518 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.598 26.945 -29.480 1.00 0.00 H new ATOM 445 N HIS A 29 3.539 27.007 -31.283 1.00 0.00 N ATOM 446 CA HIS A 29 4.541 28.042 -31.049 1.00 0.00 C ATOM 447 C HIS A 29 5.563 28.088 -32.180 1.00 0.00 C ATOM 448 O HIS A 29 6.167 29.130 -32.439 1.00 0.00 O ATOM 449 CB HIS A 29 5.260 27.780 -29.724 1.00 0.00 C ATOM 450 CG HIS A 29 6.309 28.835 -29.506 1.00 0.00 C ATOM 451 ND1 HIS A 29 5.986 30.148 -29.199 1.00 0.00 N ATOM 452 CD2 HIS A 29 7.681 28.787 -29.547 1.00 0.00 C ATOM 453 CE1 HIS A 29 7.138 30.830 -29.069 1.00 0.00 C ATOM 454 NE2 HIS A 29 8.202 30.048 -29.271 1.00 0.00 N ATOM 0 H HIS A 29 3.794 26.082 -30.937 1.00 0.00 H new ATOM 0 HA HIS A 29 4.028 29.003 -31.008 1.00 0.00 H new ATOM 0 HB2 HIS A 29 4.544 27.788 -28.902 1.00 0.00 H new ATOM 0 HB3 HIS A 29 5.720 26.792 -29.737 1.00 0.00 H new ATOM 0 HD2 HIS A 29 8.267 27.905 -29.761 1.00 0.00 H new ATOM 0 HE1 HIS A 29 7.196 31.882 -28.830 1.00 0.00 H new ATOM 0 HE2 HIS A 29 9.185 30.317 -29.231 1.00 0.00 H new ATOM 463 N SER A 30 5.762 26.957 -32.845 1.00 0.00 N ATOM 464 CA SER A 30 6.721 26.872 -33.940 1.00 0.00 C ATOM 465 C SER A 30 6.013 26.838 -35.291 1.00 0.00 C ATOM 466 O SER A 30 6.596 26.418 -36.288 1.00 0.00 O ATOM 467 CB SER A 30 7.563 25.606 -33.784 1.00 0.00 C ATOM 468 OG SER A 30 8.736 25.722 -34.578 1.00 0.00 O ATOM 0 H SER A 30 5.272 26.085 -32.645 1.00 0.00 H new ATOM 0 HA SER A 30 7.358 27.756 -33.904 1.00 0.00 H new ATOM 0 HB2 SER A 30 7.831 25.460 -32.738 1.00 0.00 H new ATOM 0 HB3 SER A 30 6.987 24.732 -34.090 1.00 0.00 H new ATOM 0 HG SER A 30 9.464 25.214 -34.162 1.00 0.00 H new ATOM 474 N SER A 31 4.758 27.276 -35.324 1.00 0.00 N ATOM 475 CA SER A 31 4.003 27.280 -36.572 1.00 0.00 C ATOM 476 C SER A 31 4.721 28.116 -37.628 1.00 0.00 C ATOM 477 O SER A 31 4.947 27.663 -38.750 1.00 0.00 O ATOM 478 CB SER A 31 2.604 27.849 -36.333 1.00 0.00 C ATOM 479 OG SER A 31 1.892 27.879 -37.563 1.00 0.00 O ATOM 0 H SER A 31 4.248 27.628 -34.513 1.00 0.00 H new ATOM 0 HA SER A 31 3.921 26.254 -36.930 1.00 0.00 H new ATOM 0 HB2 SER A 31 2.070 27.238 -35.605 1.00 0.00 H new ATOM 0 HB3 SER A 31 2.674 28.853 -35.916 1.00 0.00 H new ATOM 0 HG SER A 31 0.994 28.242 -37.413 1.00 0.00 H new ATOM 485 N ASN A 32 5.075 29.341 -37.255 1.00 0.00 N ATOM 486 CA ASN A 32 5.767 30.242 -38.172 1.00 0.00 C ATOM 487 C ASN A 32 6.991 29.558 -38.773 1.00 0.00 C ATOM 488 O ASN A 32 7.164 29.530 -39.991 1.00 0.00 O ATOM 489 CB ASN A 32 6.196 31.514 -37.436 1.00 0.00 C ATOM 490 CG ASN A 32 6.881 31.156 -36.121 1.00 0.00 C ATOM 491 OD1 ASN A 32 6.257 30.577 -35.231 1.00 0.00 O ATOM 492 ND2 ASN A 32 8.136 31.467 -35.945 1.00 0.00 N ATOM 0 H ASN A 32 4.896 29.732 -36.330 1.00 0.00 H new ATOM 0 HA ASN A 32 5.082 30.506 -38.977 1.00 0.00 H new ATOM 0 HB2 ASN A 32 6.874 32.094 -38.062 1.00 0.00 H new ATOM 0 HB3 ASN A 32 5.326 32.142 -37.242 1.00 0.00 H new ATOM 0 HD21 ASN A 32 8.602 31.231 -35.069 1.00 0.00 H new ATOM 0 HD22 ASN A 32 8.651 31.947 -36.683 1.00 0.00 H new ATOM 499 N ASN A 33 7.833 29.005 -37.909 1.00 0.00 N ATOM 500 CA ASN A 33 9.038 28.318 -38.360 1.00 0.00 C ATOM 501 C ASN A 33 8.680 27.136 -39.256 1.00 0.00 C ATOM 502 O ASN A 33 9.330 26.902 -40.275 1.00 0.00 O ATOM 503 CB ASN A 33 9.840 27.823 -37.155 1.00 0.00 C ATOM 504 CG ASN A 33 10.467 29.006 -36.425 1.00 0.00 C ATOM 505 OD1 ASN A 33 10.152 29.257 -35.262 1.00 0.00 O ATOM 506 ND2 ASN A 33 11.340 29.753 -37.043 1.00 0.00 N ATOM 0 H ASN A 33 7.705 29.018 -36.897 1.00 0.00 H new ATOM 0 HA ASN A 33 9.641 29.023 -38.933 1.00 0.00 H new ATOM 0 HB2 ASN A 33 9.190 27.270 -36.477 1.00 0.00 H new ATOM 0 HB3 ASN A 33 10.618 27.134 -37.484 1.00 0.00 H new ATOM 0 HD21 ASN A 33 11.763 30.547 -36.562 1.00 0.00 H new ATOM 0 HD22 ASN A 33 11.600 29.543 -38.007 1.00 0.00 H new ATOM 513 N PHE A 34 7.653 26.389 -38.871 1.00 0.00 N ATOM 514 CA PHE A 34 7.230 25.229 -39.646 1.00 0.00 C ATOM 515 C PHE A 34 6.990 25.604 -41.104 1.00 0.00 C ATOM 516 O PHE A 34 7.468 24.926 -42.014 1.00 0.00 O ATOM 517 CB PHE A 34 5.943 24.652 -39.052 1.00 0.00 C ATOM 518 CG PHE A 34 5.536 23.423 -39.829 1.00 0.00 C ATOM 519 CD1 PHE A 34 6.284 22.244 -39.716 1.00 0.00 C ATOM 520 CD2 PHE A 34 4.411 23.460 -40.661 1.00 0.00 C ATOM 521 CE1 PHE A 34 5.907 21.104 -40.435 1.00 0.00 C ATOM 522 CE2 PHE A 34 4.034 22.320 -41.381 1.00 0.00 C ATOM 523 CZ PHE A 34 4.782 21.142 -41.268 1.00 0.00 C ATOM 0 H PHE A 34 7.100 26.564 -38.032 1.00 0.00 H new ATOM 0 HA PHE A 