USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1017 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 19 MET CE :methyl -118:sc= -3.03 (180deg=-8.53!) USER MOD Set 1.2: B 68 HIS : no HD1:sc= -3.41! C(o=-6.4!,f=-13!) USER MOD Set 2.1: B 55 THR OG1 : rot 113:sc= 1.06 USER MOD Set 2.2: B 57 SER OG : rot 180:sc= 0.917 USER MOD Set 3.1: B 1 MET CE :methyl -169:sc= -1.18 (180deg=-1.39) USER MOD Set 3.2: B 19 SER OG : rot 16:sc= 1.14 USER MOD Set 4.1: A 35 ASN : amide:sc= -2.4! C(o=-1.6!,f=-2.3!) USER MOD Set 4.2: A 42 THR OG1 : rot 95:sc= 0.826 USER MOD Set 5.1: A 14 SER OG : rot 62:sc= 0.316 USER MOD Set 5.2: A 17 MET CE :methyl -142:sc= -1.55 (180deg=-0.074) USER MOD Set 5.3: A 25 LYS NZ :NH3+ 142:sc= -4.82! (180deg=-6.31!) USER MOD Set 6.1: A 24 SER OG : rot -114:sc= 0.771 USER MOD Set 6.2: A 26 SER OG : rot 180:sc= 0.666 USER MOD Single : A 6 ASN : amide:sc= -2.15! K(o=-2.1!,f=-0.59) USER MOD Single : A 9 HIS : no HD1:sc= -3.78 K(o=-3.8,f=-3) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 165:sc= -0.035 (180deg=-0.249) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -1.15! K(o=-1.2!,f=0) USER MOD Single : A 31 HIS : no HE2:sc= -1.35 K(o=-1.4,f=-2.2) USER MOD Single : A 36 ASN : amide:sc= -0.12 K(o=-0.12,f=-1.3) USER MOD Single : A 37 ASN : amide:sc= -2.78! K(o=-2.8!,f=-0.57) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.197 K(o=-0.2,f=-2.1!) USER MOD Single : A 53 LYS NZ :NH3+ 168:sc= -0.0427 (180deg=-0.249) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= -2.58! C(o=-2.6!,f=-11!) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0 USER MOD Single : B 9 THR OG1 : rot -19:sc= 0.659 USER MOD Single : B 11 LYS NZ :NH3+ -133:sc= -1.61 (180deg=-2.37) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot -43:sc= 1.03 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 25 ASN : amide:sc= -1.58 K(o=-1.6,f=-8.6!) USER MOD Single : B 27 LYS NZ :NH3+ -135:sc= 0.204 (180deg=-0.23) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ -164:sc= -0.0213 (180deg=-0.262) USER MOD Single : B 31 GLN : amide:sc= -3.33! K(o=-3.3!,f=-0.51) USER MOD Single : B 33 LYS NZ :NH3+ 144:sc= -4.3! (180deg=-7.49!) USER MOD Single : B 40 GLN : amide:sc= -1.62! C(o=-1.6!,f=-6.5!) USER MOD Single : B 41 GLN : amide:sc= -1.64 K(o=-1.6,f=-5.8!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= -0.632 K(o=-0.63,f=-7.6!) USER MOD Single : B 59 TYR OH : rot 180:sc= -0.809 USER MOD Single : B 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 GLN : amide:sc= -0.0799 X(o=-0.08,f=-0.085) USER MOD Single : B 63 LYS NZ :NH3+ -143:sc= -3.27! (180deg=-5.88!) USER MOD Single : B 65 SER OG : rot -130:sc= -1.71! USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 6 18.267 5.926 1.238 1.00 0.00 N ATOM 2 CA ASN A 6 17.382 5.695 0.097 1.00 0.00 C ATOM 3 C ASN A 6 17.662 4.335 -0.541 1.00 0.00 C ATOM 4 O ASN A 6 17.896 4.240 -1.747 1.00 0.00 O ATOM 5 CB ASN A 6 17.543 6.808 -0.944 1.00 0.00 C ATOM 6 CG ASN A 6 18.972 6.962 -1.447 1.00 0.00 C ATOM 7 OD1 ASN A 6 19.249 7.812 -2.293 1.00 0.00 O ATOM 8 ND2 ASN A 6 19.888 6.146 -0.933 1.00 0.00 N ATOM 0 HA ASN A 6 16.355 5.702 0.461 1.00 0.00 H new ATOM 0 HB2 ASN A 6 16.888 6.602 -1.790 1.00 0.00 H new ATOM 0 HB3 ASN A 6 17.215 7.752 -0.510 1.00 0.00 H new ATOM 0 HD21 ASN A 6 20.859 6.212 -1.238 1.00 0.00 H new ATOM 0 HD22 ASN A 6 19.620 5.454 -0.233 1.00 0.00 H new ATOM 15 N ASP A 7 17.644 3.288 0.278 1.00 0.00 N ATOM 16 CA ASP A 7 17.901 1.933 -0.200 1.00 0.00 C ATOM 17 C ASP A 7 16.966 1.559 -1.347 1.00 0.00 C ATOM 18 O ASP A 7 17.403 1.017 -2.362 1.00 0.00 O ATOM 19 CB ASP A 7 17.747 0.930 0.943 1.00 0.00 C ATOM 20 CG ASP A 7 18.692 1.217 2.093 1.00 0.00 C ATOM 21 OD1 ASP A 7 19.921 1.204 1.868 1.00 0.00 O ATOM 22 OD2 ASP A 7 18.205 1.455 3.219 1.00 0.00 O ATOM 0 H ASP A 7 17.454 3.352 1.278 1.00 0.00 H new ATOM 0 HA ASP A 7 18.925 1.902 -0.573 1.00 0.00 H new ATOM 0 HB2 ASP A 7 16.720 0.952 1.306 1.00 0.00 H new ATOM 0 HB3 ASP A 7 17.931 -0.076 0.567 1.00 0.00 H new ATOM 27 N ASP A 8 15.678 1.849 -1.179 1.00 0.00 N ATOM 28 CA ASP A 8 14.684 1.536 -2.203 1.00 0.00 C ATOM 29 C ASP A 8 13.322 2.128 -1.854 1.00 0.00 C ATOM 30 O ASP A 8 12.295 1.459 -1.981 1.00 0.00 O ATOM 31 CB ASP A 8 14.563 0.020 -2.380 1.00 0.00 C ATOM 32 CG ASP A 8 14.152 -0.684 -1.103 1.00 0.00 C ATOM 33 OD1 ASP A 8 14.891 -0.581 -0.102 1.00 0.00 O ATOM 34 OD2 ASP A 8 13.088 -1.340 -1.104 1.00 0.00 O ATOM 0 H ASP A 8 15.299 2.299 -0.346 1.00 0.00 H new ATOM 0 HA ASP A 8 15.019 1.982 -3.139 1.00 0.00 H new ATOM 0 HB2 ASP A 8 13.832 -0.194 -3.160 1.00 0.00 H new ATOM 0 HB3 ASP A 8 15.518 -0.380 -2.720 1.00 0.00 H new ATOM 39 N HIS A 9 13.313 3.387 -1.423 1.00 0.00 N ATOM 40 CA HIS A 9 12.065 4.054 -1.072 1.00 0.00 C ATOM 41 C HIS A 9 11.190 4.219 -2.310 1.00 0.00 C ATOM 42 O HIS A 9 9.970 4.334 -2.207 1.00 0.00 O ATOM 43 CB HIS A 9 12.311 5.415 -0.397 1.00 0.00 C ATOM 44 CG HIS A 9 12.625 6.554 -1.329 1.00 0.00 C ATOM 45 ND1 HIS A 9 12.364 7.870 -1.001 1.00 0.00 N ATOM 46 CD2 HIS A 9 13.178 6.585 -2.567 1.00 0.00 C ATOM 47 CE1 HIS A 9 12.734 8.654 -1.995 1.00 0.00 C ATOM 48 NE2 HIS A 9 13.234 7.902 -2.956 1.00 0.00 N ATOM 0 H HIS A 9 14.149 3.961 -1.310 1.00 0.00 H new ATOM 0 HA HIS A 9 11.545 3.425 -0.350 1.00 0.00 H new ATOM 0 HB2 HIS A 9 11.427 5.677 0.184 1.00 0.00 H new ATOM 0 HB3 HIS A 9 13.136 5.307 0.308 1.00 0.00 H new ATOM 0 HD2 HIS A 9 13.512 5.733 -3.141 1.00 0.00 H new ATOM 0 HE1 HIS A 9 12.643 9.730 -2.018 1.00 0.00 H new ATOM 0 HE2 HIS A 9 13.603 8.243 -3.844 1.00 0.00 H new ATOM 57 N GLU A 10 11.832 4.243 -3.478 1.00 0.00 N ATOM 58 CA GLU A 10 11.129 4.410 -4.744 1.00 0.00 C ATOM 59 C GLU A 10 9.986 3.411 -4.858 1.00 0.00 C ATOM 60 O GLU A 10 8.908 3.743 -5.351 1.00 0.00 O ATOM 61 CB GLU A 10 12.098 4.234 -5.916 1.00 0.00 C ATOM 62 CG GLU A 10 13.274 5.199 -5.888 1.00 0.00 C ATOM 63 CD GLU A 10 12.856 6.653 -6.019 1.00 0.00 C ATOM 64 OE1 GLU A 10 11.645 6.915 -6.184 1.00 0.00 O ATOM 65 OE2 GLU A 10 13.742 7.531 -5.963 1.00 0.00 O ATOM 0 H GLU A 10 12.843 4.148 -3.570 1.00 0.00 H new ATOM 0 HA GLU A 10 10.714 5.418 -4.776 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.478 3.212 -5.912 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.552 4.367 -6.850 1.00 0.00 H new ATOM 0 HG2 GLU A 10 13.822 5.068 -4.955 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.960 4.950 -6.698 1.00 0.00 H new ATOM 72 N SER A 11 10.217 2.193 -4.378 1.00 0.00 N ATOM 73 CA SER A 11 9.188 1.162 -4.406 1.00 0.00 C ATOM 74 C SER A 11 7.962 1.649 -3.639 1.00 0.00 C ATOM 75 O SER A 11 6.830 1.583 -4.129 1.00 0.00 O ATOM 76 CB SER A 11 9.724 -0.135 -3.793 1.00 0.00 C ATOM 77 OG SER A 11 10.741 -0.697 -4.602 1.00 0.00 O ATOM 0 H SER A 11 11.103 1.898 -3.967 1.00 0.00 H new ATOM 0 HA SER A 11 8.905 0.960 -5.439 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.117 0.065 -2.796 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.910 -0.850 -3.677 1.00 0.00 H new ATOM 0 HG SER A 11 11.068 -1.523 -4.189 1.00 0.00 H new ATOM 83 N LYS A 12 8.209 2.173 -2.443 1.00 0.00 N ATOM 84 CA LYS A 12 7.145 2.711 -1.611 1.00 0.00 C ATOM 85 C LYS A 12 6.478 3.874 -2.331 1.00 0.00 C ATOM 86 O LYS A 12 5.257 4.027 -2.301 1.00 0.00 O ATOM 87 CB LYS A 12 7.705 3.180 -0.266 1.00 0.00 C ATOM 88 CG LYS A 12 8.443 2.096 0.503 1.00 0.00 C ATOM 89 CD LYS A 12 8.967 2.620 1.830 1.00 0.00 C ATOM 90 CE LYS A 12 9.721 1.544 2.596 1.00 0.00 C ATOM 91 NZ LYS A 12 10.892 1.038 1.830 1.00 0.00 N ATOM 0 H LYS A 12 9.139 2.235 -2.030 1.00 0.00 H new ATOM 0 HA LYS A 12 6.409 1.929 -1.425 1.00 0.00 H new ATOM 0 HB2 LYS A 12 8.383 4.017 -0.437 1.00 0.00 H new ATOM 0 HB3 LYS A 12 6.885 3.554 0.348 1.00 0.00 H new ATOM 0 HG2 LYS A 12 7.774 1.254 0.681 1.00 0.00 H new ATOM 0 HG3 LYS A 12 9.273 1.723 -0.097 1.00 0.00 H new ATOM 0 HD2 LYS A 12 9.625 3.470 1.652 1.00 0.00 H new ATOM 0 HD3 LYS A 12 8.135 2.982 2.434 1.00 0.00 H new ATOM 0 HE2 LYS A 12 10.058 1.947 3.551 1.00 0.00 H new ATOM 0 HE3 LYS A 12 9.047 0.717 2.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 11.519 0.505 2.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 10.563 0.414 1.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 11.413 1.840 1.422 1.00 0.00 H new ATOM 105 N LEU A 13 7.302 4.682 -2.995 1.00 0.00 N ATOM 106 CA LEU A 13 6.816 5.825 -3.750 1.00 0.00 C ATOM 107 C LEU A 13 5.832 5.352 -4.810 1.00 0.00 C ATOM 108 O LEU A 13 4.797 5.977 -5.034 1.00 0.00 O ATOM 109 CB LEU A 13 7.988 6.567 -4.402 1.00 0.00 C ATOM 110 CG LEU A 13 7.621 7.847 -5.156 1.00 0.00 C ATOM 111 CD1 LEU A 13 6.985 8.861 -4.217 1.00 0.00 C ATOM 112 CD2 LEU A 13 8.857 8.438 -5.820 1.00 0.00 C ATOM 0 H LEU A 13 8.314 4.561 -3.023 1.00 0.00 H new ATOM 0 HA LEU A 13 6.308 6.513 -3.074 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.712 6.818 -3.627 1.00 0.00 H new ATOM 0 HB3 LEU A 13 8.485 5.888 -5.095 1.00 0.00 H new ATOM 0 HG LEU A 13 6.894 7.597 -5.929 1.00 0.00 H new ATOM 0 HD11 LEU A 13 6.732 9.763 -4.773 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.080 8.437 -3.782 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.687 9.110 -3.421 1.00 0.00 H new ATOM 0 HD21 LEU A 13 8.583 9.348 -6.353 1.00 0.00 H new ATOM 0 HD22 LEU A 13 9.601 8.673 -5.059 1.00 0.00 H new ATOM 0 HD23 LEU A 13 9.272 7.716 -6.523 1.00 0.00 H new ATOM 124 N SER A 14 6.156 4.223 -5.438 1.00 0.00 N ATOM 125 CA SER A 14 5.293 3.638 -6.453 1.00 0.00 C ATOM 126 C SER A 14 3.941 3.319 -5.839 1.00 0.00 C ATOM 127 O SER A 14 2.888 3.633 -6.414 1.00 0.00 O ATOM 128 CB SER A 14 5.924 2.370 -7.030 1.00 0.00 C ATOM 129 OG SER A 14 7.176 2.650 -7.631 1.00 0.00 O ATOM 0 H SER A 14 7.012 3.697 -5.259 1.00 0.00 H new ATOM 0 HA SER A 14 5.163 4.353 -7.266 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.054 1.632 -6.238 1.00 0.00 H new ATOM 0 HB3 SER A 14 5.253 1.930 -7.768 1.00 0.00 H new ATOM 0 HG SER A 14 7.795 2.994 -6.953 1.00 0.00 H new ATOM 135 N ILE A 15 3.972 2.718 -4.648 1.00 0.00 N ATOM 136 CA ILE A 15 2.740 2.393 -3.949 1.00 0.00 C ATOM 137 C ILE A 15 1.888 3.644 -3.855 1.00 0.00 C ATOM 138 O ILE A 15 0.696 3.616 -4.131 1.00 0.00 O ATOM 139 CB ILE A 15 2.975 1.870 -2.518 1.00 0.00 C ATOM 140 CG1 ILE A 15 4.021 0.754 -2.486 1.00 0.00 C ATOM 141 CG2 ILE A 15 1.663 1.381 -1.927 1.00 0.00 C ATOM 142 CD1 ILE A 15 3.732 -0.395 -3.429 1.00 0.00 C ATOM 0 H ILE A 15 4.826 2.452 -4.158 1.00 0.00 H new ATOM 0 HA ILE A 15 2.251 1.602 -4.517 1.00 0.00 H new ATOM 0 HB ILE A 15 3.359 2.694 -1.918 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.995 1.177 -2.734 1.00 0.00 H new ATOM 0 HG13 ILE A 15 4.091 0.366 -1.470 1.00 0.00 H new ATOM 0 HG21 ILE A 15 1.834 1.012 -0.916 1.00 0.00 H new ATOM 0 HG22 ILE A 15 0.948 2.204 -1.897 1.00 0.00 H new ATOM 0 HG23 ILE A 15 1.264 0.576 -2.544 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.521 -1.142 -3.344 1.00 0.00 H new ATOM 0 HD12 ILE A 15 2.775 -0.847 -3.169 1.00 0.00 H new ATOM 0 HD13 ILE A 15 3.692 -0.024 -4.453 1.00 0.00 H new ATOM 154 N LEU A 16 2.532 4.745 -3.471 1.00 0.00 N ATOM 155 CA LEU A 16 1.863 6.032 -3.343 1.00 0.00 C ATOM 156 C LEU A 16 1.304 6.488 -4.686 1.00 0.00 C ATOM 157 O LEU A 16 0.221 7.067 -4.750 1.00 0.00 O ATOM 158 CB LEU A 16 2.831 7.088 -2.804 1.00 0.00 C ATOM 159 CG LEU A 16 3.369 6.830 -1.395 1.00 0.00 C ATOM 160 CD1 LEU A 16 4.382 7.897 -1.009 1.00 0.00 C ATOM 161 CD2 LEU A 16 2.230 6.791 -0.388 1.00 0.00 C ATOM 0 H LEU A 16 3.526 4.767 -3.242 1.00 0.00 H new ATOM 0 HA LEU A 16 1.038 5.912 -2.641 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.676 7.164 -3.488 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.327 8.055 -2.810 1.00 0.00 H new ATOM 0 HG LEU A 16 3.868 5.861 -1.389 1.00 0.00 H new ATOM 0 HD11 LEU A 16 4.755 7.698 -0.004 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.213 7.881 -1.714 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.905 8.877 -1.032 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.631 6.607 0.608 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.704 7.746 -0.396 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.537 5.993 -0.653 1.00 0.00 H new ATOM 173 N MET A 17 2.055 6.230 -5.758 1.00 0.00 N ATOM 174 CA MET A 17 1.628 6.622 -7.097 1.00 0.00 C ATOM 175 C MET A 17 0.231 6.090 -7.382 1.00 0.00 C ATOM 176 O MET A 17 -0.662 6.839 -7.782 1.00 0.00 O ATOM 177 CB MET A 17 2.602 6.095 -8.153 1.00 0.00 C ATOM 178 CG MET A 17 4.040 6.541 -7.951 1.00 0.00 C ATOM 179 SD MET A 17 5.154 5.855 -9.192 1.00 0.00 S ATOM 180 CE MET A 17 6.733 6.468 -8.611 1.00 0.00 C ATOM 0 H MET A 17 2.956 5.754 -5.723 1.00 0.00 H new ATOM 0 HA MET A 17 1.615 7.711 -7.143 1.00 0.00 H new ATOM 0 HB2 MET A 17 2.568 5.006 -8.151 1.00 0.00 H new ATOM 0 HB3 MET A 17 2.266 6.423 -9.137 1.00 0.00 H new ATOM 0 HG2 MET A 17 4.088 7.629 -7.986 1.00 0.00 H new ATOM 0 HG3 MET A 17 4.375 6.239 -6.959 1.00 0.00 H new ATOM 0 HE1 MET A 17 7.352 6.745 -9.464 1.00 0.00 H new ATOM 0 HE2 MET A 17 6.574 7.342 -7.979 1.00 0.00 H new ATOM 0 HE3 MET A 17 7.236 5.691 -8.035 1.00 0.00 H new ATOM 190 N ASP A 18 0.047 4.791 -7.168 1.00 0.00 N ATOM 191 CA ASP A 18 -1.251 4.163 -7.399 1.00 0.00 C ATOM 192 C ASP A 18 -2.179 4.370 -6.203 1.00 0.00 C ATOM 193 O ASP A 18 -3.402 4.367 -6.344 1.00 0.00 O ATOM 194 CB ASP A 18 -1.084 2.669 -7.680 1.00 0.00 C ATOM 195 CG ASP A 18 -2.385 2.017 -8.108 1.00 0.00 C ATOM 196 OD1 ASP A 18 -2.962 2.456 -9.125 1.00 0.00 O ATOM 197 OD2 ASP A 18 -2.827 1.067 -7.430 1.00 0.00 O ATOM 0 H ASP A 18 0.774 4.156 -6.838 1.00 0.00 H new ATOM 0 HA ASP A 18 -1.701 4.637 -8.271 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -0.336 2.529 -8.460 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -0.708 2.173 -6.785 1.00 0.00 H new ATOM 202 N MET A 19 -1.583 4.543 -5.028 1.00 0.00 N ATOM 203 CA MET A 19 -2.340 4.745 -3.795 1.00 0.00 C ATOM 204 C MET A 19 -3.157 6.034 -3.864 1.00 0.00 C ATOM 205 O MET A 19 -4.271 6.103 -3.345 1.00 0.00 O ATOM 206 CB MET A 19 -1.387 4.793 -2.593 1.00 0.00 C ATOM 207 CG MET A 19 -2.086 4.723 -1.245 1.00 0.00 C ATOM 208 SD MET A 19 -2.769 3.095 -0.888 1.00 0.00 S ATOM 209 CE MET A 19 -1.314 2.241 -0.290 1.00 0.00 C ATOM 0 H MET A 19 -0.571 4.547 -4.902 1.00 0.00 H new ATOM 0 HA MET A 19 -3.027 3.907 -3.675 1.00 0.00 H new ATOM 0 HB2 MET A 19 -0.682 3.965 -2.668 1.00 0.00 H new ATOM 0 HB3 MET A 19 -0.804 5.713 -2.641 1.00 0.00 H new ATOM 0 HG2 MET A 19 -1.379 4.994 -0.461 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.888 5.461 -1.219 1.00 0.00 H new ATOM 0 HE1 MET A 19 -1.088 1.402 -0.948 1.00 0.00 H new ATOM 0 HE2 MET A 19 -0.468 2.929 -0.276 1.00 0.00 H new ATOM 0 HE3 MET A 19 -1.498 1.872 0.719 1.00 0.00 H new ATOM 219 N PHE A 20 -2.591 7.056 -4.506 1.00 0.00 N ATOM 220 CA PHE A 20 -3.262 8.346 -4.641 1.00 0.00 C ATOM 221 C PHE A 20 -3.080 8.912 -6.049 1.00 0.00 C ATOM 222 O PHE A 20 -2.340 9.876 -6.248 1.00 0.00 O ATOM 223 CB PHE A 20 -2.723 9.345 -3.613 1.00 0.00 C ATOM 224 CG PHE A 20 -2.651 8.796 -2.218 1.00 0.00 C ATOM 225 CD1 PHE A 20 -3.793 8.691 -1.440 1.00 0.00 C ATOM 226 CD2 PHE A 20 -1.443 8.371 -1.690 1.00 0.00 C ATOM 227 CE1 PHE A 20 -3.731 8.176 -0.160 1.00 0.00 C ATOM 228 CE2 PHE A 20 -1.374 7.856 -0.410 1.00 0.00 C ATOM 229 CZ PHE A 20 -2.520 7.758 0.356 1.00 0.00 C ATOM 0 H