USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1000 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 10 ASN : amide:sc= 0.43 K(o=0.89,f=0.31) USER MOD Set 1.2: A 11 GLN : amide:sc= 0.456 K(o=0.89,f=0.31) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -4:sc= 0.916 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 HIS : no HE2:sc= -11.6! C(o=-12!,f=-16!) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.697 USER MOD Single : A 18 CYS SG : rot -43:sc= -0.727! USER MOD Single : A 21 TYR OH : rot -60:sc= -2.6! USER MOD Single : A 23 CYS SG : rot 180:sc= -0.931 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.126 USER MOD Single : A 37 THR OG1 : rot 11:sc= 0.59! USER MOD Single : A 38 SER OG : rot 150:sc= 0.0621 USER MOD Single : A 39 ASN : amide:sc= -0.0448 X(o=-0.045,f=-0.49) USER MOD Single : A 40 HIS : no HD1:sc= -2.37! C(o=-2.4!,f=-3.1!) USER MOD Single : A 44 CYS SG : rot 179:sc= -0.279 USER MOD Single : A 46 CYS SG : rot 17:sc= 0.606 USER MOD Single : A 47 TYR OH : rot 180:sc= -1.31 USER MOD Single : A 49 GLN : amide:sc= -0.795 X(o=-0.8,f=-0.92) USER MOD Single : A 51 SER OG : rot -5:sc= -0.872 USER MOD Single : A 54 ASN : amide:sc= -0.983 K(o=-0.98,f=-7.1!) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0199 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.191 K(o=-0.19,f=-1.3) USER MOD Single : A 63 THR OG1 : rot 123:sc= 0.733 USER MOD Single : A 66 LYS NZ :NH3+ 167:sc= 1.15 (180deg=0.925) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.578 X(o=-0.58,f=-0.71) USER MOD Single : A 71 HIS : no HE2:sc= -0.185 K(o=-0.18,f=-1.3) USER MOD Single : A 72 THR OG1 : rot 180:sc= -1.18 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot -171:sc= -2.21! USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.567 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.278 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.271 USER MOD Single : A 98 THR OG1 : rot 38:sc= 0.154 USER MOD Single : A 99 CYS SG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot -118:sc= 0.302 USER MOD Single : A 105 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 115:sc= 1.1 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -6.05! C(o=-6.1!,f=-7.4!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.148 USER MOD Single : A 133 SER OG : rot 146:sc= 1.16 USER MOD Single : A 136 SER OG : rot 170:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.678 14.596 18.868 1.00 0.00 N ATOM 2 CA GLY A 1 2.756 15.426 17.678 1.00 0.00 C ATOM 3 C GLY A 1 4.198 15.537 17.181 1.00 0.00 C ATOM 4 O GLY A 1 4.535 15.011 16.121 1.00 0.00 O ATOM 0 H1 GLY A 1 1.689 14.536 19.185 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.030 13.642 18.649 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.259 15.015 19.622 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.129 15.003 16.893 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.366 16.420 17.897 1.00 0.00 H new ATOM 8 N SER A 2 5.011 16.225 17.969 1.00 0.00 N ATOM 9 CA SER A 2 6.410 16.411 17.622 1.00 0.00 C ATOM 10 C SER A 2 7.053 15.062 17.296 1.00 0.00 C ATOM 11 O SER A 2 6.648 14.032 17.833 1.00 0.00 O ATOM 12 CB SER A 2 7.171 17.103 18.754 1.00 0.00 C ATOM 13 OG SER A 2 7.280 16.274 19.908 1.00 0.00 O ATOM 0 H SER A 2 4.728 16.661 18.847 1.00 0.00 H new ATOM 0 HA SER A 2 6.461 17.052 16.742 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.168 17.375 18.407 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.662 18.030 19.020 1.00 0.00 H new ATOM 0 HG SER A 2 7.774 16.751 20.608 1.00 0.00 H new ATOM 19 N SER A 3 8.044 15.111 16.418 1.00 0.00 N ATOM 20 CA SER A 3 8.747 13.905 16.015 1.00 0.00 C ATOM 21 C SER A 3 10.114 14.266 15.431 1.00 0.00 C ATOM 22 O SER A 3 11.146 13.841 15.948 1.00 0.00 O ATOM 23 CB SER A 3 7.930 13.105 14.998 1.00 0.00 C ATOM 24 OG SER A 3 6.734 12.580 15.568 1.00 0.00 O ATOM 0 H SER A 3 8.377 15.967 15.974 1.00 0.00 H new ATOM 0 HA SER A 3 8.889 13.281 16.898 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.678 13.744 14.152 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.536 