34 8.024 24.484 -39.605 1.00 0.00 H new ATOM 0 HB2 PHE A 34 6.096 24.398 -38.003 1.00 0.00 H new ATOM 0 HB3 PHE A 34 5.148 25.397 -39.087 1.00 0.00 H new ATOM 0 HD1 PHE A 34 7.152 22.215 -39.074 1.00 0.00 H new ATOM 0 HD2 PHE A 34 3.833 24.368 -40.748 1.00 0.00 H new ATOM 0 HE1 PHE A 34 6.484 20.195 -40.347 1.00 0.00 H new ATOM 0 HE2 PHE A 34 3.166 22.349 -42.023 1.00 0.00 H new ATOM 0 HZ PHE A 34 4.491 20.262 -41.823 1.00 0.00 H new ATOM 533 N GLY A 35 6.241 26.680 -41.322 1.00 0.00 N ATOM 534 CA GLY A 35 5.941 27.121 -42.679 1.00 0.00 C ATOM 535 C GLY A 35 7.214 27.520 -43.420 1.00 0.00 C ATOM 536 O GLY A 35 7.356 27.261 -44.614 1.00 0.00 O ATOM 0 H GLY A 35 5.835 27.257 -40.586 1.00 0.00 H new ATOM 0 HA2 GLY A 35 5.436 26.322 -43.221 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.255 27.967 -42.647 1.00 0.00 H new ATOM 540 N ALA A 36 8.132 28.156 -42.702 1.00 0.00 N ATOM 541 CA ALA A 36 9.391 28.593 -43.298 1.00 0.00 C ATOM 542 C ALA A 36 10.186 27.399 -43.823 1.00 0.00 C ATOM 543 O ALA A 36 10.733 27.444 -44.925 1.00 0.00 O ATOM 544 CB ALA A 36 10.225 29.348 -42.263 1.00 0.00 C ATOM 0 H ALA A 36 8.031 28.380 -41.712 1.00 0.00 H new ATOM 0 HA ALA A 36 9.162 29.254 -44.133 1.00 0.00 H new ATOM 0 HB1 ALA A 36 11.162 29.670 -42.716 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.671 30.220 -41.916 1.00 0.00 H new ATOM 0 HB3 ALA A 36 10.437 28.693 -41.418 1.00 0.00 H new ATOM 550 N ILE A 37 10.249 26.335 -43.029 1.00 0.00 N ATOM 551 CA ILE A 37 10.984 25.139 -43.431 1.00 0.00 C ATOM 552 C ILE A 37 10.243 24.387 -44.533 1.00 0.00 C ATOM 553 O ILE A 37 10.844 23.981 -45.528 1.00 0.00 O ATOM 554 CB ILE A 37 11.191 24.219 -42.227 1.00 0.00 C ATOM 555 CG1 ILE A 37 12.193 24.857 -41.262 1.00 0.00 C ATOM 556 CG2 ILE A 37 11.732 22.870 -42.703 1.00 0.00 C ATOM 557 CD1 ILE A 37 12.184 24.093 -39.937 1.00 0.00 C ATOM 0 H ILE A 37 9.805 26.275 -42.113 1.00 0.00 H new ATOM 0 HA ILE A 37 11.954 25.452 -43.818 1.00 0.00 H new ATOM 0 HB ILE A 37 10.239 24.070 -41.717 1.00 0.00 H new ATOM 0 HG12 ILE A 37 13.193 24.841 -41.696 1.00 0.00 H new ATOM 0 HG13 ILE A 37 11.936 25.903 -41.093 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.880 22.214 -41.845 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.019 22.414 -43.390 1.00 0.00 H new ATOM 0 HG23 ILE A 37 12.683 23.019 -43.214 1.00 0.00 H new ATOM 0 HD11 ILE A 37 12.898 24.548 -39.250 1.00 0.00 H new ATOM 0 HD12 ILE A 37 11.186 24.132 -39.501 1.00 0.00 H new ATOM 0 HD13 ILE A 37 12.462 23.054 -40.114 1.00 0.00 H new ATOM 569 N LEU A 38 8.940 24.200 -44.354 1.00 0.00 N ATOM 570 CA LEU A 38 8.140 23.490 -45.346 1.00 0.00 C ATOM 571 C LEU A 38 8.235 24.188 -46.699 1.00 0.00 C ATOM 572 O LEU A 38 8.421 23.546 -47.732 1.00 0.00 O ATOM 573 CB LEU A 38 6.677 23.436 -44.893 1.00 0.00 C ATOM 574 CG LEU A 38 5.834 22.685 -45.929 1.00 0.00 C ATOM 575 CD1 LEU A 38 6.301 21.230 -46.019 1.00 0.00 C ATOM 576 CD2 LEU A 38 4.364 22.720 -45.504 1.00 0.00 C ATOM 0 H LEU A 38 8.419 24.526 -43.540 1.00 0.00 H new ATOM 0 HA LEU A 38 8.524 22.475 -45.445 1.00 0.00 H new ATOM 0 HB2 LEU A 38 6.606 22.939 -43.925 1.00 0.00 H new ATOM 0 HB3 LEU A 38 6.291 24.447 -44.762 1.00 0.00 H new ATOM 0 HG LEU A 38 5.948 23.161 -46.903 1.00 0.00 H new ATOM 0 HD11 LEU A 38 5.699 20.700 -46.757 1.00 0.00 H new ATOM 0 HD12 LEU A 38 7.349 21.202 -46.318 1.00 0.00 H new ATOM 0 HD13 LEU A 38 6.188 20.751 -45.046 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.760 22.187 -46.238 1.00 0.00 H new ATOM 0 HD22 LEU A 38 4.255 22.243 -44.530 1.00 0.00 H new ATOM 0 HD23 LEU A 38 4.028 23.755 -45.441 1.00 0.00 H new ATOM 588 N SER A 39 8.097 25.508 -46.680 1.00 0.00 N ATOM 589 CA SER A 39 8.160 26.296 -47.906 1.00 0.00 C ATOM 590 C SER A 39 9.392 25.925 -48.727 1.00 0.00 C ATOM 591 O SER A 39 9.396 26.056 -49.951 1.00 0.00 O ATOM 592 CB SER A 39 8.205 27.786 -47.565 1.00 0.00 C ATOM 593 OG SER A 39 6.986 28.161 -46.937 1.00 0.00 O ATOM 0 H SER A 39 7.941 26.054 -45.833 1.00 0.00 H new ATOM 0 HA SER A 39 7.269 26.081 -48.496 1.00 0.00 H new ATOM 0 HB2 SER A 39 9.047 27.994 -46.905 1.00 0.00 H new ATOM 0 HB3 SER A 39 8.357 28.374 -48.470 1.00 0.00 H new ATOM 0 HG SER A 39 6.879 27.657 -46.104 1.00 0.00 H new ATOM 599 N SER A 40 10.436 25.463 -48.045 1.00 0.00 N ATOM 600 CA SER A 40 11.670 25.078 -48.723 1.00 0.00 C ATOM 601 C SER A 40 11.651 23.593 -49.076 1.00 0.00 C ATOM 602 O SER A 40 12.694 22.938 -49.100 1.00 0.00 O ATOM 603 CB SER A 40 12.872 25.375 -47.827 