PHE A 20 -1.669 7.014 -4.940 1.00 0.00 H new ATOM 0 HA PHE A 20 -4.325 8.187 -4.461 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -1.727 9.666 -3.919 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -3.358 10.231 -3.613 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -4.743 9.016 -1.839 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -0.545 8.443 -2.286 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -4.628 8.100 0.437 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -0.426 7.530 -0.009 1.00 0.00 H new ATOM 0 HZ PHE A 20 -2.469 7.355 1.357 1.00 0.00 H new ATOM 239 N PRO A 21 -3.752 8.315 -7.051 1.00 0.00 N ATOM 240 CA PRO A 21 -3.658 8.762 -8.444 1.00 0.00 C ATOM 241 C PRO A 21 -3.934 10.254 -8.598 1.00 0.00 C ATOM 242 O PRO A 21 -3.302 10.931 -9.411 1.00 0.00 O ATOM 243 CB PRO A 21 -4.738 7.946 -9.156 1.00 0.00 C ATOM 244 CG PRO A 21 -4.905 6.726 -8.321 1.00 0.00 C ATOM 245 CD PRO A 21 -4.656 7.157 -6.902 1.00 0.00 C ATOM 0 HA PRO A 21 -2.656 8.615 -8.848 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -5.671 8.505 -9.231 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -4.436 7.692 -10.172 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -5.907 6.311 -8.433 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -4.203 5.948 -8.621 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.582 7.432 -6.397 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -4.197 6.362 -6.315 1.00 0.00 H new ATOM 253 N ALA A 22 -4.883 10.762 -7.817 1.00 0.00 N ATOM 254 CA ALA A 22 -5.245 12.175 -7.870 1.00 0.00 C ATOM 255 C ALA A 22 -4.220 13.048 -7.147 1.00 0.00 C ATOM 256 O ALA A 22 -4.572 14.077 -6.569 1.00 0.00 O ATOM 257 CB ALA A 22 -6.629 12.385 -7.274 1.00 0.00 C ATOM 0 H ALA A 22 -5.415 10.216 -7.140 1.00 0.00 H new ATOM 0 HA ALA A 22 -5.256 12.476 -8.918 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.888 13.443 -7.319 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.360 11.808 -7.840 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.632 12.055 -6.235 1.00 0.00 H new ATOM 263 N ILE A 23 -2.954 12.639 -7.190 1.00 0.00 N ATOM 264 CA ILE A 23 -1.880 13.390 -6.544 1.00 0.00 C ATOM 265 C ILE A 23 -0.569 13.228 -7.308 1.00 0.00 C ATOM 266 O ILE A 23 -0.191 12.116 -7.681 1.00 0.00 O ATOM 267 CB ILE A 23 -1.665 12.944 -5.081 1.00 0.00 C ATOM 268 CG1 ILE A 23 -2.929 13.190 -4.251 1.00 0.00 C ATOM 269 CG2 ILE A 23 -0.477 13.680 -4.472 1.00 0.00 C ATOM 270 CD1 ILE A 23 -2.809 12.745 -2.808 1.00 0.00 C ATOM 0 H ILE A 23 -2.647 11.791 -7.666 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.183 14.437 -6.549 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.453 11.875 -5.074 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -3.167 14.253 -4.275 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -3.765 12.666 -4.715 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -0.338 13.355 -3.441 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.422 13.458 -5.047 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.665 14.754 -4.492 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.743 12.952 -2.285 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -2.602 11.675 -2.773 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -1.995 13.287 -2.326 1.00 0.00 H new ATOM 282 N SER A 24 0.121 14.342 -7.533 1.00 0.00 N ATOM 283 CA SER A 24 1.392 14.325 -8.250 1.00 0.00 C ATOM 284 C SER A 24 2.421 13.474 -7.512 1.00 0.00 C ATOM 285 O SER A 24 2.506 13.512 -6.284 1.00 0.00 O ATOM 286 CB SER A 24 1.922 15.749 -8.426 1.00 0.00 C ATOM 287 OG SER A 24 3.179 15.748 -9.082 1.00 0.00 O ATOM 0 H SER A 24 -0.179 15.268 -7.229 1.00 0.00 H new ATOM 0 HA SER A 24 1.221 13.885 -9.233 1.00 0.00 H new ATOM 0 HB2 SER A 24 1.208 16.338 -9.002 1.00 0.00 H new ATOM 0 HB3 SER A 24 2.017 16.228 -7.452 1.00 0.00 H new ATOM 0 HG SER A 24 3.868 16.077 -8.468 1.00 0.00 H new ATOM 293 N LYS A 25 3.198 12.705 -8.269 1.00 0.00 N ATOM 294 CA LYS A 25 4.220 11.842 -7.687 1.00 0.00 C ATOM 295 C LYS A 25 5.239 12.653 -6.892 1.00 0.00 C ATOM 296 O LYS A 25 5.708 12.216 -5.842 1.00 0.00 O ATOM 297 CB LYS A 25 4.931 11.039 -8.779 1.00 0.00 C ATOM 298 CG LYS A 25 5.643 11.903 -9.810 1.00 0.00 C ATOM 299 CD LYS A 25 6.464 11.070 -10.787 1.00 0.00 C ATOM 300 CE LYS A 25 7.685 10.445 -10.121 1.00 0.00 C ATOM 301 NZ LYS A 25 7.312 9.431 -9.097 1.00 0.00 N ATOM 0 H LYS A 25 3.139 12.662 -9.286 1.00 0.00 H new ATOM 0 HA LYS A 25 3.722 11.152 -7.005 1.00 0.00 H new ATOM 0 HB2 LYS A 25 5.657 10.373 -8.313 1.00 0.00 H new ATOM 0 HB3 LYS A 25 4.201 10.409 -9.288 1.00 0.00 H new ATOM 0 HG2 LYS A 25 4.908 12.488 -10.362 1.00 0.00 H new ATOM 0 HG3 LYS A 25 6.296 12.611 -9.300 1.00 0.00 H new ATOM 0 HD2 LYS A 25 5.838 10.283 -11.207 1.00 0.00 H new ATOM 0 HD3 LYS A 25 6.786 11.698 -11.617 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.311 9.978 -10.881 1.00 0.00 H new ATOM 0 HE3 LYS A 25 8.282 11.228 -9.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 7.983 8.637 -9.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 7.341 9.865 -8.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 6.351 9.081 -9.288 1.00 0.00 H new ATOM 315 N SER A 26 5.582 13.834 -7.404 1.00 0.00 N ATOM 316 CA SER A 26 6.549 14.704 -6.744 1.00 0.00 C ATOM 317 C SER A 26 6.144 14.972 -5.298 1.00 0.00 C ATOM 318 O SER A 26 6.967 14.882 -4.385 1.00 0.00 O ATOM 319 CB SER A 26 6.678 16.027 -7.504 1.00 0.00 C ATOM 320 OG SER A 26 5.435 16.705 -7.560 1.00 0.00 O ATOM 0 H SER A 26 5.204 14.209 -8.274 1.00 0.00 H new ATOM 0 HA SER A 26 7.514 14.197 -6.743 1.00 0.00 H new ATOM 0 HB2 SER A 26 7.419 16.660 -7.016 1.00 0.00 H new ATOM 0 HB3 SER A 26 7.038 15.836 -8.515 1.00 0.00 H new ATOM 0 HG SER A 26 5.544 17.547 -8.049 1.00 0.00 H new ATOM 326 N LYS A 27 4.870 15.295 -5.094 1.00 0.00 N ATOM 327 CA LYS A 27 4.358 15.568 -3.758 1.00 0.00 C ATOM 328 C LYS A 27 4.545 14.353 -2.856 1.00 0.00 C ATOM 329 O LYS A 27 5.024 14.473 -1.728 1.00 0.00 O ATOM 330 CB LYS A 27 2.879 15.950 -3.830 1.00 0.00 C ATOM 331 CG LYS A 27 2.251 16.221 -2.472 1.00 0.00 C ATOM 332 CD LYS A 27 0.793 16.634 -2.606 1.00 0.00 C ATOM 333 CE LYS A 27 0.654 17.969 -3.322 1.00 0.00 C ATOM 334 NZ LYS A 27 -0.770 18.385 -3.453 1.00 0.00 N ATOM 0 H LYS A 27 4.175 15.374 -5.837 1.00 0.00 H new ATOM 0 HA LYS A 27 4.918 16.402 -3.335 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.772 16.838 -4.454 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.329 15.147 -4.321 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.322 15.327 -1.852 1.00 0.00 H new ATOM 0 HG3 LYS A 27 2.808 17.007 -1.963 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.246 15.867 -3.155 1.00 0.00 H new ATOM 0 HD3 LYS A 27 0.341 16.702 -1.617 1.00 0.00 H new ATOM 0 HE2 LYS A 27 1.206 18.733 -2.775 1.00 0.00 H new ATOM 0 HE3 LYS A 27 1.104 17.898 -4.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -0.821 19.299 -3.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -1.292 17.669 -3.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -1.193 18.478 -2.507 1.00 0.00 H new ATOM 348 N LEU A 28 4.173 13.183 -3.367 1.00 0.00 N ATOM 349 CA LEU A 28 4.306 11.942 -2.615 1.00 0.00 C ATOM 350 C LEU A 28 5.758 11.714 -2.209 1.00 0.00 C ATOM 351 O LEU A 28 6.037 11.250 -1.104 1.00 0.00 O ATOM 352 CB LEU A 28 3.789 10.764 -3.443 1.00 0.00 C ATOM 353 CG LEU A 28 2.284 10.790 -3.726 1.00 0.00 C ATOM 354 CD1 LEU A 28 1.911 9.736 -4.757 1.00 0.00 C ATOM 355 CD2 LEU A 28 1.502 10.578 -2.440 1.00 0.00 C ATOM 0 H LEU A 28 3.777 13.070 -4.300 1.00 0.00 H new ATOM 0 HA LEU A 28 3.706 12.020 -1.708 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.323 10.744 -4.393 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.031 9.838 -2.922 1.00 0.00 H new ATOM 0 HG LEU A 28 2.027 11.768 -4.132 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.838 9.772 -4.943 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.447 9.930 -5.686 1.00 0.00 H new ATOM 0 HD13 LEU A 28 2.181 8.749 -4.382 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.434 10.599 -2.656 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.766 9.613 -2.008 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.744 11.370 -1.732 1.00 0.00 H new ATOM 367 N GLN A 29 6.678 12.056 -3.107 1.00 0.00 N ATOM 368 CA GLN A 29 8.103 11.905 -2.838 1.00 0.00 C ATOM 369 C GLN A 29 8.518 12.790 -1.666 1.00 0.00 C ATOM 370 O GLN A 29 9.266 12.363 -0.789 1.00 0.00 O ATOM 371 CB GLN A 29 8.919 12.264 -4.082 1.00 0.00 C ATOM 372 CG GLN A 29 10.418 12.096 -3.899 1.00 0.00 C ATOM 373 CD GLN A 29 11.215 12.445 -5.145 1.00 0.00 C ATOM 374 OE1 GLN A 29 12.443 12.364 -5.148 1.00 0.00 O ATOM 375 NE2 GLN A 29 10.524 12.833 -6.215 1.00 0.00 N ATOM 0 H GLN A 29 6.461 12.439 -4.027 1.00 0.00 H new ATOM 0 HA GLN A 29 8.298 10.865 -2.578 1.00 0.00 H new ATOM 0 HB2 GLN A 29 8.591 11.640 -4.913 1.00 0.00 H new ATOM 0 HB3 GLN A 29 8.709 13.298 -4.357 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.750 12.727 -3.074 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.630 11.065 -3.617 1.00 0.00 H new ATOM 0 HE21 GLN A 29 9.506 12.887 -6.173 1.00 0.00 H new ATOM 0 HE22 GLN A 29 11.012 13.076 -7.077 1.00 0.00 H new ATOM 384 N VAL A 30 8.018 14.025 -1.659 1.00 0.00 N ATOM 385 CA VAL A 30 8.328 14.972 -0.592 1.00 0.00 C ATOM 386 C VAL A 30 7.893 14.427 0.766 1.00 0.00 C ATOM 387 O VAL A 30 8.682 14.386 1.711 1.00 0.00 O ATOM 388 CB VAL A 30 7.640 16.332 -0.834 1.00 0.00 C ATOM 389 CG1 VAL A 30 7.962 17.310 0.287 1.00 0.00 C ATOM 390 CG2 VAL A 30 8.051 16.905 -2.182 1.00 0.00 C ATOM 0 H VAL A 30 7.397 14.392 -2.380 1.00 0.00 H new ATOM 0 HA VAL A 30 9.409 15.115 -0.594 1.00 0.00 H new ATOM 0 HB VAL A 30 6.562 16.172 -0.842 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.466 18.261 0.094 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.612 16.904 1.236 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.040 17.466 0.335 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.556 17.864 -2.336 1.00 0.00 H new ATOM 0 HG22 VAL A 30 9.132 17.047 -2.203 1.00 0.00 H new ATOM 0 HG23 VAL A 30 7.760 16.215 -2.974 1.00 0.00 H new ATOM 400 N HIS A 31 6.634 14.001 0.853 1.00 0.00 N ATOM 401 CA HIS A 31 6.096 13.450 2.093 1.00 0.00 C ATOM 402 C HIS A 31 6.888 12.221 2.521 1.00 0.00 C ATOM 403 O HIS A 31 7.188 12.040 3.701 1.00 0.00 O ATOM 404 CB HIS A 31 4.621 13.077 1.921 1.00 0.00 C ATOM 405 CG HIS A 31 3.743 14.230 1.548 1.00 0.00 C ATOM 406 ND1 HIS A 31 3.601 15.357 2.331 1.00 0.00 N ATOM 407 CD2 HIS A 31 2.951 14.425 0.467 1.00 0.00 C ATOM 408 CE1 HIS A 31 2.759 16.192 1.749 1.00 0.00 C ATOM 409 NE2 HIS A 31 2.352 15.651 0.617 1.00 0.00 N ATOM 0 H HIS A 31 5.969 14.027 0.080 1.00 0.00 H new ATOM 0 HA HIS A 31 6.181 14.214 2.866 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.538 12.307 1.154 1.00 0.00 H new ATOM 0 HB3 HIS A 31 4.256 12.641 2.851 1.00 0.00 H new ATOM 0 HD1 HIS A 31 4.073 15.520 3.221 1.00 0.00 H new ATOM 0 HD2 HIS A 31 2.816 13.743 -0.359 1.00 0.00 H new ATOM 0 HE1 HIS A 31 2.455 17.154 2.135 1.00 0.00 H new ATOM 418 N LEU A 32 7.220 11.379 1.550 1.00 0.00 N ATOM 419 CA LEU A 32 7.973 10.161 1.814 1.00 0.00 C ATOM 420 C LEU A 32 9.320 10.477 2.458 1.00 0.00 C ATOM 421 O LEU A 32 9.703 9.857 3.446 1.00 0.00 O ATOM 422 CB LEU A 32 8.187 9.383 0.511 1.00 0.00 C ATOM 423 CG LEU A 32 8.921 8.049 0.657 1.00 0.00 C ATOM 424 CD1 LEU A 32 8.102 7.075 1.493 1.00 0.00 C ATOM 425 CD2 LEU A 32 9.222 7.457 -0.711 1.00 0.00 C ATOM 0 H LEU A 32 6.978 11.519 0.569 1.00 0.00 H new ATOM 0 HA LEU A 32 7.397 9.550 2.509 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.215 9.195 0.056 1.00 0.00 H new ATOM 0 HB3 LEU A 32 8.747 10.013 -0.181 1.00 0.00 H new ATOM 0 HG LEU A 32 9.865 8.230 1.171 1.00 0.00 H new ATOM 0 HD11 LEU A 32 8.641 6.132 1.585 1.00 0.00 H new ATOM 0 HD12 LEU A 32 7.936 7.497 2.484 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.142 6.898 1.009 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.744 6.508 -0.590 1.00 0.00 H new ATOM 0 HD22 LEU A 32 8.289 7.291 -1.249 1.00 0.00 H new ATOM 0 HD23 LEU A 32 9.849 8.147 -1.276 1.00 0.00 H new ATOM 437 N LEU A 33 10.033 11.445 1.891 1.00 0.00 N ATOM 438 CA LEU A 33 11.341 11.840 2.408 1.00 0.00 C ATOM 439 C LEU A 33 11.251 12.350 3.843 1.00 0.00 C ATOM 440 O LEU A 33 12.058 11.978 4.695 1.00 0.00 O ATOM 441 CB LEU A 33 11.963 12.921 1.520 1.00 0.00 C ATOM 442 CG LEU A 33 12.271 12.496 0.083 1.00 0.00 C ATOM 443 CD1 LEU A 33 12.827 13.670 -0.708 1.00 0.00 C ATOM 444 CD2 LEU A 33 13.252 11.333 0.069 1.00 0.00 C ATOM 0 H LEU A 33 9.728 11.972 1.073 1.00 0.00 H new ATOM 0 HA LEU A 33 11.973 10.952 2.400 1.00 0.00 H new ATOM 0 HB2 LEU A 33 11.287 13.776 1.491 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.888 13.262 1.986 1.00 0.00 H new ATOM 0 HG LEU A 33 11.344 12.169 -0.387 1.00 0.00 H new ATOM 0 HD11 LEU A 33 13.041 13.352 -1.728 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.094 14.477 -0.725 1.00 0.00 H new ATOM 0 HD13 LEU A 33 13.745 14.024 -0.238 1.00 0.00 H new ATOM 0 HD21 LEU A 33 13.459 11.044 -0.961 1.00 0.00 H new ATOM 0 HD22 LEU A 33 14.180 11.634 0.555 1.00 0.00 H new ATOM 0 HD23 LEU A 33 12.820 10.487 0.603 1.00 0.00 H new ATOM 456 N GLU A 34 10.278 13.219 4.100 1.00 0.00 N ATOM 457 CA GLU A 34 10.100 13.798 5.429 1.00 0.00 C ATOM 458 C GLU A 34 9.779 12.735 6.478 1.00 0.00 C ATOM 459 O GLU A 34 10.341 12.747 7.574 1.00 0.00 O ATOM 460 CB GLU A 34 8.992 14.850 5.403 1.00 0.00 C ATOM 461 CG GLU A 34 9.270 16.003 4.454 1.00 0.00 C ATOM 462 CD GLU A 34 8.159 17.034 4.445 1.00 0.00 C ATOM 463 OE1 GLU A 34 7.012 16.668 4.110 1.00 0.00 O ATOM 464 OE2 GLU A 34 8.434 18.206 4.776 1.00 0.00 O ATOM 0 H GLU A 34 9.601 13.538 3.407 1.00 0.00 H new ATOM 0 HA GLU A 34 11.044 14.267 5.708 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.055 14.372 5.116 1.00 0.00 H new ATOM 0 HB3 GLU A 34 8.853 15.244 6.410 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.205 16.485 4.739 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.407 15.613 3.445 1.00 0.00 H new ATOM 471 N ASN A 35 8.861 11.833 6.151 1.00 0.00 N ATOM 472 CA ASN A 35 8.457 10.783 7.083 1.00 0.00 C ATOM 473 C ASN A 35 9.457 9.626 7.120 1.00 0.00 C ATOM 474 O ASN A 35 9.069 8.469 7.284 1.00 0.00 O ATOM 475 CB ASN A 35 7.066 10.264 6.717 1.00 0.00 C ATOM 476 CG ASN A 35 6.010 11.349 6.797 1.00 0.00 C ATOM 477 OD1 ASN A 35 5.795 11.944 7.853 1.00 0.00 O ATOM 478 ND2 ASN A 35 5.346 11.615 5.678 1.00 0.00 N ATOM 0 H ASN A 35 8.383 11.806 5.251 1.00 0.00 H new ATOM 0 HA ASN A 35 8.433 11.224 8.080 1.00 0.00 H new ATOM 0 HB2 ASN A 35 7.087 9.854 5.707 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.797 9.447 7.387 1.00 0.00 H new ATOM 0 HD21 ASN A 35 4.626 12.337 5.672 1.00 0.00 H new ATOM 0 HD22 ASN A 35 5.557 11.097 4.825 1.00 0.00 H new ATOM 485 N ASN A 36 10.741 9.947 6.986 1.00 0.00 N ATOM 486 CA ASN A 36 11.799 8.937 7.021 1.00 0.00 C ATOM 487 C ASN A 36 11.471 7.742 6.127 1.00 0.00 C ATOM 488 O ASN A 36 11.747 6.595 6.480 1.00 0.00 O ATOM 489 CB ASN A 36 12.029 8.465 8.459 1.00 0.00 C ATOM 490 CG ASN A 36 12.475 9.589 9.372 1.00 0.00 C ATOM 491 OD1 ASN A 36 11.776 10.588 9.534 1.00 0.00 O ATOM 492 ND2 ASN A 36 13.647 9.429 9.974 1.00 0.00 N ATOM 0 H