1.00 0.00 C ATOM 604 OG SER A 40 12.942 26.774 -47.585 1.00 0.00 O ATOM 0 H SER A 40 10.453 25.347 -47.032 1.00 0.00 H new ATOM 0 HA SER A 40 11.750 25.656 -49.644 1.00 0.00 H new ATOM 0 HB2 SER A 40 12.780 24.835 -46.885 1.00 0.00 H new ATOM 0 HB3 SER A 40 13.790 25.030 -48.304 1.00 0.00 H new ATOM 0 HG SER A 40 13.711 26.968 -47.009 1.00 0.00 H new ATOM 610 N THR A 41 10.461 23.069 -49.349 1.00 0.00 N ATOM 611 CA THR A 41 10.318 21.660 -49.700 1.00 0.00 C ATOM 612 C THR A 41 10.968 21.356 -51.051 1.00 0.00 C ATOM 613 O THR A 41 11.089 20.193 -51.437 1.00 0.00 O ATOM 614 CB THR A 41 8.835 21.286 -49.752 1.00 0.00 C ATOM 615 OG1 THR A 41 8.708 19.903 -50.047 1.00 0.00 O ATOM 616 CG2 THR A 41 8.137 22.108 -50.836 1.00 0.00 C ATOM 0 H THR A 41 9.587 23.594 -49.334 1.00 0.00 H new ATOM 0 HA THR A 41 10.822 21.069 -48.935 1.00 0.00 H new ATOM 0 HB THR A 41 8.373 21.496 -48.787 1.00 0.00 H new ATOM 0 HG1 THR A 41 7.822 19.589 -49.769 1.00 0.00 H new ATOM 0 HG21 THR A 41 7.081 21.841 -50.872 1.00 0.00 H new ATOM 0 HG22 THR A 41 8.235 23.169 -50.608 1.00 0.00 H new ATOM 0 HG23 THR A 41 8.597 21.901 -51.802 1.00 0.00 H new ATOM 624 N ASN A 42 11.383 22.398 -51.770 1.00 0.00 N ATOM 625 CA ASN A 42 12.014 22.207 -53.072 1.00 0.00 C ATOM 626 C ASN A 42 13.501 21.878 -52.926 1.00 0.00 C ATOM 627 O ASN A 42 14.235 21.854 -53.913 1.00 0.00 O ATOM 628 CB ASN A 42 11.851 23.471 -53.919 1.00 0.00 C ATOM 629 CG ASN A 42 12.659 24.614 -53.313 1.00 0.00 C ATOM 630 OD1 ASN A 42 13.157 24.499 -52.193 1.00 0.00 O ATOM 631 ND2 ASN A 42 12.820 25.718 -53.991 1.00 0.00 N ATOM 0 H ASN A 42 11.295 23.371 -51.477 1.00 0.00 H new ATOM 0 HA ASN A 42 11.524 21.367 -53.564 1.00 0.00 H new ATOM 0 HB2 ASN A 42 12.184 23.280 -54.939 1.00 0.00 H new ATOM 0 HB3 ASN A 42 10.798 23.748 -53.974 1.00 0.00 H new ATOM 0 HD21 ASN A 42 13.359 26.487 -53.593 1.00 0.00 H new ATOM 0 HD22 ASN A 42 12.407 25.812 -54.919 1.00 0.00 H new ATOM 638 N VAL A 43 13.943 21.623 -51.695 1.00 0.00 N ATOM 639 CA VAL A 43 15.343 21.296 -51.450 1.00 0.00 C ATOM 640 C VAL A 43 15.574 19.788 -51.554 1.00 0.00 C ATOM 641 O VAL A 43 16.567 19.266 -51.048 1.00 0.00 O ATOM 642 CB VAL A 43 15.752 21.792 -50.058 1.00 0.00 C ATOM 643 CG1 VAL A 43 15.227 20.829 -48.989 1.00 0.00 C ATOM 644 CG2 VAL A 43 17.280 21.878 -49.969 1.00 0.00 C ATOM 0 H VAL A 43 13.357 21.637 -50.860 1.00 0.00 H new ATOM 0 HA VAL A 43 15.953 21.790 -52.206 1.00 0.00 H new ATOM 0 HB VAL A 43 15.325 22.781 -49.890 1.00 0.00 H new ATOM 0 HG11 VAL A 43 15.520 21.186 -48.002 1.00 0.00 H new ATOM 0 HG12 VAL A 43 14.140 20.778 -49.048 1.00 0.00 H new ATOM 0 HG13 VAL A 43 15.647 19.837 -49.155 1.00 0.00 H new ATOM 0 HG21 VAL A 43 17.567 22.231 -48.979 1.00 0.00 H new ATOM 0 HG22 VAL A 43 17.711 20.892 -50.142 1.00 0.00 H new ATOM 0 HG23 VAL A 43 17.650 22.573 -50.723 1.00 0.00 H new ATOM 654 N GLY A 44 14.654 19.090 -52.217 1.00 0.00 N ATOM 655 CA GLY A 44 14.777 17.645 -52.378 1.00 0.00 C ATOM 656 C GLY A 44 13.644 16.910 -51.663 1.00 0.00 C ATOM 657 O GLY A 44 13.391 15.735 -51.933 1.00 0.00 O ATOM 0 H GLY A 44 13.824 19.498 -52.647 1.00 0.00 H new ATOM 0 HA2 GLY A 44 14.765 17.392 -53.438 1.00 0.00 H new ATOM 0 HA3 GLY A 44 15.736 17.313 -51.982 1.00 0.00 H new ATOM 661 N SER A 45 12.966 17.603 -50.752 1.00 0.00 N ATOM 662 CA SER A 45 11.866 16.997 -50.010 1.00 0.00 C ATOM 663 C SER A 45 10.532 17.303 -50.684 1.00 0.00 C ATOM 664 O SER A 45 9.497 17.389 -50.024 1.00 0.00 O ATOM 665 CB SER A 45 11.848 17.529 -48.577 1.00 0.00 C ATOM 666 OG SER A 45 11.664 18.938 -48.602 1.00 0.00 O ATOM 0 H SER A 45 13.157 18.576 -50.512 1.00 0.00 H new ATOM 0 HA SER A 45 12.014 15.917 -49.995 1.00 0.00 H new ATOM 0 HB2 SER A 45 11.046 17.056 -48.011 1.00 0.00 H new ATOM 0 HB3 SER A 45 12.782 17.281 -48.073 1.00 0.00 H new ATOM 0 HG SER A 45 11.650 19.282 -47.685 1.00 0.00 H new ATOM 672 N ASN A 46 10.565 17.467 -52.002 1.00 0.00 N ATOM 673 CA ASN A 46 9.352 17.765 -52.755 1.00 0.00 C ATOM 674 C ASN A 46 8.708 16.481 -53.273 1.00 0.00 C ATOM 675 O ASN A 46 7.963 16.502 -54.253 1.00 0.00 O ATOM 676 CB ASN A 46 9.681 18.687 -53.932 1.00 0.00 C ATOM 677 CG ASN A 46 10.543 17.949 -54.951 1.00 0.00 C ATOM 678 OD1 ASN A 46 11.033 16.854 -54.676 1.00 0.00 O ATOM 679 ND2 ASN A 46 10.759 18.488 -56.120 1.00 0.00 N ATOM 0 H ASN A 46 11.411 17.399 -52.567 1.00 0.00 H new ATOM 0 HA ASN A 46 8.648 18.264 -52.089 1.00 0.00 H new ATOM 0 HB2 ASN A 46 8.760 19.030 -54.404 1.00 0.00 H new ATOM 0 HB3 ASN A 46 