ASN A 36 11.076 10.901 6.852 1.00 0.00 H new ATOM 0 HA ASN A 36 12.709 9.399 6.639 1.00 0.00 H new ATOM 0 HB2 ASN A 36 11.108 8.029 8.847 1.00 0.00 H new ATOM 0 HB3 ASN A 36 12.782 7.677 8.464 1.00 0.00 H new ATOM 0 HD21 ASN A 36 14.001 10.152 10.601 1.00 0.00 H new ATOM 0 HD22 ASN A 36 14.193 8.583 9.810 1.00 0.00 H new ATOM 499 N ASN A 37 10.889 8.023 4.966 1.00 0.00 N ATOM 500 CA ASN A 37 10.524 6.980 4.008 1.00 0.00 C ATOM 501 C ASN A 37 9.598 5.938 4.635 1.00 0.00 C ATOM 502 O ASN A 37 9.750 4.739 4.398 1.00 0.00 O ATOM 503 CB ASN A 37 11.782 6.299 3.458 1.00 0.00 C ATOM 504 CG ASN A 37 12.694 7.252 2.701 1.00 0.00 C ATOM 505 OD1 ASN A 37 13.749 6.851 2.210 1.00 0.00 O ATOM 506 ND2 ASN A 37 12.295 8.516 2.597 1.00 0.00 N ATOM 0 H ASN A 37 10.658 8.969 4.663 1.00 0.00 H new ATOM 0 HA ASN A 37 9.986 7.458 3.190 1.00 0.00 H new ATOM 0 HB2 ASN A 37 12.337 5.853 4.284 1.00 0.00 H new ATOM 0 HB3 ASN A 37 11.487 5.485 2.796 1.00 0.00 H new ATOM 0 HD21 ASN A 37 12.870 9.193 2.096 1.00 0.00 H new ATOM 0 HD22 ASN A 37 11.413 8.809 3.018 1.00 0.00 H new ATOM 513 N ASP A 38 8.634 6.399 5.428 1.00 0.00 N ATOM 514 CA ASP A 38 7.682 5.498 6.075 1.00 0.00 C ATOM 515 C ASP A 38 6.322 5.555 5.386 1.00 0.00 C ATOM 516 O ASP A 38 5.774 6.634 5.160 1.00 0.00 O ATOM 517 CB ASP A 38 7.530 5.850 7.558 1.00 0.00 C ATOM 518 CG ASP A 38 8.818 5.664 8.337 1.00 0.00 C ATOM 519 OD1 ASP A 38 9.826 5.244 7.729 1.00 0.00 O ATOM 520 OD2 ASP A 38 8.819 5.936 9.556 1.00 0.00 O ATOM 0 H ASP A 38 8.491 7.387 5.638 1.00 0.00 H new ATOM 0 HA ASP A 38 8.072 4.484 5.990 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.200 6.885 7.650 1.00 0.00 H new ATOM 0 HB3 ASP A 38 6.751 5.227 7.997 1.00 0.00 H new ATOM 525 N LEU A 39 5.782 4.385 5.052 1.00 0.00 N ATOM 526 CA LEU A 39 4.485 4.298 4.386 1.00 0.00 C ATOM 527 C LEU A 39 3.332 4.472 5.371 1.00 0.00 C ATOM 528 O LEU A 39 2.370 5.181 5.089 1.00 0.00 O ATOM 529 CB LEU A 39 4.344 2.955 3.666 1.00 0.00 C ATOM 530 CG LEU A 39 5.183 2.804 2.396 1.00 0.00 C ATOM 531 CD1 LEU A 39 5.061 1.391 1.845 1.00 0.00 C ATOM 532 CD2 LEU A 39 4.748 3.819 1.349 1.00 0.00 C ATOM 0 H LEU A 39 6.223 3.483 5.232 1.00 0.00 H new ATOM 0 HA LEU A 39 4.438 5.109 3.659 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.617 2.159 4.359 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.295 2.808 3.409 1.00 0.00 H new ATOM 0 HG LEU A 39 6.227 2.990 2.647 1.00 0.00 H new ATOM 0 HD11 LEU A 39 5.664 1.300 0.941 1.00 0.00 H new ATOM 0 HD12 LEU A 39 5.414 0.678 2.590 1.00 0.00 H new ATOM 0 HD13 LEU A 39 4.018 1.182 1.608 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.355 3.699 0.451 1.00 0.00 H new ATOM 0 HD22 LEU A 39 3.698 3.660 1.102 1.00 0.00 H new ATOM 0 HD23 LEU A 39 4.879 4.827 1.743 1.00 0.00 H new ATOM 544 N ASP A 40 3.424 3.805 6.514 1.00 0.00 N ATOM 545 CA ASP A 40 2.376 3.875 7.528 1.00 0.00 C ATOM 546 C ASP A 40 2.080 5.317 7.934 1.00 0.00 C ATOM 547 O ASP A 40 0.919 5.726 7.994 1.00 0.00 O ATOM 548 CB ASP A 40 2.782 3.061 8.759 1.00 0.00 C ATOM 549 CG ASP A 40 1.692 3.003 9.814 1.00 0.00 C ATOM 550 OD1 ASP A 40 0.600 3.562 9.576 1.00 0.00 O ATOM 551 OD2 ASP A 40 1.929 2.394 10.878 1.00 0.00 O ATOM 0 H ASP A 40 4.213 3.209 6.764 1.00 0.00 H new ATOM 0 HA ASP A 40 1.468 3.455 7.096 1.00 0.00 H new ATOM 0 HB2 ASP A 40 3.036 2.047 8.450 1.00 0.00 H new ATOM 0 HB3 ASP A 40 3.681 3.496 9.196 1.00 0.00 H new ATOM 556 N LEU A 41 3.128 6.079 8.228 1.00 0.00 N ATOM 557 CA LEU A 41 2.967 7.469 8.646 1.00 0.00 C ATOM 558 C LEU A 41 2.491 8.340 7.483 1.00 0.00 C ATOM 559 O LEU A 41 1.430 8.972 7.559 1.00 0.00 O ATOM 560 CB LEU A 41 4.295 8.002 9.199 1.00 0.00 C ATOM 561 CG LEU A 41 4.193 9.225 10.119 1.00 0.00 C ATOM 562 CD1 LEU A 41 5.555 9.556 10.709 1.00 0.00 C ATOM 563 CD2 LEU A 41 3.636 10.430 9.375 1.00 0.00 C ATOM 0 H LEU A 41 4.096 5.760 8.185 1.00 0.00 H new ATOM 0 HA LEU A 41 2.209 7.509 9.429 1.00 0.00 H new ATOM 0 HB2 LEU A 41 4.787 7.199 9.747 1.00 0.00 H new ATOM 0 HB3 LEU A 41 4.941 8.256 8.359 1.00 0.00 H new ATOM 0 HG LEU A 41 3.505 8.980 10.928 1.00 0.00 H new ATOM 0 HD11 LEU A 41 5.468 10.426 11.360 1.00 0.00 H new ATOM 0 HD12 LEU A 41 5.918 8.706 11.286 1.00 0.00 H new ATOM 0 HD13 LEU A 41 6.257 9.774 9.904 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.576 11.281 10.054 1.00 0.00 H new ATOM 0 HD22 LEU A 41 4.292 10.677 8.540 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.641 10.196 8.997 1.00 0.00 H new ATOM 575 N THR A 42 3.280 8.373 6.411 1.00 0.00 N ATOM 576 CA THR A 42 2.944 9.172 5.237 1.00 0.00 C ATOM 577 C THR A 42 1.527 8.880 4.770 1.00 0.00 C ATOM 578 O THR A 42 0.675 9.767 4.744 1.00 0.00 O ATOM 579 CB THR A 42 3.919 8.902 4.075 1.00 0.00 C ATOM 580 OG1 THR A 42 5.264 9.155 4.492 1.00 0.00 O ATOM 581 CG2 THR A 42 3.587 9.773 2.871 1.00 0.00 C ATOM 0 H THR A 42 4.156 7.856 6.332 1.00 0.00 H new ATOM 0 HA THR A 42 3.023 10.219 5.531 1.00 0.00 H new ATOM 0 HB THR A 42 3.818 7.856 3.786 1.00 0.00 H new ATOM 0 HG1 THR A 42 5.679 8.317 4.783 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.290 9.563 2.065 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.573 9.557 2.534 1.00 0.00 H new ATOM 0 HG23 THR A 42 3.660 10.824 3.151 1.00 0.00 H new ATOM 589 N ILE A 43 1.277 7.627 4.412 1.00 0.00 N ATOM 590 CA ILE A 43 -0.040 7.213 3.954 1.00 0.00 C ATOM 591 C ILE A 43 -1.094 7.469 5.028 1.00 0.00 C ATOM 592 O ILE A 43 -2.230 7.830 4.717 1.00 0.00 O ATOM 593 CB ILE A 43 -0.061 5.724 3.562 1.00 0.00 C ATOM 594 CG1 ILE A 43 0.922 5.464 2.417 1.00 0.00 C ATOM 595 CG2 ILE A 43 -1.467 5.301 3.171 1.00 0.00 C ATOM 596 CD1 ILE A 43 0.987 4.014 1.983 1.00 0.00 C ATOM 0 H ILE A 43 1.971 6.880 4.431 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.273 7.808 3.071 1.00 0.00 H new ATOM 0 HB ILE A 43 0.248 5.130 4.422 1.00 0.00 H new ATOM 0 HG12 ILE A 43 0.639 6.077 1.561 1.00 0.00 H new ATOM 0 HG13 ILE A 43 1.917 5.786 2.725 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.466 4.246 2.896 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.141 5.456 4.013 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -1.803 5.897 2.322 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.704 3.910 1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 43 1.301 3.396 2.824 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.003 3.691 1.643 1.00 0.00 H new ATOM 608 N GLY A 44 -0.711 7.280 6.289 1.00 0.00 N ATOM 609 CA GLY A 44 -1.637 7.495 7.387 1.00 0.00 C ATOM 610 C GLY A 44 -2.320 8.846 7.310 1.00 0.00 C ATOM 611 O GLY A 44 -3.547 8.931 7.374 1.00 0.00 O ATOM 0 H GLY A 44 0.223 6.982 6.569 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -2.392 6.708 7.382 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.100 7.415 8.332 1.00 0.00 H new ATOM 615 N LEU A 45 -1.530 9.906 7.167 1.00 0.00 N ATOM 616 CA LEU A 45 -2.080 11.258 7.072 1.00 0.00 C ATOM 617 C LEU A 45 -2.741 11.487 5.715 1.00 0.00 C ATOM 618 O LEU A 45 -3.792 12.124 5.628 1.00 0.00 O ATOM 619 CB LEU A 45 -0.990 12.310 7.307 1.00 0.00 C ATOM 620 CG LEU A 45 -0.496 12.437 8.754 1.00 0.00 C ATOM 621 CD1 LEU A 45 0.172 11.152 9.217 1.00 0.00 C ATOM 622 CD2 LEU A 45 0.459 13.614 8.888 1.00 0.00 C ATOM 0 H LEU A 45 -0.512 9.858 7.114 1.00 0.00 H new ATOM 0 HA LEU A 45 -2.838 11.360 7.849 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.138 12.073 6.670 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.370 13.280 6.985 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.361 12.616 9.393 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.513 11.269 10.246 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.542 10.331 9.163 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.025 10.934 8.575 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.800 13.690 9.920 1.00 0.00 H new ATOM 0 HD22 LEU A 45 1.317 13.463 8.233 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.055 14.533 8.607 1.00 0.00 H new ATOM 634 N LEU A 46 -2.117 10.967 4.659 1.00 0.00 N ATOM 635 CA LEU A 46 -2.643 11.117 3.304 1.00 0.00 C ATOM 636 C LEU A 46 -4.108 10.695 3.219 1.00 0.00 C ATOM 637 O LEU A 46 -4.917 11.371 2.586 1.00 0.00 O ATOM 638 CB LEU A 46 -1.806 10.301 2.315 1.00 0.00 C ATOM 639 CG LEU A 46 -0.683 11.066 1.605 1.00 0.00 C ATOM 640 CD1 LEU A 46 -1.262 12.137 0.696 1.00 0.00 C ATOM 641 CD2 LEU A 46 0.275 11.686 2.612 1.00 0.00 C ATOM 0 H LEU A 46 -1.247 10.438 4.716 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.582 12.173 3.043 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.366 9.459 2.848 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.473 9.886 1.559 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.123 10.356 0.996 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.451 12.670 0.200 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.902 11.671 -0.053 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -1.849 12.839 1.289 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.062 12.223 2.083 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -0.269 12.380 3.253 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.719 10.900 3.223 1.00 0.00 H new ATOM 653 N LEU A 47 -4.448 9.577 3.858 1.00 0.00 N ATOM 654 CA LEU A 47 -5.823 9.085 3.843 1.00 0.00 C ATOM 655 C LEU A 47 -6.767 10.104 4.472 1.00 0.00 C ATOM 656 O LEU A 47 -7.811 10.431 3.908 1.00 0.00 O ATOM 657 CB LEU A 47 -5.930 7.756 4.594 1.00 0.00 C ATOM 658 CG LEU A 47 -5.054 6.628 4.049 1.00 0.00 C ATOM 659 CD1 LEU A 47 -5.281 5.348 4.837 1.00 0.00 C ATOM 660 CD2 LEU A 47 -5.330 6.402 2.569 1.00 0.00 C ATOM 0 H LEU A 47 -3.796 8.999 4.388 1.00 0.00 H new ATOM 0 HA LEU A 47 -6.110 8.929 2.803 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -5.668 7.925 5.639 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -6.970 7.429 4.575 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.010 6.920 4.161 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.649 4.556 4.435 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.030 5.516 5.884 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -6.327 5.053 4.758 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.697 5.595 2.200 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -6.377 6.133 2.431 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.114 7.315 2.015 1.00 0.00 H new ATOM 672 N LYS A 48 -6.391 10.599 5.649 1.00 0.00 N ATOM 673 CA LYS A 48 -7.199 11.579 6.366 1.00 0.00 C ATOM 674 C LYS A 48 -6.866 13.004 5.926 1.00 0.00 C ATOM 675 O LYS A 48 -6.903 13.936 6.730 1.00 0.00 O ATOM 676 CB LYS A 48 -6.982 11.438 7.874 1.00 0.00 C ATOM 677 CG LYS A 48 -5.545 11.685 8.309 1.00 0.00 C ATOM 678 CD LYS A 48 -5.381 11.560 9.818 1.00 0.00 C ATOM 679 CE LYS A 48 -6.131 12.658 10.561 1.00 0.00 C ATOM 680 NZ LYS A 48 -5.936 12.563 12.034 1.00 0.00 N ATOM 0 H LYS A 48 -5.529 10.336 6.127 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.246 11.386 6.130 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.635 12.139 8.394 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -7.279 10.436 8.183 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.887 10.972 7.812 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -5.235 12.680 7.991 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.746 10.586 10.144 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.322 11.606 10.074 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.789 13.632 10.211 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -7.194 12.592 10.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.462 13.327 12.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -6.285 11.644 12.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.924 12.652 12.257 1.00 0.00 H new ATOM 694 N GLU A 49 -6.543 13.168 4.648 1.00 0.00 N ATOM 695 CA GLU A 49 -6.207 14.483 4.111 1.00 0.00 C ATOM 696 C GLU A 49 -7.442 15.373 4.027 1.00 0.00 C ATOM 697 O GLU A 49 -7.430 16.516 4.483 1.00 0.00 O ATOM 698 CB GLU A 49 -5.570 14.345 2.727 1.00 0.00 C ATOM 699 CG GLU A 49 -5.203 15.676 2.087 1.00 0.00 C ATOM 700 CD GLU A 49 -4.234 16.482 2.930 1.00 0.00 C ATOM 701 OE1 GLU A 49 -3.116 15.988 3.187 1.00 0.00 O ATOM 702 OE2 GLU A 49 -4.593 17.609 3.332 1.00 0.00 O ATOM 0 H GLU A 49 -6.506 12.410 3.966 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.492 14.950 4.789 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.673 13.732 2.809 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.260 13.814 2.071 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.762 15.494 1.107 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.110 16.259 1.925 1.00 0.00 H new ATOM 709 N ASN A 50 -8.505 14.840 3.434 1.00 0.00 N ATOM 710 CA ASN A 50 -9.750 15.583 3.278 1.00 0.00 C ATOM 711 C ASN A 50 -10.576 15.557 4.563 1.00 0.00 C ATOM 712 O ASN A 50 -11.773 15.270 4.536 1.00 0.00 O ATOM 713 CB ASN A 50 -10.565 15.004 2.119 1.00 0.00 C ATOM 714 CG ASN A 50 -9.791 15.004 0.815 1.00 0.00 C ATOM 715 OD1 ASN A 50 -8.740 14.374 0.703 1.00 0.00 O ATOM 716 ND2 ASN A 50 -10.309 15.715 -0.180 1.00 0.00 N ATOM 0 H ASN A 50 -8.529 13.894 3.053 1.00 0.00 H new ATOM 0 HA ASN A 50 -9.498 16.621 3.059 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -10.864 13.984 2.362 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -11.480 15.583 1.996 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.833 15.754 -1.081 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -11.183 16.222 -0.043 1.00 0.00 H new ATOM 723 N ASP A 51 -9.932 15.860 5.688 1.00 0.00 N ATOM 724 CA ASP A 51 -10.614 15.872 6.979 1.00 0.00 C ATOM 725 C ASP A 51 -11.738 16.904 6.991 1.00 0.00 C ATOM 726 O ASP A 51 -11.555 18.041 6.554 1.00 0.00 O ATOM 727 CB ASP A 51 -9.622 16.168 8.105 1.00 0.00 C ATOM 728 CG ASP A 51 -8.948 17.518 7.948 1.00 0.00 C ATOM 729 OD1 ASP A 51 -8.261 17.723 6.925 1.00 0.00 O ATOM 730 OD2 ASP A 51 -9.110 18.370 8.846 1.00 0.00 O ATOM 0 H ASP A 51 -8.942 16.100 5.731 1.00 0.00 H new ATOM 0 HA ASP A 51 -11.048 14.885 7.140 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -10.143 16.135 9.062 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -8.862 15.387 8.129 1.00 0.00 H new ATOM 735 N ASP A 52 -12.902 16.500 7.493 1.00 0.00 N ATOM 736 CA ASP A 52 -14.057 17.388 7.563 1.00 0.00 C ATOM 737 C ASP A 52 -13.777 18.576 8.476 1.00 0.00 C ATOM 738 O ASP A 52 -13.233 18.416 9.570 1.00 0.00 O ATOM 739 CB ASP A 52 -15.285 16.624 8.062 1.00 0.00 C ATOM 740 CG ASP A 52 -16.517 17.504 8.153 1.00 0.00 C ATOM 741 OD1 ASP A 52 -16.925 18.063 7.113 1.00 0.00 O ATOM 742 OD2 ASP A 52 -17.075 17.631 9.263 1.00 0.00 O ATOM 0 H ASP A 52 -13.070 15.562 7.857 1.00 0.00 H new ATOM 0 HA ASP A 52 -14.255 17.764 6.559 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.487 15.789 7.391 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -15.072 16.200 9.043 1.00 0.00 H new ATOM 747 N LYS A 53 -14.152 19.768 8.022 1.00 0.00 N ATOM 748 CA LYS A 53 -13.943 20.984 8.799 1.00 0.00 C ATOM 749 C LYS A 53 -14.745 20.951 10.095 1.00 0.00 C ATOM 750 O LYS A 53 -15.931 20.618 10.095 1.00 0.00 O ATOM 751 CB LYS A 53 -14.333 22.215 7.978 1.00 0.00 C ATOM 752 CG LYS A 53 -13.480 22.412 6.733 1.00 0.00 C ATOM 753 CD LYS A 53 -13.840 23.699 6.003 1.00 0.00 C ATOM 754 CE LYS A 53 -13.616 24.924 6.878 1.00 0.00 C ATOM 755 NZ LYS A 53 -12.208 25.020 7.349 1.00 0.00 N ATOM 0 H LYS A 53 -14.603 19.917 7.119 1.00 0.00 H new ATOM 0 HA LYS A 53 -12.884 21.043 9.050 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -15.378 22.128 7.682 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -14.253 23.101 8.607 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -12.427 22.435 7.013 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -13.613 21.563 6.062 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -13.239 23.784 5.097 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -14.884 23.661 5.691 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -13.873 25.823 6.317 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -14.284 24.883 7.