10.205 19.573 -53.574 1.00 0.00 H new ATOM 0 HD21 ASN A 46 11.335 18.002 -56.807 1.00 0.00 H new ATOM 0 HD22 ASN A 46 10.352 19.396 -56.346 1.00 0.00 H new ATOM 686 N THR A 47 8.999 15.366 -52.610 1.00 0.00 N ATOM 687 CA THR A 47 8.440 14.081 -53.015 1.00 0.00 C ATOM 688 C THR A 47 7.148 13.794 -52.254 1.00 0.00 C ATOM 689 O THR A 47 6.795 12.637 -52.026 1.00 0.00 O ATOM 690 CB THR A 47 9.452 12.964 -52.747 1.00 0.00 C ATOM 691 OG1 THR A 47 10.758 13.423 -53.068 1.00 0.00 O ATOM 692 CG2 THR A 47 9.111 11.747 -53.609 1.00 0.00 C ATOM 0 H THR A 47 9.613 15.326 -51.797 1.00 0.00 H new ATOM 0 HA THR A 47 8.218 14.122 -54.081 1.00 0.00 H new ATOM 0 HB THR A 47 9.414 12.683 -51.694 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.407 12.709 -52.895 1.00 0.00 H new ATOM 0 HG21 THR A 47 9.832 10.952 -53.418 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.109 11.395 -53.362 1.00 0.00 H new ATOM 0 HG23 THR A 47 9.149 12.025 -54.662 1.00 0.00 H new ATOM 700 N TYR A 48 6.449 14.855 -51.864 1.00 0.00 N ATOM 701 CA TYR A 48 5.197 14.706 -51.129 1.00 0.00 C ATOM 702 C TYR A 48 4.039 15.326 -51.907 1.00 0.00 C ATOM 703 O TYR A 48 3.030 15.724 -51.324 1.00 0.00 O ATOM 704 CB TYR A 48 5.314 15.375 -49.756 1.00 0.00 C ATOM 705 CG TYR A 48 5.194 16.874 -49.908 1.00 0.00 C ATOM 706 CD1 TYR A 48 4.063 17.539 -49.419 1.00 0.00 C ATOM 707 CD2 TYR A 48 6.214 17.599 -50.536 1.00 0.00 C ATOM 708 CE1 TYR A 48 3.951 18.928 -49.559 1.00 0.00 C ATOM 709 CE2 TYR A 48 6.102 18.988 -50.677 1.00 0.00 C ATOM 710 CZ TYR A 48 4.971 19.652 -50.188 1.00 0.00 C ATOM 711 OH TYR A 48 4.861 21.020 -50.327 1.00 0.00 O ATOM 0 H TYR A 48 6.725 15.821 -52.043 1.00 0.00 H new ATOM 0 HA TYR A 48 4.999 13.642 -50.997 1.00 0.00 H new ATOM 0 HB2 TYR A 48 4.534 15.003 -49.092 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.270 15.122 -49.297 1.00 0.00 H new ATOM 0 HD1 TYR A 48 3.276 16.980 -48.934 1.00 0.00 H new ATOM 0 HD2 TYR A 48 7.087 17.087 -50.912 1.00 0.00 H new ATOM 0 HE1 TYR A 48 3.078 19.440 -49.182 1.00 0.00 H new ATOM 0 HE2 TYR A 48 6.888 19.547 -51.163 1.00 0.00 H new ATOM 0 HH TYR A 48 4.334 21.383 -49.585 1.00 0.00 H new ATOM 721 N GLY A 49 4.191 15.405 -53.226 1.00 0.00 N ATOM 722 CA GLY A 49 3.151 15.979 -54.073 1.00 0.00 C ATOM 723 C GLY A 49 1.784 15.389 -53.740 1.00 0.00 C ATOM 724 O GLY A 49 1.542 14.200 -53.948 1.00 0.00 O ATOM 0 H GLY A 49 5.018 15.081 -53.728 1.00 0.00 H new ATOM 0 HA2 GLY A 49 3.126 17.061 -53.941 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.386 15.791 -55.121 1.00 0.00 H new ATOM 728 N LYS A 50 0.895 16.231 -53.223 1.00 0.00 N ATOM 729 CA LYS A 50 -0.447 15.788 -52.864 1.00 0.00 C ATOM 730 C LYS A 50 -1.238 15.403 -54.110 1.00 0.00 C ATOM 731 O LYS A 50 -2.064 14.490 -54.075 1.00 0.00 O ATOM 732 CB LYS A 50 -1.180 16.903 -52.115 1.00 0.00 C ATOM 733 CG LYS A 50 -0.541 17.097 -50.738 1.00 0.00 C ATOM 734 CD LYS A 50 -1.379 18.080 -49.917 1.00 0.00 C ATOM 735 CE LYS A 50 -1.231 19.489 -50.495 1.00 0.00 C ATOM 736 NZ LYS A 50 0.203 19.892 -50.462 1.00 0.00 N ATOM 0 H LYS A 50 1.078 17.218 -53.044 1.00 0.00 H new ATOM 0 HA LYS A 50 -0.360 14.913 -52.220 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.132 17.831 -52.684 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -2.235 16.650 -52.006 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -0.473 16.141 -50.220 1.00 0.00 H new ATOM 0 HG3 LYS A 50 0.476 17.474 -50.848 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -2.427 17.779 -49.930 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -1.056 18.067 -48.876 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -1.603 19.514 -51.519 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -1.831 20.194 -49.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 0.271 20.929 -50.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.659 19.482 -49.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 0.681 19.546 -51.319 1.00 0.00 H new ATOM 750 N ARG A 51 -0.981 16.104 -55.208 1.00 0.00 N ATOM 751 CA ARG A 51 -1.675 15.828 -56.462 1.00 0.00 C ATOM 752 C ARG A 51 -1.396 14.404 -56.942 1.00 0.00 C ATOM 753 O ARG A 51 -2.106 13.882 -57.801 1.00 0.00 O ATOM 754 CB ARG A 51 -1.232 16.825 -57.535 1.00 0.00 C ATOM 755 CG ARG A 51 0.206 16.520 -57.961 1.00 0.00 C ATOM 756 CD ARG A 51 0.712 17.632 -58.882 1.00 0.00 C ATOM 757 NE ARG A 51 2.051 17.316 -59.368 1.00 0.00 N ATOM 758 CZ ARG A 51 3.138 17.518 -58.620 1.00 0.00 C ATOM 759 NH1 ARG A 51 3.037 18.008 -57.410 1.00 0.00 N ATOM 760 NH2 ARG A 51 4.315 17.224 -59.100 1.00 0.00 N ATOM 0 H ARG A 51 -0.302 16.863 -55.257 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.746 15.931 -56.286 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -1.897 16.766 -58.397 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.299 17.842 -57.150 1.00 0.00 H new ATOM 0 HG2 ARG A 51 0.847 16.440 -57.083 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.248 15.560 -58.475 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.031 17.754 -59.724 1.00 0.00 H new ATOM 0 HD3 ARG A 51 0.727 18.580 -58.345 1.00 0.00 H new ATOM 0 HE ARG A 51 2.160 16.930 -60.306 1.00 0.00 H new ATOM 0 HH11 ARG A 51 2.120 18.240 -57.029 1.00 0.00 H new ATOM 0 HH12 ARG A 51 3.875 18.158 -56.849 1.00 0.00 H new ATOM 0 HH21 ARG A 51 4.401 16.842 -60.042 1.00 0.00 H new ATOM 0 HH22 ARG A 51 5.149 17.376 -58.533 1.00 0.00 H new ATOM 774 N ASN A 52 -0.361 13.778 -56.387 1.00 0.00 N ATOM 775 CA ASN A 52 -0.012 12.416 -56.776 1.00 0.00 C ATOM 776 C ASN A 52 -0.873 11.405 -56.026 1.00 0.00 C ATOM 777 O ASN A 52 -1.086 10.287 -56.495 1.00 0.00 O ATOM 778 CB ASN A 52 1.465 12.149 -56.480 1.00 0.00 C ATOM 779 CG ASN A 52 1.975 11.015 -57.362 1.00 0.00 C ATOM 780 OD1 ASN A 52 2.469 11.258 -58.463 1.00 0.00 O ATOM 781 ND2 ASN A 52 1.881 9.783 -56.943 1.00 0.00 N ATOM 0 H ASN A 52 0.244 14.187 -55.675 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.194 12.308 -57.845 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.050 13.051 -56.659 1.00 0.00 H new ATOM 0 HB3 ASN A 52 1.593 11.890 -55.429 1.00 0.00 H new ATOM 0 HD21 ASN A 52 2.217 9.018 -57.528 1.00 0.00 H new ATOM 0 HD22 ASN A 52 1.471 9.585 -56.030 1.00 0.00 H new ATOM 788 N ALA A 53 -1.363 11.803 -54.856 1.00 0.00 N ATOM 789 CA ALA A 53 -2.196 10.922 -54.045 1.00 0.00 C ATOM 790 C ALA A 53 -3.452 10.511 -54.807 1.00 0.00 C ATOM 791 O ALA A 53 -3.861 9.351 -54.768 1.00 0.00 O ATOM 792 CB ALA A 53 -2.596 11.633 -52.751 1.00 0.00 C ATOM 0 H ALA A 53 -1.199 12.724 -54.450 1.00 0.00 H new ATOM 0 HA ALA A 53 -1.620 10.027 -53.810 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -3.218 10.970 -52.149 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.700 11.899 -52.190 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -3.155 12.537 -52.991 1.00 0.00 H new ATOM 798 N VAL A 54 -4.063 11.470 -55.494 1.00 0.00 N ATOM 799 CA VAL A 54 -5.275 11.193 -56.255 1.00 0.00 C ATOM 800 C VAL A 54 -4.941 10.493 -57.569 1.00 0.00 C ATOM 801 O VAL A 54 -5.745 9.723 -58.093 1.00 0.00 O ATOM 802 CB VAL A 54 -6.029 12.494 -56.538 1.00 0.00 C ATOM 803 CG1 VAL A 54 -5.379 13.220 -57.718 1.00 0.00 C ATOM 804 CG2 VAL A 54 -7.486 12.173 -56.878 1.00 0.00 C ATOM 0 H VAL A 54 -3.743 12.437 -55.540 1.00 0.00 H new ATOM 0 HA VAL A 54 -5.907 10.533 -55.661 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.991 13.133 -55.656 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.918 14.146 -57.917 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -4.341 13.449 -57.477 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -5.414 12.583 -58.601 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -8.025 13.099 -57.080 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.521 11.533 -57.759 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -7.951 11.659 -56.037 1.00 0.00 H new ATOM 814 N GLU A 55 -3.751 10.762 -58.097 1.00 0.00 N ATOM 815 CA GLU A 55 -3.329 10.147 -59.351 1.00 0.00 C ATOM 816 C GLU A 55 -3.195 8.635 -59.191 1.00 0.00 C ATOM 817 O GLU A 55 -3.664 7.870 -60.033 1.00 0.00 O ATOM 818 CB GLU A 55 -1.989 10.737 -59.795 1.00 0.00 C ATOM 819 CG GLU A 55 -1.691 10.310 -61.234 1.00 0.00 C ATOM 820 CD GLU A 55 -1.086 8.909 -61.257 1.00 0.00 C ATOM 821 OE1 GLU A 55 -0.419 8.555 -60.298 1.00 0.00 O ATOM 822 OE2 GLU A 55 -1.299 8.209 -62.233 1.00 0.00 O ATOM 0 H GLU A 55 -3.068 11.395 -57.681 1.00 0.00 H new ATOM 0 HA GLU A 55 -4.086 10.353 -60.108 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.019 11.824 -59.726 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.193 10.397 -59.132 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -2.608 10.327 -61.823 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -1.003 11.018 -61.695 1.00 0.00 H new ATOM 829 N VAL A 56 -2.552 8.210 -58.108 1.00 0.00 N ATOM 830 CA VAL A 56 -2.366 6.785 -57.857 1.00 0.00 C ATOM 831 C VAL A 56 -3.677 6.140 -57.416 1.00 0.00 C ATOM 832 O VAL A 56 -3.965 4.996 -57.766 1.00 0.00 O ATOM 833 CB