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -12.045 25.959 7.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -12.031 24.287 8.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -11.563 24.881 6.545 1.00 0.00 H new ATOM 769 N SER A 54 -14.090 21.301 11.198 1.00 0.00 N ATOM 770 CA SER A 54 -14.741 21.314 12.503 1.00 0.00 C ATOM 771 C SER A 54 -15.821 22.390 12.559 1.00 0.00 C ATOM 772 O SER A 54 -15.462 23.586 12.567 1.00 0.00 O ATOM 773 CB SER A 54 -13.709 21.550 13.607 1.00 0.00 C ATOM 774 OG SER A 54 -12.760 20.497 13.652 1.00 0.00 O ATOM 775 OXT SER A 54 -17.014 22.027 12.596 1.00 0.00 O ATOM 0 H SER A 54 -13.109 21.579 11.214 1.00 0.00 H new ATOM 0 HA SER A 54 -15.212 20.344 12.659 1.00 0.00 H new ATOM 0 HB2 SER A 54 -13.198 22.497 13.435 1.00 0.00 H new ATOM 0 HB3 SER A 54 -14.214 21.630 14.570 1.00 0.00 H new ATOM 0 HG SER A 54 -12.110 20.672 14.365 1.00 0.00 H new TER 781 SER A 54 ATOM 782 N MET B 1 -17.382 -11.786 -10.081 1.00 0.00 N ATOM 783 CA MET B 1 -16.553 -10.556 -10.178 1.00 0.00 C ATOM 784 C MET B 1 -15.239 -10.707 -9.418 1.00 0.00 C ATOM 785 O MET B 1 -15.213 -11.204 -8.293 1.00 0.00 O ATOM 786 CB MET B 1 -17.351 -9.382 -9.610 1.00 0.00 C ATOM 787 CG MET B 1 -16.595 -8.063 -9.640 1.00 0.00 C ATOM 788 SD MET B 1 -17.504 -6.727 -8.843 1.00 0.00 S ATOM 789 CE MET B 1 -16.387 -5.349 -9.096 1.00 0.00 C ATOM 0 H1 MET B 1 -18.268 -11.650 -10.608 1.00 0.00 H new ATOM 0 H2 MET B 1 -16.859 -12.590 -10.484 1.00 0.00 H new ATOM 0 H3 MET B 1 -17.600 -11.980 -9.083 1.00 0.00 H new ATOM 0 HA MET B 1 -16.309 -10.378 -11.225 1.00 0.00 H new ATOM 0 HB2 MET B 1 -18.276 -9.274 -10.176 1.00 0.00 H new ATOM 0 HB3 MET B 1 -17.631 -9.608 -8.581 1.00 0.00 H new ATOM 0 HG2 MET B 1 -15.632 -8.189 -9.145 1.00 0.00 H new ATOM 0 HG3 MET B 1 -16.388 -7.790 -10.675 1.00 0.00 H new ATOM 0 HE1 MET B 1 -16.714 -4.501 -8.495 1.00 0.00 H new ATOM 0 HE2 MET B 1 -15.379 -5.638 -8.798 1.00 0.00 H new ATOM 0 HE3 MET B 1 -16.388 -5.069 -10.149 1.00 0.00 H new ATOM 801 N GLN B 2 -14.150 -10.271 -10.043 1.00 0.00 N ATOM 802 CA GLN B 2 -12.830 -10.350 -9.429 1.00 0.00 C ATOM 803 C GLN B 2 -12.276 -8.955 -9.160 1.00 0.00 C ATOM 804 O GLN B 2 -12.398 -8.060 -9.995 1.00 0.00 O ATOM 805 CB GLN B 2 -11.856 -11.121 -10.326 1.00 0.00 C ATOM 806 CG GLN B 2 -12.260 -12.565 -10.600 1.00 0.00 C ATOM 807 CD GLN B 2 -13.276 -12.702 -11.721 1.00 0.00 C ATOM 808 OE1 GLN B 2 -14.400 -12.212 -11.628 1.00 0.00 O ATOM 809 NE2 GLN B 2 -12.881 -13.375 -12.795 1.00 0.00 N ATOM 0 H GLN B 2 -14.156 -9.859 -10.976 1.00 0.00 H new ATOM 0 HA GLN B 2 -12.937 -10.881 -8.483 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -11.764 -10.596 -11.277 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -10.870 -11.114 -9.861 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -11.371 -13.142 -10.853 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -12.673 -12.998 -9.689 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -11.940 -13.767 -12.834 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -13.519 -13.501 -13.581 1.00 0.00 H new ATOM 818 N ILE B 3 -11.660 -8.776 -7.995 1.00 0.00 N ATOM 819 CA ILE B 3 -11.082 -7.488 -7.629 1.00 0.00 C ATOM 820 C ILE B 3 -9.644 -7.654 -7.150 1.00 0.00 C ATOM 821 O ILE B 3 -9.332 -8.578 -6.397 1.00 0.00 O ATOM 822 CB ILE B 3 -11.904 -6.784 -6.530 1.00 0.00 C ATOM 823 CG1 ILE B 3 -11.887 -7.605 -5.238 1.00 0.00 C ATOM 824 CG2 ILE B 3 -13.331 -6.561 -7.008 1.00 0.00 C ATOM 825 CD1 ILE B 3 -12.531 -6.904 -4.060 1.00 0.00 C ATOM 0 H ILE B 3 -11.549 -9.505 -7.290 1.00 0.00 H new ATOM 0 HA ILE B 3 -11.098 -6.869 -8.526 1.00 0.00 H new ATOM 0 HB ILE B 3 -11.453 -5.814 -6.321 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -12.402 -8.550 -5.412 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -10.854 -7.846 -4.985 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -13.903 -6.063 -6.225 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -13.322 -5.938 -7.902 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -13.791 -7.521 -7.239 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -12.481 -7.548 -3.182 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -12.003 -5.972 -3.858 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -13.574 -6.687 -4.291 1.00 0.00 H new ATOM 837 N PHE B 4 -8.768 -6.759 -7.595 1.00 0.00 N ATOM 838 CA PHE B 4 -7.364 -6.815 -7.213 1.00 0.00 C ATOM 839 C PHE B 4 -7.162 -6.285 -5.797 1.00 0.00 C ATOM 840 O PHE B 4 -7.760 -5.284 -5.405 1.00 0.00 O ATOM 841 CB PHE B 4 -6.504 -6.033 -8.213 1.00 0.00 C ATOM 842 CG PHE B 4 -6.378 -6.706 -9.557 1.00 0.00 C ATOM 843 CD1 PHE B 4 -7.481 -7.279 -10.172 1.00 0.00 C ATOM 844 CD2 PHE B 4 -5.152 -6.769 -10.200 1.00 0.00 C ATOM 845 CE1 PHE B 4 -7.364 -7.901 -11.400 1.00 0.00 C ATOM 846 CE2 PHE B 4 -5.029 -7.390 -11.430 1.00 0.00 C ATOM 847 CZ PHE B 4 -6.137 -7.956 -12.030 1.00 0.00 C ATOM 0 H PHE B 4 -9.006 -5.988 -8.219 1.00 0.00 H new ATOM 0 HA PHE B 4 -7.049 -7.858 -7.229 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -6.934 -5.041 -8.352 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -5.509 -5.893 -7.792 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -8.444 -7.238 -9.685 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -4.282 -6.328 -9.735 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -8.232 -8.344 -11.867 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -4.068 -7.432 -11.921 1.00 0.00 H new ATOM 0 HZ PHE B 4 -6.043 -8.441 -12.991 1.00 0.00 H new ATOM 857 N VAL B 5 -6.323 -6.976 -5.034 1.00 0.00 N ATOM 858 CA VAL B 5 -6.043 -6.596 -3.656 1.00 0.00 C ATOM 859 C VAL B 5 -4.548 -6.711 -3.364 1.00 0.00 C ATOM 860 O VAL B 5 -4.087 -7.679 -2.758 1.00 0.00 O ATOM 861 CB VAL B 5 -6.839 -7.482 -2.673 1.00 0.00 C ATOM 862 CG1 VAL B 5 -6.636 -7.027 -1.238 1.00 0.00 C ATOM 863 CG2 VAL B 5 -8.317 -7.475 -3.034 1.00 0.00 C ATOM 0 H VAL B 5 -5.823 -7.807 -5.350 1.00 0.00 H new ATOM 0 HA VAL B 5 -6.352 -5.559 -3.521 1.00 0.00 H new ATOM 0 HB VAL B 5 -6.464 -8.502 -2.755 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -7.208 -7.669 -0.568 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -5.578 -7.088 -0.983 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -6.976 -5.997 -1.131 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -8.866 -8.104 -2.333 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -8.699 -6.455 -2.983 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -8.446 -7.861 -4.045 1.00 0.00 H new ATOM 873 N LYS B 6 -3.796 -5.715 -3.826 1.00 0.00 N ATOM 874 CA LYS B 6 -2.348 -5.682 -3.648 1.00 0.00 C ATOM 875 C LYS B 6 -1.961 -5.201 -2.252 1.00 0.00 C ATOM 876 O LYS B 6 -2.527 -4.239 -1.735 1.00 0.00 O ATOM 877 CB LYS B 6 -1.721 -4.766 -4.702 1.00 0.00 C ATOM 878 CG LYS B 6 -0.202 -4.813 -4.733 1.00 0.00 C ATOM 879 CD LYS B 6 0.361 -3.825 -5.742 1.00 0.00 C ATOM 880 CE LYS B 6 0.155 -2.387 -5.291 1.00 0.00 C ATOM 881 NZ LYS B 6 0.667 -1.410 -6.294 1.00 0.00 N ATOM 0 H LYS B 6 -4.171 -4.913 -4.332 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.973 -6.698 -3.767 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.104 -5.043 -5.684 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -2.039 -3.741 -4.514 1.00 0.00 H new ATOM 0 HG2 LYS B 6 0.191 -4.587 -3.742 1.00 0.00 H new ATOM 0 HG3 LYS B 6 0.128 -5.821 -4.985 1.00 0.00 H new ATOM 0 HD2 LYS B 6 1.425 -4.014 -5.883 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -0.120 -3.977 -6.708 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -0.907 -2.209 -5.120 1.00 0.00 H new ATOM 0 HE3 LYS B 6 0.662 -2.229 -4.339 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 0.508 -0.442 -5.949 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 1.686 -1.563 -6.439 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 0.166 -1.543 -7.195 1.00 0.00 H new ATOM 895 N THR B 7 -0.981 -5.872 -1.656 1.00 0.00 N ATOM 896 CA THR B 7 -0.493 -5.518 -0.328 1.00 0.00 C ATOM 897 C THR B 7 0.481 -4.346 -0.401 1.00 0.00 C ATOM 898 O THR B 7 0.991 -4.021 -1.474 1.00 0.00 O ATOM 899 CB THR B 7 0.204 -6.710 0.353 1.00 0.00 C ATOM 900 OG1 THR B 7 1.335 -7.127 -0.424 1.00 0.00 O ATOM 901 CG2 THR B 7 -0.758 -7.876 0.520 1.00 0.00 C ATOM 0 H THR B 7 -0.506 -6.671 -2.076 1.00 0.00 H new ATOM 0 HA THR B 7 -1.362 -5.232 0.265 1.00 0.00 H new ATOM 0 HB THR B 7 0.539 -6.390 1.340 1.00 0.00 H new ATOM 0 HG1 THR B 7 1.774 -7.884 0.017 1.00 0.00 H new ATOM 0 HG21 THR B 7 -0.243 -8.706 1.003 1.00 0.00 H new ATOM 0 HG22 THR B 7 -1.603 -7.566 1.135 1.00 0.00 H new ATOM 0 HG23 THR B 7 -1.119 -8.193 -0.458 1.00 0.00 H new ATOM 909 N LEU B 8 0.732 -3.715 0.744 1.00 0.00 N ATOM 910 CA LEU B 8 1.647 -2.579 0.812 1.00 0.00 C ATOM 911 C LEU B 8 3.103 -3.048 0.774 1.00 0.00 C ATOM 912 O LEU B 8 3.903 -2.692 1.640 1.00 0.00 O ATOM 913 CB LEU B 8 1.396 -1.769 2.089 1.00 0.00 C ATOM 914 CG LEU B 8 2.137 -0.431 2.168 1.00 0.00 C ATOM 915 CD1 LEU B 8 1.513 0.583 1.221 1.00 0.00 C ATOM 916 CD2 LEU B 8 2.144 0.099 3.592 1.00 0.00 C ATOM 0 H LEU B 8 0.314 -3.972 1.638 1.00 0.00 H new ATOM 0 HA LEU B 8 1.463 -1.945 -0.056 1.00 0.00 H new ATOM 0 HB2 LEU B 8 0.326 -1.579 2.176 1.00 0.00 H new ATOM 0 HB3 LEU B 8 1.683 -2.376 2.948 1.00 0.00 H new ATOM 0 HG LEU B 8 3.170 -0.596 1.862 1.00 0.00 H new ATOM 0 HD11 LEU B 8 2.053 1.527 1.291 1.00 0.00 H new ATOM 0 HD12 LEU B 8 1.569 0.209 0.199 1.00 0.00 H new ATOM 0 HD13 LEU B 8 0.469 0.741 1.493 1.00 0.00 H new ATOM 0 HD21 LEU B 8 2.676 1.050 3.624 1.00 0.00 H new ATOM 0 HD22 LEU B 8 1.118 0.245 3.931 1.00 0.00 H new ATOM 0 HD23 LEU B 8 2.643 -0.618 4.244 1.00 0.00 H new ATOM 928 N THR B 9 3.444 -3.851 -0.230 1.00 0.00 N ATOM 929 CA THR B 9 4.803 -4.361 -0.366 1.00 0.00 C ATOM 930 C THR B 9 5.095 -4.782 -1.804 1.00 0.00 C ATOM 931 O THR B 9 6.058 -4.309 -2.410 1.00 0.00 O ATOM 932 CB THR B 9 5.046 -5.564 0.568 1.00 0.00 C ATOM 933 OG1 THR B 9 4.816 -5.184 1.930 1.00 0.00 O ATOM 934 CG2 THR B 9 6.467 -6.089 0.421 1.00 0.00 C ATOM 0 H THR B 9 2.800 -4.161 -0.958 1.00 0.00 H new ATOM 0 HA THR B 9 5.474 -3.549 -0.086 1.00 0.00 H new ATOM 0 HB THR B 9 4.351 -6.355 0.287 1.00 0.00 H new ATOM 0 HG1 THR B 9 4.849 -4.208 2.007 1.00 0.00 H new ATOM 0 HG21 THR B 9 6.613 -6.937 1.090 1.00 0.00 H new ATOM 0 HG22 THR B 9 6.633 -6.406 -0.608 1.00 0.00 H new ATOM 0 HG23 THR B 9 7.175 -5.300 0.676 1.00 0.00 H new ATOM 942 N GLY B 10 4.265 -5.669 -2.348 1.00 0.00 N ATOM 943 CA GLY B 10 4.469 -6.124 -3.711 1.00 0.00 C ATOM 944 C GLY B 10 3.821 -7.467 -3.993 1.00 0.00 C ATOM 945 O GLY B 10 4.502 -8.417 -4.382 1.00 0.00 O ATOM 0 H GLY B 10 3.461 -6.078 -1.872 1.00 0.00 H new ATOM 0 HA2 GLY B 10 4.067 -5.381 -4.400 1.00 0.00 H new ATOM 0 HA3 GLY B 10 5.539 -6.195 -3.908 1.00 0.00 H new ATOM 949 N LYS B 11 2.508 -7.552 -3.802 1.00 0.00 N ATOM 950 CA LYS B 11 1.784 -8.796 -4.046 1.00 0.00 C ATOM 951 C LYS B 11 0.289 -8.542 -4.200 1.00 0.00 C ATOM 952 O LYS B 11 -0.379 -8.111 -3.262 1.00 0.00 O ATOM 953 CB LYS B 11 2.031 -9.782 -2.902 1.00 0.00 C ATOM 954 CG LYS B 11 1.296 -11.102 -3.065 1.00 0.00 C ATOM 955 CD LYS B 11 1.560 -12.036 -1.895 1.00 0.00 C ATOM 956 CE LYS B 11 0.782 -13.333 -2.033 1.00 0.00 C ATOM 957 NZ LYS B 11 -0.686 -13.094 -2.098 1.00 0.00 N ATOM 0 H LYS B 11 1.926 -6.779 -3.481 1.00 0.00 H new ATOM 0 HA LYS B 11 2.154 -9.225 -4.977 1.00 0.00 H new ATOM 0 HB2 LYS B 11 3.101 -9.978 -2.828 1.00 0.00 H new ATOM 0 HB3 LYS B 11 1.726 -9.320 -1.963 1.00 0.00 H new ATOM 0 HG2 LYS B 11 0.225 -10.915 -3.148 1.00 0.00 H new ATOM 0 HG3 LYS B 11 1.609 -11.582 -3.992 1.00 0.00 H new ATOM 0 HD2 LYS B 11 2.626 -12.254 -1.836 1.00 0.00 H new ATOM 0 HD3 LYS B 11 1.284 -11.542 -0.964 1.00 0.00 H new ATOM 0 HE2 LYS B 11 1.105 -13.856 -2.933 1.00 0.00 H new ATOM 0 HE3 LYS B 11 1.007 -13.983 -1.188 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -1.173 -13.748 -1.453 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -0.891 -12.114 -1.817 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -1.021 -13.253 -3.070 1.00 0.00 H new ATOM 971 N THR B 12 -0.230 -8.815 -5.394 1.00 0.00 N ATOM 972 CA THR B 12 -1.646 -8.618 -5.679 1.00 0.00 C ATOM 973 C THR B 12 -2.447 -9.895 -5.440 1.00 0.00 C ATOM 974 O THR B 12 -2.042 -10.980 -5.858 1.00 0.00 O ATOM 975 CB THR B 12 -1.860 -8.153 -7.132 1.00 0.00 C ATOM 976 OG1 THR B 12 -1.139 -6.939 -7.369 1.00 0.00 O ATOM 977 CG2 THR B 12 -3.337 -7.934 -7.424 1.00 0.00 C ATOM 0 H THR B 12 0.311 -9.174 -6.181 1.00 0.00 H new ATOM 0 HA THR B 12 -2.001 -7.845 -4.997 1.00 0.00 H new ATOM 0 HB THR B 12 -1.488 -8.934 -7.795 1.00 0.00 H new ATOM 0 HG1 THR B 12 -1.279 -6.651 -8.295 1.00 0.00 H new ATOM 0 HG21 THR B 12 -3.459 -7.606 -8.456 1.00 0.00 H new ATOM 0 HG22 THR B 12 -3.880 -8.867 -7.273 1.00 0.00 H new ATOM 0 HG23 THR B 12 -3.732 -7.172 -6.752 1.00 0.00 H new ATOM 985 N ILE B 13 -3.592 -9.757 -4.775 1.00 0.00 N ATOM 986 CA ILE B 13 -4.456 -10.898 -4.492 1.00 0.00 C ATOM 987 C ILE B 13 -5.835 -10.692 -5.103 1.00 0.00 C ATOM 988 O ILE B 13 -6.499 -9.693 -4.829 1.00 0.00 O ATOM 989 CB ILE B 13 -4.615 -11.127 -2.977 1.00 0.00 C ATOM 990 CG1 ILE B 13 -3.242 -11.285 -2.320 1.00 0.00 C ATOM 991 CG2 ILE B 13 -5.483 -12.354 -2.715 1.00 0.00 C ATOM 992 CD1 ILE B 13 -3.297 -11.369 -0.809 1.00 0.00 C ATOM 0 H ILE B 13 -3.942 -8.866 -4.423 1.00 0.00 H new ATOM 0 HA ILE B 13 -3.981 -11.774 -4.934 1.00 0.00 H new ATOM 0 HB ILE B 13 -5.109 -10.259 -2.540 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -2.765 -12.185 -2.708 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -2.613 -10.442 -2.606 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -5.587 -12.504 -1.640 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -6.468 -12.204 -3.157 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -5.015 -13.232 -3.160 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -2.287 -11.480 -0.414 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.745 -10.459 -0.410 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -3.899 -12.229 -0.514 1.00 0.00 H new ATOM 1004 N THR B 14 -6.265 -11.639 -5.926 1.00 0.00 N ATOM 1005 CA THR B 14 -7.570 -11.551 -6.564 1.00 0.00 C ATOM 1006 C THR B 14 -8.654 -12.140 -5.667 1.00 0.00 C ATOM 1007 O THR B 14 -8.652 -13.338 -5.380 1.00 0.00 O ATOM 1008 CB THR B 14 -7.579 -12.279 -7.922 1.00 0.00 C ATOM 1009 OG1 THR B 14 -6.514 -11.788 -8.746 1.00 0.00 O ATOM 1010 CG2 THR B 14 -8.907 -12.076 -8.637 1.00 0.00 C ATOM 0 H THR B 14 -5.731 -12.474 -6.166 1.00 0.00 H new ATOM 0 HA THR B 14 -7.777 -10.494 -6.731 1.00 0.00 H new ATOM 0 HB THR B 14 -7.440 -13.344 -7.738 1.00 0.00 H new ATOM 0 HG1 THR B 14 -6.524 -12.256 -9.607 1.00 0.00 H new ATOM 0 HG21 THR B 14 -8.889 -12.599 -9.593 1.00 0.00 H new ATOM 0 HG22 THR B 14 -9.715 -12.471 -8.022 1.00 0.00 H new ATOM 0 HG23 THR B 14 -9.069 -11.012 -8.809 1.00 0.00 H new ATOM 1018 N LEU B 15 -9.584 -11.294 -5.233 1.00 0.00 N ATOM 1019 CA LEU B 15 -10.680 -11.732 -4.375 1.00 0.00 C ATOM 1020 C LEU B 15 -12.019 -11.616 -5.101 1.00 0.00 C ATOM 1021 O LEU B 15 -12.324 -10.586 -5.700 1.00 0.00 O ATOM 1022 CB LEU B 15 -10.717 -10.916 -3.074 1.00 0.00 C ATOM 1023 CG LEU B 15 -9.632 -11.239 -2.048 1.00 0.00 C ATOM 1024 CD1 LEU B 15 -9.637 -12.721 -1.711 1.00 0.00 C ATOM 1025 CD2 LEU B 15 -8.271 -10.808 -2.550 1.00 0.00 C ATOM 0 H LEU B 15 -9.600 -10.300 -5.462 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.507 -12.779 -4.125 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -10.644 -9.859 -3.330 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -11.689 -11.064 -2.604 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.849 -10.681 -1.137 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -8.857 -12.930 -0.979 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -10.607 -12.997 -1.297 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -9.451 -13.300 -2.615 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -7.515 -11.048 -1.803 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -8.043 -11.332 -3.478 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -8.274 -9.733 -2.731 1.00 0.00 H new ATOM 1037 N GLU B 16 -12.812 -12.684 -5.043 1.00 0.00 N ATOM 1038 CA GLU B 16 -14.119 -12.706 -5.697 1.00 0.00 C ATOM 1039 C GLU B 16 -15.178 -12.012 -4.840 1.00 0.00 C ATOM 1040 O GLU B 16 -15.229 -12.206 -3.625 1.00 0.00 O ATOM 1041 CB GLU B 16 -14.543 -14.147 -5.984 1.00 0.00 C ATOM 1042 CG GLU B 16 -15.881 -14.257 -6.699 1.00 0.00 C ATOM 1043 CD GLU B 16 -16.277 -15.693 -6.978 1.00 0.00 C ATOM 1044 OE1 GLU B 16 -15.522 -16.389 -7.689 1.00 0.00 O ATOM 1045 OE2 GLU B 16 -17.342 -16.122 -6.486 1.00 0.00 O ATOM 0 H GLU B 16 -12.573 -13.545 -4.550 1.00 0.00 H new ATOM 0 HA GLU B 16 -14.032 -12.163 -6.638 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -13.776 -14.629 -6.590 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -14.597 -14.695 -5.043 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -16.653 -13.783 -6.093 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -15.832 -13.708 -7.640 1.00 0.00 H new ATOM 1052 N VAL B 17 -16.023 -11.210 -5.486 1.00 0.00 N ATOM 1053 CA VAL B 17 -17.087 -10.488 -4.792 1.00 0.00 C ATOM 1054 C VAL B 17 -17.949 -9.697 -5.777 1.00 0.00 C ATOM 1055 O VAL B 17 -17.432 -8.972 -6.625 1.00 0.00 O ATOM 1056 CB VAL B 17 -16.514 -9.529 -3.728 1.00 0.00 C ATOM 1057 CG1 VAL B 17 -15.579 -8.511 -4.366 1.00 0.00 C ATOM 1058 CG2 VAL B 17 -17.634 -8.834 -2.969 1.00 0.00 C ATOM 0 H VAL B 17 -15.991 -11.044 -6.492 1.00 0.00 H new ATOM 0 HA VAL B 17 -17.707 -11.234 -4.295 1.00 0.00 H new ATOM 0 HB VAL B 17 -15.937 -10.118 -3.015 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -15.187 -7.845 -3.597 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -14.753 -9.030 -4.852 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -16.127 -7.928 -5.106 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -17.207 -8.163 -2.224 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -18.245 -8.261 -3.666 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -18.254 -9.580 -2.472 1.00 0.00 H new ATOM 1068 N GLU B 18 -19.267 -9.843 -5.655 1.00 0.00 N ATOM 1069 CA GLU B 18 -20.202 -9.142 -6.533 1.00 0.00 C ATOM 1070 C GLU B 18 -20.190 -7.641 -6.267 1.00 0.00 C ATOM 1071 O GLU B 18 -19.953 -7.202 -5.143 1.00 0.00 O ATOM 1072 CB GLU B 18 -21.628 -9.686 -6.373 1.00 0.00 C ATOM 1073 CG GLU B 18 -22.116 -9.748 -4.933 1.00 0.00 C ATOM 1074 CD GLU B 18 -21.612 -10.972 -4.190 1.00 0.00 C ATOM 1075 OE1 GLU B 18 -20.938 -11.816 -4.817 1.00 0.00 O ATOM 1076 OE2 GLU B 18 -21.905 -11.094 -2.982 1.00 0.00 O ATOM 0 H GLU B 18 -19.711 -10.440 -4.957 1.00 0.00 H new ATOM 0 HA GLU B 18 -19.874 -9.317 -7.558 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -22.310 -9.060 -6.949 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -21.673 -10.687 -6.803 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -21.792 -8.851 -4.406 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -23.206 -9.747 -4.924 1.00 0.00 H new ATOM 1083 N SER B 19 -20.446 -6.859 -7.312 1.00 0.00 N ATOM 1084 CA SER B 19 -20.466 -5.405 -7.193 1.00 0.00 C ATOM 1085 C SER B 19 -21.502 -4.958 -6.166 1.00 0.00 C ATOM 1086 O SER B 19 -21.248 -4.058 -5.366 1.00 0.00 O ATOM 1087 CB SER B 19 -20.772 -4.761 -8.547 1.00 0.00 C ATOM 1088 OG SER B 19 -19.817 -5.136 -9.523 1.00 0.00 O ATOM 0 H SER B 19 -20.642 -7.208 -8.250 1.00 0.00 H new ATOM 0 HA SER B 19 -19.480 -5.083 -6.859 1.00 0.00 H new ATOM 0 HB2 SER B 19 -21.768 -5.058 -8.877 1.00 0.00 H new ATOM 0 HB3 SER B 19 -20.781 -3.676 -8.442 1.00 0.00 H new ATOM 0 HG SER B 19 -19.314 -5.915 -9.206 1.00 0.00 H new ATOM 1094 N SER B 20 -22.674 -5.588 -6.203 1.00 0.00 N ATOM 1095 CA SER B 20 -23.756 -5.251 -5.283 1.00 0.00 C ATOM 1096 C SER B 20 -23.551 -5.902 -3.916 1.00 0.00 C ATOM 1097 O SER B 20 -24.514 -6.302 -3.258 1.00 0.00 O ATOM 1098 CB SER B 20 -25.102 -5.682 -5.871 1.00 0.00 C ATOM 1099 OG SER B 20 -26.172 -5.331 -5.010 1.00 0.00 O ATOM 0 H SER B 20 -22.898 -6.335 -6.861 1.00 0.00 H new ATOM 0 HA SER B 20 -23.752 -4.170 -5.145 1.00 0.00 H new ATOM 0 HB2 SER B 20 -25.245 -5.211 -6.844 1.00 0.00 H new ATOM 0 HB3 SER B 20 -25.102 -6.760 -6.035 1.00 0.00 H new ATOM 0 HG SER B 20 -25.926 -5.533 -4.083 1.00 0.00 H new ATOM 1105 N ASP B 21 -22.296 -6.001 -3.486 1.00 0.00 N ATOM 1106 CA ASP B 21 -21.977 -6.597 -2.193 1.00 0.00 C ATOM 1107 C ASP B 21 -21.737 -5.497 -1.151 1.00 0.00 C ATOM 1108 O ASP B 21 -22.614 -4.665 -0.915 1.00 0.00 O ATOM 1109 CB ASP B 21 -20.759 -7.520 -2.322 1.00 0.00 C ATOM 1110 CG ASP B 21 -20.581 -8.433 -1.119 1.00 0.00 C ATOM 1111 OD1 ASP B 21 -20.498 -7.920 0.015 1.00 0.00 O ATOM 1112 OD2 ASP B 21 -20.522 -9.663 -1.315 1.00 0.00 O ATOM 0 H ASP B 21 -21.485 -5.677 -4.013 1.00 0.00 H new ATOM 0 HA ASP B 21 -22.820 -7.200 -1.858 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -20.863 -8.127 -3.221 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -19.862 -6.914 -2.449 1.00 0.00 H new ATOM 1117 N THR B 22 -20.555 -5.489 -0.534 1.00 0.00 N ATOM 1118 CA THR B 22 -20.221 -4.489 0.472 1.00 0.00 C ATOM 1119 C THR B 22 -18.755 -4.595 0.882 1.00 0.00 C ATOM 1120 O THR B 22 -18.215 -5.694 1.007 1.00 0.00 O ATOM 1121 CB THR B 22 -21.109 -4.621 1.725 1.00 0.00 C ATOM 1122 OG1 THR B 22 -20.716 -3.658 2.709 1.00 0.00 O ATOM 1123 CG2 THR B 22 -21.019 -6.022 2.313 1.00 0.00 C ATOM 0 H THR B 22 -19.814 -6.166 -0.716 1.00 0.00 H new ATOM 0 HA THR B 22 -20.401 -3.514 0.019 1.00 0.00 H new ATOM 0 HB THR B 22 -22.142 -4.437 1.429 1.00 0.00 H new ATOM 0 HG1 THR B 22 -21.286 -3.748 3.501 1.00 0.00 H new ATOM 0 HG21 THR B 22 -21.655 -6.088 3.196 1.00 0.00 H new ATOM 0 HG22 THR B 22 -21.350 -6.750 1.572 1.00 0.00 H new ATOM 0 HG23 THR B 22 -19.987 -6.234 2.593 1.00 0.00 H new ATOM 1131 N ILE B 23 -18.119 -3.446 1.081 1.00 0.00 N ATOM 1132 CA ILE B 23 -16.713 -3.399 1.470 1.00 0.00 C ATOM 1133 C ILE B 23 -16.440 -4.288 2.679 1.00 0.00 C ATOM 1134 O ILE B 23 -15.397 -4.943 2.755 1.00 0.00 O ATOM 1135 CB ILE B 23 -16.273 -1.955 1.786 1.00 0.00 C ATOM 1136 CG1 ILE B 23 -16.398 -1.072 0.542 1.00 0.00 C ATOM 1137 CG2 ILE B 23 -14.848 -1.933 2.316 1.00 0.00 C ATOM 1138 CD1 ILE B 23 -15.543 -1.526 -0.623 1.00 0.00 C ATOM 0 H ILE B 23 -18.557 -2.530 0.979 1.00 0.00 H new ATOM 0 HA ILE B 23 -16.135 -3.771 0.624 1.00 0.00 H new ATOM 0 HB ILE B 23 -16.931 -1.557 2.558 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -17.441 -1.051 0.227 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -16.123 -0.050 0.805 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -14.556 -0.905 2.533 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -14.790 -2.527 3.228 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -14.175 -2.351 1.567 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -15.687 -0.850 -1.465 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -14.494 -1.520 -0.328 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -15.832 -2.536 -0.915 1.00 0.00 H new ATOM 1150 N ASP B 24 -17.380 -4.310 3.622 1.00 0.00 N ATOM 1151 CA ASP B 24 -17.239 -5.124 4.823 1.00 0.00 C ATOM 1152 C ASP B 24 -16.891 -6.563 4.453 1.00 0.00 C ATOM 1153 O ASP B 24 -16.032 -7.188 5.080 1.00 0.00 O ATOM 1154 CB ASP B 24 -18.529 -5.093 5.644 1.00 0.00 C ATOM 1155 CG ASP B 24 -18.430 -5.922 6.909 1.00 0.00 C ATOM 1156 OD1 ASP B 24 -17.564 -5.615 7.756 1.00 0.00 O ATOM 1157 OD2 ASP B 24 -19.219 -6.881 7.053 1.00 0.00 O ATOM 0 H ASP B 24 -18.246 -3.773 3.576 1.00 0.00 H new ATOM 0 HA ASP B 24 -16.430 -4.710 5.425 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -18.764 -4.062 5.906 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -19.353 -5.463 5.034 1.00 0.00 H new ATOM 1162 N ASN B 25 -17.557 -7.076 3.424 1.00 0.00 N ATOM 1163 CA ASN B 25 -17.315 -8.435 2.954 1.00 0.00 C ATOM 1164 C ASN B 25 -15.873 -8.584 2.485 1.00 0.00 C ATOM 1165 O ASN B 25 -15.221 -9.590 2.764 1.00 0.00 O ATOM 1166 CB ASN B 25 -18.277 -8.785 1.817 1.00 0.00 C ATOM 1167 CG ASN B 25 -18.093 -10.203 1.312 1.00 0.00 C ATOM 1168 OD1 ASN B 25 -17.026 -10.568 0.820 1.00 0.00 O ATOM 1169 ND2 ASN B 25 -19.140 -11.012 1.432 1.00 0.00 N ATOM 0 H ASN B 25 -18.270 -6.570 2.899 1.00 0.00 H new ATOM 0 HA ASN B 25 -17.487 -9.123 3.782 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -19.303 -8.657 2.162 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -18.128 -8.088 0.993 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -19.078 -11.978 1.110 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -20.006 -10.667 1.846 1.00 0.00 H new ATOM 1176 N VAL B 26 -15.380 -7.570 1.777 1.00 0.00 N ATOM 1177 CA VAL B 26 -14.011 -7.585 1.277 1.00 0.00 C ATOM 1178 C VAL B 26 -13.030 -7.770 2.428 1.00 0.00 C ATOM 1179 O VAL B 26 -12.137 -8.614 2.364 1.00 0.00 O ATOM 1180 CB VAL B 26 -13.671 -6.286 0.520 1.00 0.00 C ATOM 1181 CG1 VAL B 26 -12.248 -6.330 -0.014 1.00 0.00 C ATOM 1182 CG2 VAL B 26 -14.664 -6.053 -0.609 1.00 0.00 C ATOM 0 H VAL B 26 -15.908 -6.731 1.538 1.00 0.00 H new ATOM 0 HA VAL B 26 -13.925 -8.421 0.583 1.00 0.00 H new ATOM 0 HB VAL B 26 -13.744 -5.452 1.219 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -12.030 -5.403 -0.545 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -11.551 -6.446 0.816 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -12.142 -7.173 -0.697 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -14.409 -5.132 -1.133 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -14.625 -6.890 -1.306 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -15.670 -5.970 -0.197 1.00 0.00 H new ATOM 1192 N LYS B 27 -13.212 -6.988 3.488 1.00 0.00 N ATOM 1193 CA LYS B 27 -12.350 -7.081 4.662 1.00 0.00 C ATOM 1194 C LYS B 27 -12.454 -8.461 5.299 1.00 0.00 C ATOM 1195 O LYS B 27 -11.466 -9.002 5.796 1.00 0.00 O ATOM 1196 CB LYS B 27 -12.708 -6.001 5.688 1.00 0.00 C ATOM 1197 CG LYS B 27 -12.112 -4.633 5.381 1.00 0.00 C ATOM 1198 CD LYS B 27 -12.582 -4.092 4.041 1.00 0.00 C ATOM 1199 CE LYS B 27 -11.942 -2.748 3.735 1.00 0.00 C ATOM 1200 NZ LYS B 27 -12.285 -1.724 4.759 1.00 0.00 N ATOM 0 H LYS B 27 -13.947 -6.284 3.558 1.00 0.00 H new ATOM 0 HA LYS B 27 -11.322 -6.923 4.336 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -13.793 -5.910 5.741 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -12.367 -6.322 6.672 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -12.386 -3.933 6.170 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -11.024 -4.704 5.382 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -12.336 -4.803 3.252 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -13.667 -3.988 4.048 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -10.859 -2.864 3.686 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -12.270 -2.405 2.754 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -12.544 -0.834 4.287 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -13.087 -2.059 5.330 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -11.464 -1.562 5.376 1.00 0.00 H new ATOM 1214 N SER B 28 -13.659 -9.027 5.282 1.00 0.00 N ATOM 1215 CA SER B 28 -13.892 -10.348 5.860 1.00 0.00 C ATOM 1216 C SER B 28 -13.067 -11.417 5.146 1.00 0.00 C ATOM 1217 O SER B 28 -12.376 -12.210 5.788 1.00 0.00 O ATOM 1218 CB SER B 28 -15.377 -10.701 5.785 1.00 0.00 C ATOM 1219 OG SER B 28 -15.620 -11.998 6.300 1.00 0.00 O ATOM 0 H SER B 28 -14.487 -8.592 4.875 1.00 0.00 H new ATOM 0 HA SER B 28 -13.581 -10.318 6.904 1.00 0.00 H new ATOM 0 HB2 SER B 28 -15.957 -9.969 6.347 1.00 0.00 H new ATOM 0 HB3 SER B 28 -15.715 -10.648 4.750 1.00 0.00 H new ATOM 0 HG SER B 28 -16.577 -12.199 6.242 1.00 0.00 H new ATOM 1225 N LYS B 29 -13.141 -11.433 3.818 1.00 0.00 N ATOM 1226 CA LYS B 29 -12.399 -12.407 3.022 1.00 0.00 C ATOM 1227 C LYS B 29 -10.896 -12.212 3.181 1.00 0.00 C ATOM 1228 O LYS B 29 -10.156 -13.174 3.381 1.00 0.00 O ATOM 1229 CB LYS B 29 -12.791 -12.305 1.547 1.00 0.00 C ATOM 1230 CG LYS B 29 -14.217 -12.747 1.268 1.00 0.00 C ATOM 1231 CD LYS B 29 -14.540 -12.690 -0.216 1.00 0.00 C ATOM 1232 CE LYS B 29 -15.941 -13.203 -0.502 1.00 0.00 C ATOM 1233 NZ LYS B 29 -16.098 -14.632 -0.114 1.00 0.00 N ATOM 0 H LYS B 29 -13.706 -10.784 3.271 1.00 0.00 H new ATOM 0 HA LYS B 29 -12.655 -13.402 3.386 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -12.667 -11.274 1.217 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -12.108 -12.914 0.955 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -14.362 -13.764 1.634 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -14.910 -12.109 1.817 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -14.448 -11.663 -0.570 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -13.814 -13.284 -0.770 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -16.667 -12.598 0.040 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -16.160 -13.089 -1.564 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -16.953 -15.021 -0.561 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -15.266 -15.171 -0.430 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -16.184 -14.704 0.920 1.00 0.00 H new ATOM 1247 N ILE B 30 -10.452 -10.962 3.097 1.00 0.00 N ATOM 1248 CA ILE B 30 -9.037 -10.644 3.240 1.00 0.00 C ATOM 1249 C ILE B 30 -8.522 -11.082 4.608 1.00 0.00 C ATOM 1250 O ILE B 30 -7.405 -11.586 4.733 1.00 0.00 O ATOM 1251 CB ILE B 30 -8.782 -9.132 3.061 1.00 0.00 C ATOM 1252 CG1 ILE B 30 -9.233 -8.674 1.671 1.00 0.00 C ATOM 1253 CG2 ILE B 30 -7.309 -8.815 3.279 1.00 0.00 C ATOM 1254 CD1 ILE B 30 -9.127 -7.178 1.456 1.00 0.00 C ATOM 0 H ILE B 30 -11.052 -10.154 2.931 1.00 0.00 H new ATOM 0 HA ILE B 30 -8.502 -11.186 2.460 1.00 0.00 H new ATOM 0 HB ILE B 30 -9.365 -8.590 3.806 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -8.632 -9.183 0.918 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -10.267 -8.982 1.515 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -7.144 -7.745 3.150 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -7.019 -9.107 4.288 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -6.707 -9.365 2.555 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -9.464 -6.930 0.449 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -9.751 -6.661 2.185 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -8.090 -6.865 1.579 1.00 0.00 H new ATOM 1266 N GLN B 31 -9.349 -10.881 5.628 1.00 0.00 N ATOM 1267 CA GLN B 31 -8.994 -11.244 6.996 1.00 0.00 C ATOM 1268 C GLN B 31 -8.811 -12.751 7.151 1.00 0.00 C ATOM 1269 O GLN B 31 -7.861 -13.204 7.784 1.00 0.00 O ATOM 1270 CB GLN B 31 -10.075 -10.755 7.964 1.00 0.00 C ATOM 1271 CG GLN B 31 -9.837 -11.173 9.407 1.00 0.00 C ATOM 1272 CD GLN B 31 -10.912 -10.664 10.346 1.00 0.00 C ATOM 1273 OE1 GLN B 31 -12.093 -10.977 10.187 1.00 0.00 O ATOM 1274 NE2 GLN B 31 -10.508 -9.876 11.336 1.00 0.00 N ATOM 0 H GLN B 31 -10.276 -10.466 5.532 1.00 0.00 H new ATOM 0 HA GLN B 31 -8.044 -10.763 7.229 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -10.130 -9.668 7.914 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -11.042 -11.138 7.639 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -9.795 -12.261 9.464 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -8.867 -10.799 9.734 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -9.520 -9.642 11.431 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -11.186 -9.505 12.002 1.00 0.00 H new ATOM 1283 N ASP B 32 -9.735 -13.522 6.593 1.00 0.00 N ATOM 1284 CA ASP B 32 -9.679 -14.977 6.693 1.00 0.00 C ATOM 1285 C ASP B 32 -8.527 -15.560 5.875 1.00 0.00 C ATOM 1286 O ASP B 32 -7.807 -16.442 6.345 1.00 0.00 O ATOM 1287 CB ASP B 32 -11.007 -15.584 6.235 1.00 0.00 C ATOM 1288 CG ASP B 32 -11.045 -17.094 6.388 1.00 0.00 C ATOM 1289 OD1 ASP B 32 -10.237 -17.781 5.728 1.00 0.00 O ATOM 1290 OD2 ASP B 32 -11.885 -17.588 7.170 1.00 0.00 O ATOM 0 H ASP B 32 -10.533 -13.166 6.066 1.00 0.00 H new ATOM 0 HA ASP B 32 -9.502 -15.230 7.738 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -11.821 -15.144 6.811 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -11.179 -15.324 5.191 1.00 0.00 H new ATOM 1295 N LYS B 33 -8.369 -15.081 4.646 1.00 0.00 N ATOM 1296 CA LYS B 33 -7.319 -15.573 3.758 1.00 0.00 C ATOM 1297 C LYS B 33 -5.923 -15.251 4.291 1.00 0.00 C ATOM 1298 O LYS B 33 -5.131 -16.154 4.563 1.00 0.00 O ATOM 1299 CB LYS B 33 -7.495 -14.976 2.360 1.00 0.00 C ATOM 1300 CG LYS B 33 -6.447 -15.434 1.357 1.00 0.00 C ATOM 1301 CD LYS B 33 -6.671 -14.819 -0.019 1.00 0.00 C ATOM 1302 CE LYS B 33 -7.870 -15.429 -0.735 1.00 0.00 C ATOM 1303 NZ LYS B 33 -9.146 -15.215 0.005 1.00 0.00 N ATOM 0 H LYS B 33 -8.955 -14.351 4.240 1.00 0.00 H new ATOM 0 HA LYS B 33 -7.411 -16.658 3.708 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -8.483 -15.241 1.984 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -7.463 -13.889 2.433 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -5.455 -15.163 1.719 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -6.471 -16.521 1.277 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -6.821 -13.744 0.085 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -5.777 -14.959 -0.627 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -7.954 -14.994 -1.731 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -7.705 -16.498 -0.867 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -9.919 -15.061 -0.673 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -9.356 -16.052 0.585 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -9.055 -14.382 0.620 1.00 0.00 H new ATOM 1317 N GLU B 34 -5.623 -13.964 4.430 1.00 0.00 N ATOM 1318 CA GLU B 34 -4.316 -13.529 4.918 1.00 0.00 C ATOM 1319 C GLU B 34 -4.148 -13.807 6.408 1.00 0.00 C ATOM 1320 O GLU B 34 -3.068 -14.188 6.859 1.00 0.00 O ATOM 1321 CB GLU B 34 -4.114 -12.039 4.640 1.00 0.00 C ATOM 1322 CG GLU B 34 -4.077 -11.704 3.159 1.00 0.00 C ATOM 1323 CD GLU B 34 -2.947 -12.410 2.436 1.00 0.00 C ATOM 1324 OE1 GLU B 34 -1.772 -12.142 2.765 1.00 0.00 O ATOM 1325 OE2 GLU B 34 -3.236 -13.238 1.547 1.00 0.00 O ATOM 0 H GLU B 34 -6.266 -13.203 4.212 1.00 0.00 H new ATOM 0 HA GLU B 34 -3.559 -14.103 4.383 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -4.919 -11.476 5.113 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -3.182 -11.713 5.103 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -5.027 -11.982 2.702 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -3.967 -10.627 3.035 1.00 0.00 H new ATOM 1332 N GLY B 35 -5.216 -13.603 7.168 1.00 0.00 N ATOM 1333 CA GLY B 35 -5.161 -13.825 8.601 1.00 0.00 C ATOM 1334 C GLY B 35 -4.516 -12.665 9.334 1.00 0.00 C ATOM 1335 O GLY B 35 -3.912 -12.846 10.392 1.00 0.00 O ATOM 0 H GLY B 35 -6.121 -13.287 6.818 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -6.170 -13.978 8.983 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -4.601 -14.738 8.805 1.00 0.00 H new ATOM 1339 N ILE B 36 -4.655 -11.467 8.771 1.00 0.00 N ATOM 1340 CA ILE B 36 -4.095 -10.264 9.372 1.00 0.00 C ATOM 1341 C ILE B 36 -5.084 -9.647 10.361 1.00 0.00 C ATOM 1342 O ILE B 36 -6.269 -9.513 10.054 1.00 0.00 O ATOM 1343 CB ILE B 36 -3.733 -9.214 8.299 1.00 0.00 C ATOM 1344 CG1 ILE B 36 -2.695 -9.784 7.325 1.00 0.00 C ATOM 1345 CG2 ILE B 36 -3.215 -7.939 8.951 1.00 0.00 C ATOM 1346 CD1 ILE B 36 -2.317 -8.830 6.209 1.00 0.00 C ATOM 0 H ILE B 36 -5.153 -11.306 7.896 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.186 -10.558 9.897 1.00 0.00 H new ATOM 0 HB ILE B 36 -4.634 -8.967 7.738 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -1.797 -10.052 7.881 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -3.086 -10.703 6.888 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.965 -7.211 8.179 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -3.984 -7.526 9.604 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.325 -8.166 9.537 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -1.579 -9.303 5.561 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -3.204 -8.581 5.627 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -1.895 -7.920 6.636 1.00 0.00 H new ATOM 1358 N PRO B 37 -4.616 -9.261 11.564 1.00 0.00 N ATOM 1359 CA PRO B 37 -5.479 -8.658 12.583 1.00 0.00 C ATOM 1360 C PRO B 37 -6.258 -7.463 12.041 1.00 0.00 C ATOM 1361 O PRO B 37 -5.693 -6.602 11.364 1.00 0.00 O ATOM 1362 CB PRO B 37 -4.499 -8.202 13.665 1.00 0.00 C ATOM 1363 CG PRO B 37 -3.308 -9.080 13.494 1.00 0.00 C ATOM 1364 CD PRO B 37 -3.218 -9.380 12.023 1.00 0.00 C ATOM 0 HA PRO B 37 -6.232 -9.359 12.942 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -4.236 -7.151 13.543 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -4.930 -8.310 14.660 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -2.404 -8.583 13.846 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -3.414 -9.997 14.073 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -2.565 -8.675 11.508 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -2.818 -10.377 11.840 1.00 0.00 H new ATOM 1372 N PRO B 38 -7.569 -7.387 12.334 1.00 0.00 N ATOM 1373 CA PRO B 38 -8.414 -6.283 11.871 1.00 0.00 C ATOM 1374 C PRO B 38 -7.878 -4.934 12.328 1.00 0.00 C ATOM 1375 O PRO B 38 -7.803 -3.986 11.545 1.00 0.00 O ATOM 1376 CB PRO B 38 -9.781 -6.567 12.513 1.00 0.00 C ATOM 1377 CG PRO B 38 -9.512 -7.559 13.595 1.00 0.00 C ATOM 1378 CD PRO B 38 -8.326 -8.357 13.139 1.00 0.00 C ATOM 0 HA PRO B 38 -8.455 -6.229 10.783 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -10.223 -5.656 12.916 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -10.484 -6.965 11.781 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -9.305 -7.058 14.541 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -10.376 -8.203 13.758 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -7.741 -8.728 13.980 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -8.625 -9.225 12.551 1.00 0.00 H new ATOM 1386 N ASP B 39 -7.498 -4.857 13.599 1.00 0.00 N ATOM 1387 CA ASP B 39 -6.956 -3.627 14.163 1.00 0.00 C ATOM 1388 C ASP B 39 -5.465 -3.504 13.858 1.00 0.00 C ATOM 1389 O ASP B 39 -4.681 -3.081 14.707 1.00 0.00 O ATOM 1390 CB ASP B 39 -7.188 -3.590 15.675 1.00 0.00 C ATOM 1391 CG ASP B 39 -8.660 -3.644 16.040 1.00 0.00 C ATOM 1392 OD1 ASP B 39 -9.500 -3.701 15.118 1.00 0.00 O ATOM 1393 OD2 ASP B 39 -8.971 -3.628 17.250 1.00 0.00 O ATOM 0 H ASP B 39 -7.556 -5.633 14.258 1.00 0.00 H new ATOM 0 HA ASP B 39 -7.473 -2.784 13.705 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -6.671 -4.430 16.139 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -6.749 -2.680 16.084 1.00 0.00 H new ATOM 1398 N GLN B 40 -5.080 -3.878 12.640 1.00 0.00 N ATOM 1399 CA GLN B 40 -3.684 -3.810 12.227 1.00 0.00 C ATOM 1400 C GLN B 40 -3.568 -3.865 10.703 1.00 0.00 C ATOM 1401 O GLN B 40 -2.623 -4.438 10.158 1.00 0.00 O ATOM 1402 CB GLN B 40 -2.901 -4.966 12.850 1.00 0.00 C ATOM 1403 CG GLN B 40 -1.392 -4.812 12.747 1.00 0.00 C ATOM 1404 CD GLN B 40 -0.644 -6.028 13.254 1.00 0.00 C ATOM 1405 OE1 GLN B 40 -0.799 -6.432 14.407 1.00 0.00 O ATOM 1406 NE2 GLN B 40 0.175 -6.620 12.393 1.00 0.00 N ATOM 0 H GLN B 40 -5.715 -4.230 11.924 1.00 0.00 H new ATOM 0 HA GLN B 40 -3.267 -2.864 12.572 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -3.177 -5.054 13.901 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -3.196 -5.896 12.364 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -1.120 -4.630 11.707 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -1.081 -3.936 13.316 1.00 0.00 H new ATOM 0 HE21 GLN B 40 0.273 -6.252 11.447 1.00 0.00 H new ATOM 0 HE22 GLN B 40 0.706 -7.443 12.678 1.00 0.00 H new ATOM 1415 N GLN B 41 -4.536 -3.261 10.024 1.00 0.00 N ATOM 1416 CA GLN B 41 -4.552 -3.237 8.567 1.00 0.00 C ATOM 1417 C GLN B 41 -5.644 -2.307 8.057 1.00 0.00 C ATOM 1418 O GLN B 41 -6.697 -2.172 8.680 1.00 0.00 O ATOM 1419 CB GLN B 41 -4.742 -4.654 8.016 1.00 0.00 C ATOM 1420 CG GLN B 41 -6.031 -5.333 8.460 1.00 0.00 C ATOM 1421 CD GLN B 41 -7.168 -5.162 7.469 1.00 0.00 C ATOM 1422 OE1 GLN B 41 -7.596 -4.046 7.175 1.00 0.00 O ATOM 1423 NE2 GLN B 41 -7.665 -6.277 6.946 1.00 0.00 N ATOM 0 H GLN B 41 -5.322 -2.780 10.461 1.00 0.00 H new ATOM 0 HA GLN B 41 -3.594 -2.856 8.215 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -4.724 -4.613 6.927 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -3.896 -5.268 8.326 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -5.842 -6.396 8.607 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -6.334 -4.927 9.425 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -7.281 -7.182 7.217 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -8.430 -6.228 6.274 1.00 0.00 H new ATOM 1432 N ARG B 42 -5.383 -1.654 6.928 1.00 0.00 N ATOM 1433 CA ARG B 42 -6.340 -0.724 6.346 1.00 0.00 C ATOM 1434 C ARG B 42 -6.315 -0.782 4.822 1.00 0.00 C ATOM 1435 O ARG B 42 -5.277 -0.558 4.199 1.00 0.00 O ATOM 1436 CB ARG B 42 -6.026 0.699 6.810 1.00 0.00 C ATOM 1437 CG ARG B 42 -6.191 0.905 8.307 1.00 0.00 C ATOM 1438 CD ARG B 42 -5.676 2.267 8.747 1.00 0.00 C ATOM 1439 NE ARG B 42 -6.342 3.365 8.049 1.00 0.00 N ATOM 1440 CZ ARG B 42 -6.086 4.649 8.287 1.00 0.00 C ATOM 1441 NH1 ARG B 42 -5.192 4.991 9.205 1.00 0.00 N ATOM 1442 NH2 ARG B 42 -6.724 5.592 7.606 1.00 0.00 N ATOM 0 H ARG B 42 -4.516 -1.753 6.400 1.00 0.00 H new ATOM 0 HA ARG B 42 -7.336 -1.012 6.681 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -5.002 0.945 6.529 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -6.678 1.396 6.283 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -7.244 0.810 8.574 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -5.655 0.122 8.843 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -5.824 2.379 9.821 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -4.603 2.323 8.566 1.00 0.00 H new ATOM 0 HE ARG B 42 -7.040 3.135 7.342 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -4.699 4.269 9.730 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -4.998 5.976 9.386 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -7.412 5.333 6.899 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -6.527 6.576 7.790 1.00 0.00 H new ATOM 1456 N LEU B 43 -7.471 -1.071 4.228 1.00 0.00 N ATOM 1457 CA LEU B 43 -7.586 -1.142 2.775 1.00 0.00 C ATOM 1458 C LEU B 43 -7.800 0.250 2.192 1.00 0.00 C ATOM 1459 O LEU B 43 -8.737 0.952 2.570 1.00 0.00 O ATOM 1460 CB LEU B 43 -8.740 -2.065 2.365 1.00 0.00 C ATOM 1461 CG LEU B 43 -8.525 -3.559 2.631 1.00 0.00 C ATOM 1462 CD1 LEU B 43 -7.256 -4.051 1.950 1.00 0.00 C ATOM 1463 CD2 LEU B 43 -8.475 -3.835 4.124 1.00 0.00 C ATOM 0 H LEU B 43 -8.339 -1.259 4.730 1.00 0.00 H new ATOM 0 HA LEU B 43 -6.657 -1.553 2.380 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.640 -1.747 2.892 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -8.929 -1.928 1.300 1.00 0.00 H new ATOM 0 HG LEU B 43 -9.369 -4.105 2.210 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -7.123 -5.114 2.152 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -7.336 -3.893 0.874 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -6.399 -3.499 2.335 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -8.322 -4.901 4.292 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -7.653 -3.275 4.570 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -9.415 -3.527 4.583 1.00 0.00 H new ATOM 1475 N ILE B 44 -6.922 0.642 1.278 1.00 0.00 N ATOM 1476 CA ILE B 44 -7.000 1.952 0.647 1.00 0.00 C ATOM 1477 C ILE B 44 -7.362 1.845 -0.831 1.00 0.00 C ATOM 1478 O ILE B 44 -6.936 0.919 -1.526 1.00 0.00 O ATOM 1479 CB ILE B 44 -5.667 2.711 0.779 1.00 0.00 C ATOM 1480 CG1 ILE B 44 -5.304 2.894 2.250 1.00 0.00 C ATOM 1481 CG2 ILE B 44 -5.750 4.062 0.082 1.00 0.00 C ATOM 1482 CD1 ILE B 44 -3.850 3.236 2.472 1.00 0.00 C ATOM 0 H ILE B 44 -6.143 0.067 0.956 1.00 0.00 H new ATOM 0 HA ILE B 44 -7.786 2.501 1.165 1.00 0.00 H new ATOM 0 HB ILE B 44 -4.886 2.122 0.298 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -5.924 3.684 2.674 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -5.541 1.978 2.791 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -4.799 4.584 0.186 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -5.969 3.913 -0.975 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -6.542 4.658 0.536 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -3.662 3.352 3.539 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -3.224 2.436 2.078 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -3.613 4.168 1.959 1.00 0.00 H new ATOM 1494 N PHE B 45 -8.142 2.814 -1.297 1.00 0.00 N ATOM 1495 CA PHE B 45 -8.566 2.865 -2.689 1.00 0.00 C ATOM 1496 C PHE B 45 -8.895 4.302 -3.073 1.00 0.00 C ATOM 1497 O PHE B 45 -9.442 5.051 -2.261 1.00 0.00 O ATOM 1498 CB PHE B 45 -9.780 1.965 -2.917 1.00 0.00 C ATOM 1499 CG PHE B 45 -10.233 1.916 -4.349 1.00 0.00 C ATOM 1500 CD1 PHE B 45 -9.343 1.593 -5.361 1.00 0.00 C ATOM 1501 CD2 PHE B 45 -11.550 2.189 -4.683 1.00 0.00 C ATOM 1502 CE1 PHE B 45 -9.756 1.545 -6.678 1.00 0.00 C ATOM 1503 CE2 PHE B 45 -11.969 2.142 -5.998 1.00 0.00 C ATOM 1504 CZ PHE B 45 -11.071 1.820 -6.997 1.00 0.00 C ATOM 0 H PHE B 45 -8.495 3.581 -0.724 1.00 0.00 H new ATOM 0 HA PHE B 45 -7.752 2.503 -3.317 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -9.540 0.955 -2.586 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -10.604 2.316 -2.296 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -8.314 1.376 -5.117 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -12.257 2.441 -3.906 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -9.052 1.293 -7.457 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -12.998 2.357 -6.245 1.00 0.00 H new ATOM 0 HZ PHE B 45 -11.397 1.783 -8.026 1.00 0.00 H new ATOM 1514 N ALA B 46 -8.540 4.678 -4.303 1.00 0.00 N ATOM 1515 CA ALA B 46 -8.771 6.033 -4.809 1.00 0.00 C ATOM 1516 C ALA B 46 -7.860 7.031 -4.102 1.00 0.00 C ATOM 1517 O ALA B 46 -6.983 7.637 -4.718 1.00 0.00 O ATOM 1518 CB ALA B 46 -10.232 6.429 -4.639 1.00 0.00 C ATOM 0 H ALA B 46 -8.087 4.057 -4.973 1.00 0.00 H new ATOM 0 HA ALA B 46 -8.535 6.045 -5.873 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -10.382 7.439 -5.021 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -10.864 5.734 -5.192 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -10.497 6.398 -3.582 1.00 0.00 H new ATOM 1524 N GLY B 47 -8.066 7.181 -2.800 1.00 0.00 N ATOM 1525 CA GLY B 47 -7.259 8.085 -2.006 1.00 0.00 C ATOM 1526 C GLY B 47 -7.656 8.065 -0.542 1.00 0.00 C ATOM 1527 O GLY B 47 -7.419 9.032 0.183 1.00 0.00 O ATOM 0 H GLY B 47 -8.787 6.686 -2.275 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -6.208 7.811 -2.100 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -7.360 9.098 -2.395 1.00 0.00 H new ATOM 1531 N LYS B 48 -8.261 6.959 -0.109 1.00 0.00 N ATOM 1532 CA LYS B 48 -8.693 6.818 1.278 1.00 0.00 C ATOM 1533 C LYS B 48 -9.207 5.407 1.552 1.00 0.00 C ATOM 1534 O LYS B 48 -9.632 4.701 0.636 1.00 0.00 O ATOM 1535 CB LYS B 48 -9.776 7.848 1.605 1.00 0.00 C ATOM 1536 CG LYS B 48 -10.261 7.786 3.045 1.00 0.00 C ATOM 1537 CD LYS B 48 -11.224 8.919 3.360 1.00 0.00 C ATOM 1538 CE LYS B 48 -12.469 8.861 2.484 1.00 0.00 C ATOM 1539 NZ LYS B 48 -13.410 9.977 2.778 1.00 0.00 N ATOM 0 H LYS B 48 -8.462 6.151 -0.698 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.830 6.996 1.920 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.388 8.847 1.404 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -10.624 7.695 0.938 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -10.753 6.830 3.223 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -9.406 7.836 3.720 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.515 8.868 4.409 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.721 9.875 3.215 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -12.176 8.900 1.435 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -12.977 7.909 2.638 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -14.243 9.900 2.160 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -13.710 9.925 3.772 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.935 10.886 2.607 1.00 0.00 H new ATOM 1553 N GLN B 49 -9.161 5.003 2.819 1.00 0.00 N ATOM 1554 CA GLN B 49 -9.622 3.679 3.221 1.00 0.00 C ATOM 1555 C GLN B 49 -11.095 3.479 2.872 1.00 0.00 C ATOM 1556 O GLN B 49 -11.915 4.379 3.057 1.00 0.00 O ATOM 1557 CB GLN B 49 -9.418 3.475 4.724 1.00 0.00 C ATOM 1558 CG GLN B 49 -10.176 4.475 5.582 1.00 0.00 C ATOM 1559 CD GLN B 49 -10.060 4.176 7.064 1.00 0.00 C ATOM 1560 OE1 GLN B 49 -8.963 4.136 7.617 1.00 0.00 O ATOM 1561 NE2 GLN B 49 -11.198 3.965 7.715 1.00 0.00 N ATOM 0 H GLN B 49 -8.808 5.576 3.586 1.00 0.00 H new ATOM 0 HA GLN B 49 -9.033 2.943 2.674 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -9.734 2.467 4.991 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -8.354 3.547 4.951 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -9.796 5.478 5.386 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -11.228 4.471 5.295 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -12.087 4.008 7.216 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -11.184 3.760 8.714 1.00 0.00 H new ATOM 1570 N LEU B 50 -11.423 2.294 2.367 1.00 0.00 N ATOM 1571 CA LEU B 50 -12.797 1.974 1.994 1.00 0.00 C ATOM 1572 C LEU B 50 -13.683 1.834 3.230 1.00 0.00 C ATOM 1573 O LEU B 50 -13.317 1.163 4.194 1.00 0.00 O ATOM 1574 CB LEU B 50 -12.838 0.682 1.175 1.00 0.00 C ATOM 1575 CG LEU B 50 -12.104 0.738 -0.167 1.00 0.00 C ATOM 1576 CD1 LEU B 50 -12.099 -0.630 -0.832 1.00 0.00 C ATOM 1577 CD2 LEU B 50 -12.751 1.769 -1.079 1.00 0.00 C ATOM 0 H LEU B 50 -10.756 1.539 2.207 1.00 0.00 H new ATOM 0 HA LEU B 50 -13.180 2.795 1.387 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -12.409 -0.122 1.773 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -13.880 0.420 0.991 1.00 0.00 H new ATOM 0 HG LEU B 50 -11.071 1.034 0.016 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -11.573 -0.570 -1.785 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -11.596 -1.348 -0.184 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -13.125 -0.954 -1.004 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -12.219 1.798 -2.030 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -13.792 1.498 -1.254 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -12.706 2.751 -0.608 1.00 0.00 H new ATOM 1589 N GLU B 51 -14.851 2.468 3.188 1.00 0.00 N ATOM 1590 CA GLU B 51 -15.794 2.411 4.300 1.00 0.00 C ATOM 1591 C GLU B 51 -16.374 1.009 4.439 1.00 0.00 C ATOM 1592 O GLU B 51 -16.777 0.397 3.452 1.00 0.00 O ATOM 1593 CB GLU B 51 -16.920 3.424 4.095 1.00 0.00 C ATOM 1594 CG GLU B 51 -16.435 4.859 3.993 1.00 0.00 C ATOM 1595 CD GLU B 51 -17.566 5.841 3.761 1.00 0.00 C ATOM 1596 OE1 GLU B 51 -18.473 5.914 4.616 1.00 0.00 O ATOM 1597 OE2 GLU B 51 -17.545 6.537 2.723 1.00 0.00 O ATOM 0 H GLU B 51 -15.167 3.027 2.396 1.00 0.00 H new ATOM 0 HA GLU B 51 -15.258 2.659 5.216 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -17.466 3.169 3.187 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -17.624 3.345 4.924 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -15.908 5.127 4.909 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -15.716 4.939 3.177 1.00 0.00 H new ATOM 1604 N ASP B 52 -16.409 0.506 5.669 1.00 0.00 N ATOM 1605 CA ASP B 52 -16.937 -0.827 5.941 1.00 0.00 C ATOM 1606 C ASP B 52 -18.464 -0.834 5.943 1.00 0.00 C ATOM 1607 O ASP B 52 -19.090 -1.332 6.879 1.00 0.00 O ATOM 1608 CB ASP B 52 -16.409 -1.342 7.282 1.00 0.00 C ATOM 1609 CG ASP B 52 -14.897 -1.457 7.302 1.00 0.00 C ATOM 1610 OD1 ASP B 52 -14.221 -0.422 7.125 1.00 0.00 O ATOM 1611 OD2 ASP B 52 -14.392 -2.582 7.496 1.00 0.00 O ATOM 0 H ASP B 52 -16.077 1.003 6.496 1.00 0.00 H new ATOM 0 HA ASP B 52 -16.598 -1.488 5.143 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -16.730 -0.670 8.078 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -16.848 -2.318 7.492 1.00 0.00 H new ATOM 1616 N GLY B 53 -19.060 -0.282 4.889 1.00 0.00 N ATOM 1617 CA GLY B 53 -20.508 -0.238 4.792 1.00 0.00 C ATOM 1618 C GLY B 53 -20.982 0.434 3.519 1.00 0.00 C ATOM 1619 O GLY B 53 -21.897 1.257 3.550 1.00 0.00 O ATOM 0 H GLY B 53 -18.565 0.135 4.101 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -20.903 -1.253 4.832 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -20.911 0.295 5.653 1.00 0.00 H new ATOM 1623 N ARG B 54 -20.357 0.081 2.399 1.00 0.00 N ATOM 1624 CA ARG B 54 -20.714 0.653 1.103 1.00 0.00 C ATOM 1625 C ARG B 54 -20.430 -0.334 -0.025 1.00 0.00 C ATOM 1626 O ARG B 54 -19.372 -0.960 -0.065 1.00 0.00 O ATOM 1627 CB ARG B 54 -19.930 1.948 0.857 1.00 0.00 C ATOM 1628 CG ARG B 54 -20.284 3.080 1.811 1.00 0.00 C ATOM 1629 CD ARG B 54 -21.705 3.572 1.590 1.00 0.00 C ATOM 1630 NE ARG B 54 -22.065 4.644 2.516 1.00 0.00 N ATOM 1631 CZ ARG B 54 -23.233 5.278 2.493 1.00 0.00 C ATOM 1632 NH1 ARG B 54 -24.147 4.963 1.585 1.00 0.00 N ATOM 1633 NH2 ARG B 54 -23.488 6.231 3.379 1.00 0.00 N ATOM 0 H ARG B 54 -19.599 -0.600 2.362 1.00 0.00 H new ATOM 0 HA ARG B 54 -21.781 0.873 1.117 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -18.864 1.736 0.941 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -20.109 2.280 -0.166 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -20.172 2.738 2.840 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -19.586 3.906 1.672 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -21.810 3.928 0.565 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -22.399 2.740 1.711 1.00 0.00 H new ATOM 0 HE ARG B 54 -21.381 4.921 3.220 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -23.955 4.232 0.901 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -25.042 5.452 1.571 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -22.788 6.478 4.078 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -24.384 6.717 3.361 1.00 0.00 H new ATOM 1647 N THR B 55 -21.381 -0.462 -0.945 1.00 0.00 N ATOM 1648 CA THR B 55 -21.233 -1.366 -2.080 1.00 0.00 C ATOM 1649 C THR B 55 -20.077 -0.931 -2.975 1.00 0.00 C ATOM 1650 O THR B 55 -19.696 0.238 -2.982 1.00 0.00 O ATOM 1651 CB THR B 55 -22.520 -1.431 -2.923 1.00 0.00 C ATOM 1652 OG1 THR B 55 -22.841 -0.130 -3.428 1.00 0.00 O ATOM 1653 CG2 THR B 55 -23.684 -1.961 -2.099 1.00 0.00 C ATOM 0 H THR B 55 -22.263 0.050 -0.926 1.00 0.00 H new ATOM 0 HA THR B 55 -21.027 -2.355 -1.672 1.00 0.00 H new ATOM 0 HB THR B 55 -22.346 -2.112 -3.756 1.00 0.00 H new ATOM 0 HG1 THR B 55 -22.737 -0.122 -4.402 1.00 0.00 H new ATOM 0 HG21 THR B 55 -24.581 -1.997 -2.717 1.00 0.00 H new ATOM 0 HG22 THR B 55 -23.450 -2.963 -1.741 1.00 0.00 H new ATOM 0 HG23 THR B 55 -23.857 -1.303 -1.248 1.00 0.00 H new ATOM 1661 N LEU B 56 -19.523 -1.878 -3.726 1.00 0.00 N ATOM 1662 CA LEU B 56 -18.410 -1.588 -4.626 1.00 0.00 C ATOM 1663 C LEU B 56 -18.749 -0.431 -5.564 1.00 0.00 C ATOM 1664 O LEU B 56 -17.899 0.407 -5.862 1.00 0.00 O ATOM 1665 CB LEU B 56 -18.049 -2.831 -5.443 1.00 0.00 C ATOM 1666 CG LEU B 56 -17.464 -3.994 -4.638 1.00 0.00 C ATOM 1667 CD1 LEU B 56 -17.289 -5.218 -5.523 1.00 0.00 C ATOM 1668 CD2 LEU B 56 -16.132 -3.594 -4.021 1.00 0.00 C ATOM 0 H LEU B 56 -19.826 -2.852 -3.730 1.00 0.00 H new ATOM 0 HA LEU B 56 -17.553 -1.298 -4.017 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -18.944 -3.180 -5.957 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -17.331 -2.545 -6.212 1.00 0.00 H new ATOM 0 HG LEU B 56 -18.159 -4.243 -3.836 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -16.872 -6.036 -4.935 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -18.257 -5.517 -5.926 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -16.613 -4.980 -6.344 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -15.729 -4.431 -3.452 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.432 -3.322 -4.811 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -16.280 -2.742 -3.358 1.00 0.00 H new ATOM 1680 N SER B 57 -19.995 -0.398 -6.028 1.00 0.00 N ATOM 1681 CA SER B 57 -20.452 0.650 -6.936 1.00 0.00 C ATOM 1682 C SER B 57 -20.245 2.040 -6.336 1.00 0.00 C ATOM 1683 O SER B 57 -20.078 3.018 -7.066 1.00 0.00 O ATOM 1684 CB SER B 57 -21.930 0.447 -7.279 1.00 0.00 C ATOM 1685 OG SER B 57 -22.739 0.516 -6.117 1.00 0.00 O ATOM 0 H SER B 57 -20.708 -1.087 -5.789 1.00 0.00 H new ATOM 0 HA SER B 57 -19.857 0.582 -7.846 1.00 0.00 H new ATOM 0 HB2 SER B 57 -22.248 1.207 -7.993 1.00 0.00 H new ATOM 0 HB3 SER B 57 -22.065 -0.521 -7.762 1.00 0.00 H new ATOM 0 HG SER B 57 -23.678 0.385 -6.364 1.00 0.00 H new ATOM 1691 N ASP B 58 -20.271 2.125 -5.008 1.00 0.00 N ATOM 1692 CA ASP B 58 -20.097 3.401 -4.316 1.00 0.00 C ATOM 1693 C ASP B 58 -18.848 4.133 -4.803 1.00 0.00 C ATOM 1694 O ASP B 58 -18.931 5.273 -5.261 1.00 0.00 O ATOM 1695 CB ASP B 58 -20.018 3.184 -2.803 1.00 0.00 C ATOM 1696 CG ASP B 58 -19.871 4.485 -2.038 1.00 0.00 C ATOM 1697 OD1 ASP B 58 -20.766 5.349 -2.156 1.00 0.00 O ATOM 1698 OD2 ASP B 58 -18.861 4.640 -1.319 1.00 0.00 O ATOM 0 H ASP B 58 -20.411 1.326 -4.389 1.00 0.00 H new ATOM 0 HA ASP B 58 -20.965 4.020 -4.543 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -20.916 2.667 -2.466 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -19.172 2.535 -2.576 1.00 0.00 H new ATOM 1703 N TYR B 59 -17.691 3.477 -4.710 1.00 0.00 N ATOM 1704 CA TYR B 59 -16.439 4.085 -5.155 1.00 0.00 C ATOM 1705 C TYR B 59 -16.261 3.933 -6.663 1.00 0.00 C ATOM 1706 O TYR B 59 -15.138 3.842 -7.160 1.00 0.00 O ATOM 1707 CB TYR B 59 -15.243 3.465 -4.427 1.00 0.00 C ATOM 1708 CG TYR B 59 -15.217 3.742 -2.939 1.00 0.00 C ATOM 1709 CD1 TYR B 59 -16.134 3.148 -2.081 1.00 0.00 C ATOM 1710 CD2 TYR B 59 -14.265 4.595 -2.393 1.00 0.00 C ATOM 1711 CE1 TYR B 59 -16.105 3.398 -0.722 1.00 0.00 C ATOM 1712 CE2 TYR B 59 -14.229 4.850 -1.036 1.00 0.00 C ATOM 1713 CZ TYR B 59 -15.151 4.249 -0.204 1.00 0.00 C ATOM 1714 OH TYR B 59 -15.120 4.504 1.147 1.00 0.00 O ATOM 0 H TYR B 59 -17.596 2.534 -4.334 1.00 0.00 H new ATOM 0 HA TYR B 59 -16.486 5.147 -4.915 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -15.254 2.387 -4.585 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -14.323 3.844 -4.873 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -16.882 2.480 -2.482 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -13.541 5.067 -3.041 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -16.826 2.929 -0.069 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -13.483 5.516 -0.628 1.00 0.00 H new ATOM 0 HH TYR B 59 -14.387 5.123 1.346 1.00 0.00 H new ATOM 1724 N ASN B 60 -17.378 3.913 -7.384 1.00 0.00 N ATOM 1725 CA ASN B 60 -17.364 3.778 -8.838 1.00 0.00 C ATOM 1726 C ASN B 60 -16.489 2.608 -9.283 1.00 0.00 C ATOM 1727 O ASN B 60 -15.843 2.668 -10.330 1.00 0.00 O ATOM 1728 CB ASN B 60 -16.871 5.076 -9.483 1.00 0.00 C ATOM 1729 CG ASN B 60 -17.749 6.262 -9.134 1.00 0.00 C ATOM 1730 OD1 ASN B 60 -18.945 6.271 -9.426 1.00 0.00 O ATOM 1731 ND2 ASN B 60 -17.158 7.272 -8.507 1.00 0.00 N ATOM 0 H ASN B 60 -18.312 3.989 -6.981 1.00 0.00 H new ATOM 0 HA ASN B 60 -18.384 3.577 -9.164 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -15.850 5.275 -9.159 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -16.843 4.953 -10.566 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -17.698 8.098 -8.248 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -16.164 7.222 -8.284 1.00 0.00 H new ATOM 1738 N ILE B 61 -16.476 1.545 -8.486 1.00 0.00 N ATOM 1739 CA ILE B 61 -15.684 0.362 -8.806 1.00 0.00 C ATOM 1740 C ILE B 61 -16.321 -0.425 -9.947 1.00 0.00 C ATOM 1741 O ILE B 61 -17.452 -0.900 -9.831 1.00 0.00 O ATOM 1742 CB ILE B 61 -15.527 -0.554 -7.575 1.00 0.00 C ATOM 1743 CG1 ILE B 61 -14.823 0.202 -6.445 1.00 0.00 C ATOM 1744 CG2 ILE B 61 -14.761 -1.819 -7.940 1.00 0.00 C ATOM 1745 CD1 ILE B 61 -14.657 -0.609 -5.175 1.00 0.00 C ATOM 0 H ILE B 61 -17.003 1.478 -7.616 1.00 0.00 H new ATOM 0 HA ILE B 61 -14.697 0.706 -9.116 1.00 0.00 H new ATOM 0 HB ILE B 61 -16.518 -0.850 -7.230 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -13.840 0.521 -6.792 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -15.390 1.105 -6.217 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -14.661 -2.451 -7.058 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -15.302 -2.361 -8.716 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -13.771 -1.551 -8.308 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -14.150 -0.006 -4.422 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -15.637 -0.906 -4.803 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -14.064 -1.499 -5.386 1.00 0.00 H new ATOM 1757 N GLN B 62 -15.590 -0.559 -11.050 1.00 0.00 N ATOM 1758 CA GLN B 62 -16.088 -1.287 -12.211 1.00 0.00 C ATOM 1759 C GLN B 62 -15.842 -2.782 -12.070 1.00 0.00 C ATOM 1760 O GLN B 62 -16.776 -3.573 -11.938 1.00 0.00 O ATOM 1761 CB GLN B 62 -15.424 -0.768 -13.487 1.00 0.00 C ATOM 1762 CG GLN B 62 -15.676 0.708 -13.746 1.00 0.00 C ATOM 1763 CD GLN B 62 -17.150 1.029 -13.905 1.00 0.00 C ATOM 1764 OE1 GLN B 62 -17.816 0.510 -14.799 1.00 0.00 O ATOM 1765 NE2 GLN B 62 -17.666 1.888 -13.034 1.00 0.00 N ATOM 0 H GLN B 62 -14.653 -0.173 -11.163 1.00 0.00 H new ATOM 0 HA GLN B 62 -17.164 -1.122 -12.274 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -14.349 -0.939 -13.423 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -15.788 -1.345 -14.337 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -15.267 1.293 -12.922 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -15.143 1.011 -14.647 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -17.076 2.295 -12.308 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -18.652 2.141 -13.091 1.00 0.00 H new ATOM 1774 N LYS B 63 -14.572 -3.145 -12.098 1.00 0.00 N ATOM 1775 CA LYS B 63 -14.154 -4.540 -11.977 1.00 0.00 C ATOM 1776 C LYS B 63 -12.634 -4.647 -12.064 1.00 0.00 C ATOM 1777 O LYS B 63 -11.985 -3.847 -12.739 1.00 0.00 O ATOM 1778 CB LYS B 63 -14.798 -5.397 -13.069 1.00 0.00 C ATOM 1779 CG LYS B 63 -14.238 -5.137 -14.457 1.00 0.00 C ATOM 1780 CD LYS B 63 -14.954 -5.950 -15.529 1.00 0.00 C ATOM 1781 CE LYS B 63 -16.379 -5.463 -15.764 1.00 0.00 C ATOM 1782 NZ LYS B 63 -17.264 -5.710 -14.592 1.00 0.00 N ATOM 0 H LYS B 63 -13.800 -2.487 -12.205 1.00 0.00 H new ATOM 0 HA LYS B 63 -14.483 -4.909 -11.006 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -14.659 -6.450 -12.822 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -15.872 -5.211 -13.079 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -14.326 -4.076 -14.689 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -13.175 -5.379 -14.469 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -14.393 -5.892 -16.462 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -14.974 -6.999 -15.234 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -16.363 -4.396 -15.986 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -16.792 -5.964 -16.639 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -18.214 -5.972 -14.924 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -16.872 -6.484 -14.018 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -17.324 -4.847 -14.014 1.00 0.00 H new ATOM 1796 N GLU B 64 -12.073 -5.632 -11.371 1.00 0.00 N ATOM 1797 CA GLU B 64 -10.629 -5.843 -11.359 1.00 0.00 C ATOM 1798 C GLU B 64 -9.904 -4.604 -10.841 1.00 0.00 C ATOM 1799 O GLU B 64 -8.815 -4.268 -11.306 1.00 0.00 O ATOM 1800 CB GLU B 64 -10.112 -6.201 -12.757 1.00 0.00 C ATOM 1801 CG GLU B 64 -10.663 -7.510 -13.302 1.00 0.00 C ATOM 1802 CD GLU B 64 -11.947 -7.337 -14.082 1.00 0.00 C ATOM 1803 OE1 GLU B 64 -11.901 -6.708 -15.159 1.00 0.00 O ATOM 1804 OE2 GLU B 64 -12.994 -7.834 -13.620 1.00 0.00 O ATOM 0 H GLU B 64 -12.599 -6.300 -10.808 1.00 0.00 H new ATOM 0 HA GLU B 64 -10.424 -6.678 -10.688 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -10.368 -5.396 -13.446 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -9.024 -6.261 -12.727 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -9.914 -7.972 -13.945 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -10.838 -8.196 -12.473 1.00 0.00 H new ATOM 1811 N SER B 65 -10.518 -3.932 -9.873 1.00 0.00 N ATOM 1812 CA SER B 65 -9.935 -2.733 -9.283 1.00 0.00 C ATOM 1813 C SER B 65 -8.835 -3.095 -8.290 1.00 0.00 C ATOM 1814 O SER B 65 -8.987 -4.025 -7.495 1.00 0.00 O ATOM 1815 CB SER B 65 -11.015 -1.905 -8.586 1.00 0.00 C ATOM 1816 OG SER B 65 -12.019 -1.503 -9.503 1.00 0.00 O ATOM 0 H SER B 65 -11.421 -4.198 -9.480 1.00 0.00 H new ATOM 0 HA SER B 65 -9.495 -2.141 -10.085 1.00 0.00 H new ATOM 0 HB2 SER B 65 -11.464 -2.489 -7.783 1.00 0.00 H new ATOM 0 HB3 SER B 65 -10.564 -1.025 -8.127 1.00 0.00 H new ATOM 0 HG SER B 65 -12.176 -0.540 -9.415 1.00 0.00 H new ATOM 1822 N THR B 66 -7.727 -2.360 -8.340 1.00 0.00 N ATOM 1823 CA THR B 66 -6.607 -2.607 -7.440 1.00 0.00 C ATOM 1824 C THR B 66 -6.862 -1.993 -6.067 1.00 0.00 C ATOM 1825 O THR B 66 -7.211 -0.817 -5.954 1.00 0.00 O ATOM 1826 CB THR B 66 -5.289 -2.041 -8.006 1.00 0.00 C ATOM 1827 OG1 THR B 66 -5.037 -2.592 -9.303 1.00 0.00 O ATOM 1828 CG2 THR B 66 -4.118 -2.358 -7.084 1.00 0.00 C ATOM 0 H THR B 66 -7.582 -1.590 -8.993 1.00 0.00 H new ATOM 0 HA THR B 66 -6.514 -3.689 -7.343 1.00 0.00 H new ATOM 0 HB THR B 66 -5.390 -0.958 -8.081 1.00 0.00 H new ATOM 0 HG1 THR B 66 -4.199 -2.226 -9.657 1.00 0.00 H new ATOM 0 HG21 THR B 66 -3.201 -1.948 -7.507 1.00 0.00 H new ATOM 0 HG22 THR B 66 -4.296 -1.915 -6.104 1.00 0.00 H new ATOM 0 HG23 THR B 66 -4.018 -3.439 -6.981 1.00 0.00 H new ATOM 1836 N LEU B 67 -6.672 -2.794 -5.024 1.00 0.00 N ATOM 1837 CA LEU B 67 -6.866 -2.335 -3.655 1.00 0.00 C ATOM 1838 C LEU B 67 -5.581 -2.525 -2.861 1.00 0.00 C ATOM 1839 O LEU B 67 -5.020 -3.618 -2.835 1.00 0.00 O ATOM 1840 CB LEU B 67 -8.011 -3.103 -2.992 1.00 0.00 C ATOM 1841 CG LEU B 67 -9.371 -2.960 -3.676 1.00 0.00 C ATOM 1842 CD1 LEU B 67 -10.392 -3.881 -3.029 1.00 0.00 C ATOM 1843 CD2 LEU B 67 -9.847 -1.516 -3.623 1.00 0.00 C ATOM 0 H LEU B 67 -6.382 -3.769 -5.102 1.00 0.00 H new ATOM 0 HA LEU B 67 -7.123 -1.276 -3.672 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -7.748 -4.160 -2.960 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -8.104 -2.766 -1.960 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.261 -3.247 -4.722 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -11.354 -3.766 -3.529 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -10.058 -4.915 -3.119 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.497 -3.624 -1.975 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -10.816 -1.434 -4.115 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -9.940 -1.201 -2.584 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -9.126 -0.876 -4.133 1.00 0.00 H new ATOM 1855 N HIS B 68 -5.110 -1.459 -2.231 1.00 0.00 N ATOM 1856 CA HIS B 68 -3.875 -1.527 -1.455 1.00 0.00 C ATOM 1857 C HIS B 68 -4.141 -1.844 0.010 1.00 0.00 C ATOM 1858 O HIS B 68 -4.979 -1.214 0.649 1.00 0.00 O ATOM 1859 CB HIS B 68 -3.102 -0.216 -1.577 1.00 0.00 C ATOM 1860 CG HIS B 68 -2.616 0.067 -2.965 1.00 0.00 C ATOM 1861 ND1 HIS B 68 -1.865 1.178 -3.287 1.00 0.00 N ATOM 1862 CD2 HIS B 68 -2.770 -0.627 -4.118 1.00 0.00 C ATOM 1863 CE1 HIS B 68 -1.578 1.154 -4.576 1.00 0.00 C ATOM 1864 NE2 HIS B 68 -2.115 0.069 -5.102 1.00 0.00 N ATOM 0 H HIS B 68 -5.558 -0.543 -2.240 1.00 0.00 H new ATOM 0 HA HIS B 68 -3.275 -2.340 -1.864 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -3.741 0.604 -1.251 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -2.248 -0.243 -0.901 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -3.308 -1.555 -4.240 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -1.002 1.896 -5.109 1.00 0.00 H new ATOM 0 HE2 HIS B 68 -2.053 -0.207 -6.082 1.00 0.00 H new ATOM 1873 N LEU B 69 -3.411 -2.820 0.541 1.00 0.00 N ATOM 1874 CA LEU B 69 -3.561 -3.207 1.938 1.00 0.00 C ATOM 1875 C LEU B 69 -2.338 -2.773 2.739 1.00 0.00 C ATOM 1876 O LEU B 69 -1.267 -3.367 2.624 1.00 0.00 O ATOM 1877 CB LEU B 69 -3.762 -4.725 2.050 1.00 0.00 C ATOM 1878 CG LEU B 69 -4.214 -5.243 3.423 1.00 0.00 C ATOM 1879 CD1 LEU B 69 -4.637 -6.699 3.327 1.00 0.00 C ATOM 1880 CD2 LEU B 69 -3.110 -5.090 4.460 1.00 0.00 C ATOM 0 H LEU B 69 -2.712 -3.355 0.026 1.00 0.00 H new ATOM 0 HA LEU B 69 -4.440 -2.709 2.347 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -4.500 -5.030 1.308 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -2.825 -5.216 1.789 1.00 0.00 H new ATOM 0 HG LEU B 69 -5.067 -4.644 3.741 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -4.955 -7.051 4.308 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -5.464 -6.792 2.623 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -3.796 -7.300 2.980 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -3.460 -5.465 5.422 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -2.234 -5.658 4.146 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -2.844 -4.037 4.556 1.00 0.00 H new ATOM 1892 N VAL B 70 -2.505 -1.737 3.556 1.00 0.00 N ATOM 1893 CA VAL B 70 -1.411 -1.233 4.377 1.00 0.00 C ATOM 1894 C VAL B 70 -1.416 -1.884 5.758 1.00 0.00 C ATOM 1895 O VAL B 70 -2.405 -1.810 6.488 1.00 0.00 O ATOM 1896 CB VAL B 70 -1.484 0.299 4.527 1.00 0.00 C ATOM 1897 CG1 VAL B 70 -0.455 0.797 5.533 1.00 0.00 C ATOM 1898 CG2 VAL B 70 -1.280 0.972 3.176 1.00 0.00 C ATOM 0 H VAL B 70 -3.384 -1.232 3.666 1.00 0.00 H new ATOM 0 HA VAL B 70 -0.482 -1.490 3.868 1.00 0.00 H new ATOM 0 HB VAL B 70 -2.474 0.559 4.901 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -0.527 1.881 5.621 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -0.646 0.341 6.504 1.00 0.00 H new ATOM 0 HG13 VAL B 70 0.545 0.526 5.195 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -1.334 2.054 3.297 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -0.303 0.700 2.778 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -2.057 0.645 2.485 1.00 0.00 H new ATOM 1908 N LEU B 71 -0.302 -2.519 6.106 1.00 0.00 N ATOM 1909 CA LEU B 71 -0.167 -3.183 7.398 1.00 0.00 C ATOM 1910 C LEU B 71 0.198 -2.181 8.489 1.00 0.00 C ATOM 1911 O LEU B 71 1.126 -1.389 8.328 1.00 0.00 O ATOM 1912 CB LEU B 71 0.900 -4.278 7.317 1.00 0.00 C ATOM 1913 CG LEU B 71 1.108 -5.085 8.602 1.00 0.00 C ATOM 1914 CD1 LEU B 71 -0.146 -5.869 8.956 1.00 0.00 C ATOM 1915 CD2 LEU B 71 2.298 -6.021 8.451 1.00 0.00 C ATOM 0 H LEU B 71 0.523 -2.588 5.510 1.00 0.00 H new ATOM 0 HA LEU B 71 -1.126 -3.634 7.652 1.00 0.00 H new ATOM 0 HB2 LEU B 71 0.631 -4.966 6.515 1.00 0.00 H new ATOM 0 HB3 LEU B 71 1.848 -3.818 7.038 1.00 0.00 H new ATOM 0 HG LEU B 71 1.314 -4.389 9.415 1.00 0.00 H new ATOM 0 HD11 LEU B 71 0.025 -6.435 9.872 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -0.976 -5.179 9.105 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -0.387 -6.556 8.145 1.00 0.00 H new ATOM 0 HD21 LEU B 71 2.434 -6.588 9.372 1.00 0.00 H new ATOM 0 HD22 LEU B 71 2.118 -6.709 7.625 1.00 0.00 H new ATOM 0 HD23 LEU B 71 3.196 -5.438 8.248 1.00 0.00 H new ATOM 1927 N ARG B 72 -0.532 -2.223 9.598 1.00 0.00 N ATOM 1928 CA ARG B 72 -0.271 -1.319 10.713 1.00 0.00 C ATOM 1929 C ARG B 72 0.985 -1.756 11.461 1.00 0.00 C ATOM 1930 O ARG B 72 1.090 -2.900 11.902 1.00 0.00 O ATOM 1931 CB ARG B 72 -1.481 -1.284 11.657 1.00 0.00 C ATOM 1932 CG ARG B 72 -1.429 -0.183 12.710 1.00 0.00 C ATOM 1933 CD ARG B 72 -0.448 -0.506 13.828 1.00 0.00 C ATOM 1934 NE ARG B 72 -0.376 0.564 14.821 1.00 0.00 N ATOM 1935 CZ ARG B 72 0.064 1.793 14.556 1.00 0.00 C ATOM 1936 NH1 ARG B 72 0.495 2.100 13.340 1.00 0.00 N ATOM 1937 NH2 ARG B 72 0.080 2.712 15.512 1.00 0.00 N ATOM 0 H ARG B 72 -1.306 -2.870 9.749 1.00 0.00 H new ATOM 0 HA ARG B 72 -0.107 -0.314 10.325 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -2.386 -1.159 11.063 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -1.561 -2.247 12.160 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -1.143 0.757 12.238 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -2.424 -0.038 13.132 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -0.747 -1.434 14.316 1.00 0.00 H new ATOM 0 HD3 ARG B 72 0.542 -0.674 13.404 1.00 0.00 H new ATOM 0 HE ARG B 72 -0.680 0.358 15.772 1.00 0.00 H new ATOM 0 HH11 ARG B 72 0.490 1.394 12.604 1.00 0.00 H new ATOM 0 HH12 ARG B 72 0.831 3.042 13.141 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -0.245 2.478 16.450 1.00 0.00 H new ATOM 0 HH22 ARG B 72 0.417 3.653 15.309 1.00 0.00 H new ATOM 1951 N LEU B 73 1.939 -0.839 11.598 1.00 0.00 N ATOM 1952 CA LEU B 73 3.189 -1.133 12.290 1.00 0.00 C ATOM 1953 C LEU B 73 3.031 -0.992 13.802 1.00 0.00 C ATOM 1954 O LEU B 73 2.585 0.043 14.296 1.00 0.00 O ATOM 1955 CB LEU B 73 4.303 -0.208 11.788 1.00 0.00 C ATOM 1956 CG LEU B 73 4.630 -0.330 10.297 1.00 0.00 C ATOM 1957 CD1 LEU B 73 5.711 0.667 9.904 1.00 0.00 C ATOM 1958 CD2 LEU B 73 5.067 -1.749 9.956 1.00 0.00 C ATOM 0 H LEU B 73 1.870 0.113 11.239 1.00 0.00 H new ATOM 0 HA LEU B 73 3.458 -2.167 12.073 1.00 0.00 H new ATOM 0 HB2 LEU B 73 4.019 0.823 11.998 1.00 0.00 H new ATOM 0 HB3 LEU B 73 5.208 -0.412 12.360 1.00 0.00 H new ATOM 0 HG LEU B 73 3.727 -0.103 9.730 1.00 0.00 H new ATOM 0 HD11 LEU B 73 5.930 0.566 8.841 1.00 0.00 H new ATOM 0 HD12 LEU B 73 5.363 1.680 10.108 1.00 0.00 H new ATOM 0 HD13 LEU B 73 6.614 0.470 10.481 1.00 0.00 H new ATOM 0 HD21 LEU B 73 5.295 -1.814 8.892 1.00 0.00 H new ATOM 0 HD22 LEU B 73 5.955 -2.005 10.533 1.00 0.00 H new ATOM 0 HD23 LEU B 73 4.264 -2.445 10.198 1.00 0.00 H new ATOM 1970 N ARG B 74 3.410 -2.039 14.532 1.00 0.00 N ATOM 1971 CA ARG B 74 3.321 -2.033 15.989 1.00 0.00 C ATOM 1972 C ARG B 74 4.402 -1.147 16.598 1.00 0.00 C ATOM 1973 O ARG B 74 5.533 -1.109 16.113 1.00 0.00 O ATOM 1974 CB ARG B 74 3.440 -3.456 16.541 1.00 0.00 C ATOM 1975 CG ARG B 74 2.246 -4.341 16.216 1.00 0.00 C ATOM 1976 CD ARG B 74 0.985 -3.853 16.913 1.00 0.00 C ATOM 1977 NE ARG B 74 -0.181 -4.658 16.563 1.00 0.00 N ATOM 1978 CZ ARG B 74 -1.405 -4.424 17.027 1.00 0.00 C ATOM 1979 NH1 ARG B 74 -1.619 -3.421 17.868 1.00 0.00 N ATOM 1980 NH2 ARG B 74 -2.416 -5.197 16.652 1.00 0.00 N ATOM 0 H ARG B 74 3.782 -2.903 14.137 1.00 0.00 H new ATOM 0 HA ARG B 74 2.347 -1.628 16.263 1.00 0.00 H new ATOM 0 HB2 ARG B 74 4.342 -3.917 16.140 1.00 0.00 H new ATOM 0 HB3 ARG B 74 3.561 -3.407 17.623 1.00 0.00 H new ATOM 0 HG2 ARG B 74 2.085 -4.355 15.138 1.00 0.00 H new ATOM 0 HG3 ARG B 74 2.458 -5.366 16.520 1.00 0.00 H new ATOM 0 HD2 ARG B 74 1.134 -3.881 17.992 1.00 0.00 H new ATOM 0 HD3 ARG B 74 0.801 -2.813 16.643 1.00 0.00 H new ATOM 0 HE ARG B 74 -0.050 -5.444 15.927 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -0.844 -2.827 18.161 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -2.559 -3.244 18.222 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -2.254 -5.971 16.008 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -3.355 -5.017 17.008 1.00 0.00 H new ATOM 1994 N GLY B 75 4.047 -0.435 17.663 1.00 0.00 N ATOM 1995 CA GLY B 75 4.999 0.443 18.321 1.00 0.00 C ATOM 1996 C GLY B 75 4.458 1.021 19.614 1.00 0.00 C ATOM 1997 O GLY B 75 4.607 2.214 19.877 1.00 0.00 O ATOM 0 H GLY B 75 3.117 -0.450 18.082 1.00 0.00 H new ATOM 0 HA2 GLY B 75 5.915 -0.110 18.529 1.00 0.00 H new ATOM 0 HA3 GLY B 75 5.265 1.257 17.646 1.00 0.00 H new ATOM 2001 N GLY B 76 3.829 0.172 20.421 1.00 0.00 N ATOM 2002 CA GLY B 76 3.274 0.621 21.685 1.00 0.00 C ATOM 2003 C GLY B 76 4.337 1.135 22.636 1.00 0.00 C ATOM 2004 O GLY B 76 4.011 1.990 23.486 1.00 0.00 O ATOM 2005 OXT GLY B 76 5.497 0.684 22.530 1.00 0.00 O ATOM 0 H GLY B 76 3.694 -0.819 20.222 1.00 0.00 H new ATOM 0 HA2 GLY B 76 2.546 1.410 21.498 1.00 0.00 H new ATOM 0 HA3 GLY B 76 2.738 -0.203 22.156 1.00 0.00 H new TER 2009 GLY B 76