VAL A 56 -1.296 6.572 -56.783 1.00 0.00 C ATOM 834 CG1 VAL A 56 -1.763 7.178 -55.458 1.00 0.00 C ATOM 835 CG2 VAL A 56 -1.054 5.073 -56.597 1.00 0.00 C ATOM 0 H VAL A 56 -2.155 8.824 -57.397 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.040 6.315 -58.785 1.00 0.00 H new ATOM 0 HB VAL A 56 -0.372 7.058 -57.096 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.998 7.023 -54.697 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -1.936 8.246 -55.587 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.689 6.696 -55.144 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -0.292 4.920 -55.833 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.981 4.590 -56.288 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -0.716 4.639 -57.538 1.00 0.00 H new ATOM 845 N LEU A 57 -4.467 6.882 -56.645 1.00 0.00 N ATOM 846 CA LEU A 57 -5.747 6.375 -56.160 1.00 0.00 C ATOM 847 C LEU A 57 -6.555 5.754 -57.294 1.00 0.00 C ATOM 848 O LEU A 57 -7.051 4.634 -57.171 1.00 0.00 O ATOM 849 CB LEU A 57 -6.552 7.513 -55.528 1.00 0.00 C ATOM 850 CG LEU A 57 -6.764 7.223 -54.041 1.00 0.00 C ATOM 851 CD1 LEU A 57 -5.506 7.605 -53.260 1.00 0.00 C ATOM 852 CD2 LEU A 57 -7.952 8.041 -53.528 1.00 0.00 C ATOM 0 H LEU A 57 -4.245 7.831 -56.344 1.00 0.00 H new ATOM 0 HA LEU A 57 -5.546 5.606 -55.414 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -6.025 8.459 -55.653 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.514 7.615 -56.030 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.966 6.161 -53.903 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.658 7.398 -52.201 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.660 7.023 -53.625 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.302 8.667 -53.396 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -8.105 7.836 -52.468 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -7.749 9.103 -53.666 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.849 7.768 -54.084 1.00 0.00 H new ATOM 864 N LYS A 58 -6.690 6.485 -58.396 1.00 0.00 N ATOM 865 CA LYS A 58 -7.449 5.983 -59.536 1.00 0.00 C ATOM 866 C LYS A 58 -6.788 4.734 -60.109 1.00 0.00 C ATOM 867 O LYS A 58 -7.464 3.776 -60.484 1.00 0.00 O ATOM 868 CB LYS A 58 -7.545 7.059 -60.620 1.00 0.00 C ATOM 869 CG LYS A 58 -8.490 8.171 -60.159 1.00 0.00 C ATOM 870 CD LYS A 58 -9.940 7.719 -60.340 1.00 0.00 C ATOM 871 CE LYS A 58 -10.882 8.867 -59.973 1.00 0.00 C ATOM 872 NZ LYS A 58 -10.774 9.151 -58.514 1.00 0.00 N ATOM 0 H LYS A 58 -6.290 7.414 -58.524 1.00 0.00 H new ATOM 0 HA LYS A 58 -8.452 5.726 -59.195 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.557 7.470 -60.827 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.909 6.621 -61.550 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -8.301 8.412 -59.113 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -8.307 9.079 -60.733 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -10.110 7.411 -61.372 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -10.143 6.852 -59.711 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -10.628 9.758 -60.548 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -11.909 8.605 -60.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -11.577 9.740 -58.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -10.785 8.256 -57.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -9.885 9.655 -58.323 1.00 0.00 H new ATOM 886 N ARG A 59 -5.460 4.753 -60.171 1.00 0.00 N ATOM 887 CA ARG A 59 -4.710 3.619 -60.699 1.00 0.00 C ATOM 888 C ARG A 59 -4.796 2.424 -59.752 1.00 0.00 C ATOM 889 O ARG A 59 -4.592 1.282 -60.163 1.00 0.00 O ATOM 890 CB ARG A 59 -3.244 4.010 -60.897 1.00 0.00 C ATOM 891 CG ARG A 59 -2.588 3.053 -61.895 1.00 0.00 C ATOM 892 CD ARG A 59 -1.701 2.058 -61.143 1.00 0.00 C ATOM 893 NE ARG A 59 -1.054 1.148 -62.083 1.00 0.00 N ATOM 894 CZ ARG A 59 -0.223 0.187 -61.673 1.00 0.00 C ATOM 895 NH1 ARG A 59 0.046 0.032 -60.401 1.00 0.00 N ATOM 896 NH2 ARG A 59 0.328 -0.608 -62.549 1.00 0.00 N ATOM 0 H ARG A 59 -4.884 5.537 -59.864 1.00 0.00 H new ATOM 0 HA ARG A 59 -5.146 3.337 -61.658 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -3.177 5.035 -61.262 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -2.716 3.976 -59.944 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.353 2.520 -62.460 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -1.993 3.614 -62.615 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -0.947 2.595 -60.568 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.301 1.491 -60.431 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.242 1.249 -63.080 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -0.381 0.649 -59.710 1.00 0.00 H new ATOM 0 HH12 ARG A 59 0.683 -0.706 -60.101 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.123 -0.493 -63.542 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.964 -1.344 -62.241 1.00 0.00 H new ATOM 910 N GLU A 60 -5.096 2.693 -58.484 1.00 0.00 N ATOM 911 CA GLU A 60 -5.201 1.627 -57.494 1.00 0.00 C ATOM 912 C GLU A 60 -6.631 1.513 -56.977 1.00 0.00 C ATOM 913 O GLU A 60 -6.928 1.918 -55.854 1.00 0.00 O ATOM 914 CB GLU A 60 -4.259 1.909 -56.321 1.00 0.00 C ATOM 915 CG GLU A 60 -2.811 1.926 -56.815 1.00 0.00 C ATOM 916 CD GLU A 60 -2.447 0.569 -57.409 1.00 0.00 C ATOM 917 OE1 GLU A 60 -2.916 -0.429 -56.887 1.00 0.00 O ATOM 918 OE2 GLU A 60 -1.705 0.549 -58.377 1.00 0.00 O ATOM 0 H GLU A 60 -5.269 3.630 -58.121 1.00 0.00 H new ATOM 0 HA GLU A 60 -4.921 0.688 -57.971 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -4.509 2.866 -55.864 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -4.382 1.147 -55.552 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -2.683 2.707 -57.565 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -2.139 2.163 -55.990 1.00 0.00 H new ATOM 925 N PRO A 61 -7.513 0.968 -57.773 1.00 0.00 N ATOM 926 CA PRO A 61 -8.946 0.791 -57.392 1.00 0.00 C ATOM 927 C PRO A 61 -9.130 -0.227 -56.265 1.00 0.00 C ATOM 928 O PRO A 61 -10.235 -0.397 -55.748 1.00 0.00 O ATOM 929 CB PRO A 61 -9.614 0.303 -58.681 1.00 0.00 C ATOM 930 CG PRO A 61 -8.517 -0.291 -59.500 1.00 0.00 C ATOM 931 CD PRO A 61 -7.240 0.460 -59.127 1.00 0.00 C ATOM 0 HA PRO A 61 -9.377 1.716 -57.007 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -10.387 -0.435 -58.467 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.096 1.126 -59.209 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -8.414 -1.357 -59.295 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -8.729 -0.190 -60.564 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -6.371 -0.198 -59.140 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -7.035 1.272 -59.825 1.00 0.00 H new ATOM 939 N LEU A 62 -8.048 -0.902 -55.885 1.00 0.00 N ATOM 940 CA LEU A 62 -8.116 -1.892 -54.818 1.00 0.00 C ATOM 941 C LEU A 62 -8.555 -1.237 -53.512 1.00 0.00 C ATOM 942 O LEU A 62 -9.370 -1.790 -52.774 1.00 0.00 O ATOM 943 CB LEU A 62 -6.751 -2.556 -54.630 1.00 0.00 C ATOM 944 CG LEU A 62 -6.885 -3.741 -53.673 1.00 0.00 C ATOM 945 CD1 LEU A 62 -6.022 -4.901 -54.173 1.00 0.00 C ATOM 946 CD2 LEU A 62 -6.419 -3.324 -52.275 1.00 0.00 C ATOM 0 H LEU A 62 -7.123 -0.782 -56.297 1.00 0.00 H new ATOM 0 HA LEU A 62 -8.848 -2.650 -55.095 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -6.364 -2.894 -55.591 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.036 -1.835 -54.234 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.928 -4.056 -53.630 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -6.117 -5.746 -53.491 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.353 -5.199 -55.168 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.979 -4.586 -54.217 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.514 -4.169 -51.593 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.377 -3.008 -52.318 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.034 -2.498 -51.918 1.00 0.00 H new ATOM 958 N ASN A 63 -8.011 -0.057 -53.232 1.00 0.00 N ATOM 959 CA ASN A 63 -8.359 0.659 -52.010 1.00 0.00 C ATOM 960 C ASN A 63 -9.871 0.845 -51.909 1.00 0.00 C ATOM 961 O ASN A 63 -10.416 0.985 -50.814 1.00 0.00 O ATOM 962 CB ASN A 63 -7.667 2.024 -51.989 1.00 0.00 C ATOM 963 CG ASN A 63 -8.202 2.901 -53.116 1.00 0.00 C ATOM 964 OD1 ASN A 63 -8.685 2.391 -54.125 1.00 0.00 O ATOM 965 ND2 ASN A 63 -8.143 4.200 -53.003 1.00 0.00 N ATOM 0 H ASN A 63 -7.334 0.420 -53.828 1.00 0.00 H new ATOM 0 HA ASN A 63 -8.022 0.071 -51.157 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -7.835 2.511 -51.028 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -6.590 1.896 -52.098 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -8.498 4.794 -53.753 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -7.742 4.621 -52.165 1.00 0.00 H new ATOM 972 N TYR A 64 -10.543 0.843 -53.056 1.00 0.00 N ATOM 973 CA TYR A 64 -11.992 1.008 -53.082 1.00 0.00 C ATOM 974 C TYR A 64 -12.684 -0.272 -52.623 1.00 0.00 C ATOM 975 O TYR A 64 -13.590 -0.235 -51.790 1.00 0.00 O ATOM 976 CB TYR A 64 -12.453 1.356 -54.499 1.00 0.00 C ATOM 977 CG TYR A 64 -13.932 1.660 -54.486 1.00 0.00 C ATOM 978 CD1 TYR A 64 -14.387 2.905 -54.034 1.00 0.00 C ATOM 979 CD2 TYR A 64 -14.848 0.697 -54.924 1.00 0.00 C ATOM 980 CE1 TYR A 64 -15.758 3.187 -54.021 1.00 0.00 C ATOM 981 CE2 TYR A 64 -16.219 0.979 -54.911 1.00 0.00 C ATOM 982 CZ TYR A 64 -16.674 2.223 -54.460 1.00 0.00 C ATOM 983 OH TYR A 64 -18.026 2.501 -54.447 1.00 0.00 O ATOM 0 H TYR A 64 -10.111 0.730 -53.973 1.00 0.00 H new ATOM 0 HA TYR A 64 -12.259 1.818 -52.403 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -11.897 2.216 -54.873 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -12.247 0.525 -55.174 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -13.680 3.648 -53.695 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -14.497 -0.263 -55.272 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -16.109 4.147 -53.673 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -16.926 0.236 -55.249 1.00 0.00 H new ATOM 0 HH TYR A 64 -18.523 1.726 -54.784 1.00 0.00 H new ATOM 993 N LEU A 65 -12.252 -1.402 -53.171 1.00 0.00 N ATOM 994 CA LEU A 65 -12.837 -2.689 -52.812 1.00 0.00 C ATOM 995 C LEU A 65 -12.448 -3.070 -51.383 1.00 0.00 C ATOM 996 O LEU A 65 -11.461 -2.563 -50.849 1.00 0.00 O ATOM 997 CB LEU A 65 -12.350 -3.767 -53.784 1.00 0.00 C ATOM 998 CG LEU A 65 -12.866 -3.460 -55.191 1.00 0.00 C ATOM 999 CD1 LEU A 65 -12.182 -4.387 -56.198 1.00 0.00 C ATOM 1000 CD2 LEU A 65 -14.381 -3.682 -55.242 1.00 0.00 C ATOM 0 H LEU A 65 -11.503 -1.454 -53.862 1.00 0.00 H new ATOM 0 HA LEU A 65 -13.922 -2.610 -52.872 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.261 -3.804 -53.785 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -12.702 -4.747 -53.462 1.00 0.00 H new ATOM 0 HG LEU A 65 -12.643 -2.423 -55.440 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -12.549 -4.169 -57.201 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.104 -4.229 -56.164 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -12.405 -5.424 -55.948 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -14.747 -3.463 -56.245 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -14.605 -4.719 -54.992 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -14.870 -3.022 -54.525 1.00 0.00 H new ATOM 1012 N PRO A 66 -13.196 -3.945 -50.755 1.00 0.00 N ATOM 1013 CA PRO A 66 -12.908 -4.388 -49.358 1.00 0.00 C ATOM 1014 C PRO A 66 -11.470 -4.873 -49.194 1.00 0.00 C ATOM 1015 O PRO A 66 -10.927 -5.545 -50.072 1.00 0.00 O ATOM 1016 CB PRO A 66 -13.897 -5.533 -49.122 1.00 0.00 C ATOM 1017 CG PRO A 66 -15.011 -5.298 -50.086 1.00 0.00 C ATOM 1018 CD PRO A 66 -14.394 -4.607 -51.300 1.00 0.00 C ATOM 0 HA PRO A 66 -13.018 -3.572 -48.643 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -13.426 -6.501 -49.294 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -14.260 -5.533 -48.094 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -15.481 -6.239 -50.372 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -15.787 -4.677 -49.639 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -14.136 -5.323 -52.080 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -15.082 -3.887 -51.744 1.00 0.00 H new ATOM 1026 N LEU A 67 -10.859 -4.528 -48.066 1.00 0.00 N ATOM 1027 CA LEU A 67 -9.484 -4.933 -47.798 1.00 0.00 C ATOM 1028 C LEU A 67 -9.370 -5.556 -46.410 1.00 0.00 C ATOM 1029 O LEU A 67 -10.117 -5.149 -45.536 1.00 0.00 O ATOM 1030 CB LEU A 67 -8.555 -3.721 -47.894 1.00 0.00 C ATOM 1031 CG LEU A 67 -7.454 -4.002 -48.918 1.00 0.00 C ATOM 1032 CD1 LEU A 67 -6.667 -2.718 -49.187 1.00 0.00 C ATOM 1033 CD2 LEU A 67 -6.509 -5.072 -48.368 1.00 0.00 C ATOM 0 H LEU A 67 -11.290 -3.973 -47.327 1.00 0.00 H new ATOM 0 HA LEU A 67 -9.191 -5.674 -48.541 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -9.122 -2.837 -48.187 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -8.115 -3.509 -46.920 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.903 -4.354 -49.847 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.882 -2.918 -49.917 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.339 -1.954 -49.578 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -6.218 -2.365 -48.259 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.724 -5.273 -49.097 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -6.060 -4.719 -47.439 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -7.069 -5.987 -48.175 1.00 0.00 H new TER 1045 LEU A 67