12.287 14.610 1.00 0.00 H new ATOM 0 HG SER A 3 6.707 12.792 16.524 1.00 0.00 H new ATOM 30 N GLY A 4 10.077 15.047 14.362 1.00 0.00 N ATOM 31 CA GLY A 4 11.300 15.471 13.702 1.00 0.00 C ATOM 32 C GLY A 4 10.997 16.419 12.540 1.00 0.00 C ATOM 33 O GLY A 4 11.368 17.591 12.577 1.00 0.00 O ATOM 0 H GLY A 4 9.219 15.398 13.936 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.952 15.968 14.421 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.839 14.599 13.333 1.00 0.00 H new ATOM 37 N SER A 5 10.325 15.876 11.535 1.00 0.00 N ATOM 38 CA SER A 5 9.967 16.659 10.365 1.00 0.00 C ATOM 39 C SER A 5 11.220 16.983 9.549 1.00 0.00 C ATOM 40 O SER A 5 11.386 16.487 8.436 1.00 0.00 O ATOM 41 CB SER A 5 9.245 17.947 10.763 1.00 0.00 C ATOM 42 OG SER A 5 8.459 18.471 9.696 1.00 0.00 O ATOM 0 H SER A 5 10.019 14.903 11.507 1.00 0.00 H new ATOM 0 HA SER A 5 9.286 16.067 9.754 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.604 17.752 11.623 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.978 18.692 11.073 1.00 0.00 H new ATOM 0 HG SER A 5 8.013 19.292 9.991 1.00 0.00 H new ATOM 48 N SER A 6 12.070 17.814 10.135 1.00 0.00 N ATOM 49 CA SER A 6 13.303 18.210 9.476 1.00 0.00 C ATOM 50 C SER A 6 14.062 16.971 8.997 1.00 0.00 C ATOM 51 O SER A 6 14.054 15.937 9.663 1.00 0.00 O ATOM 52 CB SER A 6 14.183 19.043 10.410 1.00 0.00 C ATOM 53 OG SER A 6 14.594 18.304 11.557 1.00 0.00 O ATOM 0 H SER A 6 11.929 18.224 11.058 1.00 0.00 H new ATOM 0 HA SER A 6 13.047 18.827 8.615 1.00 0.00 H new ATOM 0 HB2 SER A 6 15.063 19.388 9.867 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.636 19.931 10.728 1.00 0.00 H new ATOM 0 HG SER A 6 15.155 18.870 12.127 1.00 0.00 H new ATOM 59 N GLY A 7 14.700 17.116 7.845 1.00 0.00 N ATOM 60 CA GLY A 7 15.462 16.021 7.269 1.00 0.00 C ATOM 61 C GLY A 7 15.474 16.105 5.741 1.00 0.00 C ATOM 62 O GLY A 7 14.721 15.401 5.071 1.00 0.00 O ATOM 0 H GLY A 7 14.705 17.975 7.295 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.484 16.047 7.646 1.00 0.00 H new ATOM 0 HA3 GLY A 7 15.031 15.070 7.581 1.00 0.00 H new ATOM 66 N SER A 8 16.337 16.974 5.235 1.00 0.00 N ATOM 67 CA SER A 8 16.457 17.160 3.799 1.00 0.00 C ATOM 68 C SER A 8 17.747 17.916 3.475 1.00 0.00 C ATOM 69 O SER A 8 18.373 18.492 4.363 1.00 0.00 O ATOM 70 CB SER A 8 15.247 17.909 3.238 1.00 0.00 C ATOM 71 OG SER A 8 15.224 19.272 3.652 1.00 0.00 O ATOM 0 H SER A 8 16.960 17.557 5.794 1.00 0.00 H new ATOM 0 HA SER A 8 16.492 16.177 3.328 1.00 0.00 H new ATOM 0 HB2 SER A 8 15.264 17.861 2.149 1.00 0.00 H new ATOM 0 HB3 SER A 8 14.332 17.415 3.565 1.00 0.00 H new ATOM 0 HG SER A 8 14.438 19.716 3.272 1.00 0.00 H new ATOM 77 N TRP A 9 18.106 17.890 2.200 1.00 0.00 N ATOM 78 CA TRP A 9 19.310 18.566 1.747 1.00 0.00 C ATOM 79 C TRP A 9 19.029 19.158 0.365 1.00 0.00 C ATOM 80 O TRP A 9 19.042 20.376 0.193 1.00 0.00 O ATOM 81 CB TRP A 9 20.509 17.616 1.758 1.00 0.00 C ATOM 82 CG TRP A 9 21.660 18.076 2.654 1.00 0.00 C ATOM 83 CD1 TRP A 9 22.423 17.331 3.466 1.00 0.00 C ATOM 84 CD2 TRP A 9 22.152 19.426 2.797 1.00 0.00 C ATOM 85 NE1 TRP A 9 23.366 18.098 4.119 1.00 0.00 N ATOM 86 CE2 TRP A 9 23.196 19.412 3.700 1.00 0.00 C ATOM 87 CE3 TRP A 9 21.728 20.618 2.185 1.00 0.00 C ATOM 88 CZ2 TRP A 9 23.903 20.562 4.071 1.00 0.00 C ATOM 89 CZ3 TRP A 9 22.445 21.758 2.566 1.00 0.00 C ATOM 90 CH2 TRP A 9 23.499 21.762 3.473 1.00 0.00 C ATOM 0 H TRP A 9 17.584 17.411 1.466 1.00 0.00 H new ATOM 0 HA TRP A 9 19.575 19.377 2.425 1.00 0.00 H new ATOM 0 HB2 TRP A 9 20.176 16.632 2.088 1.00 0.00 H new ATOM 0 HB3 TRP A 9 20.879 17.502 0.739 1.00 0.00 H new ATOM 0 HD1 TRP A 9 22.313 16.264 3.593 1.00 0.00 H new ATOM 0 HE1 TRP A 9 24.060 17.762 4.787 1.00 0.00 H new ATOM 0 HE3 TRP A 9 20.913 20.652 1.477 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 24.716 20.526 4.780 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 22.159 22.701 2.124 1.00 0.00 H new ATOM 0 HH2 TRP A 9 24.003 22.686 3.715 1.00 0.00 H new ATOM 101 N ASN A 10 18.781 18.269 -0.585 1.00 0.00 N ATOM 102 CA ASN A 10 18.497 18.689 -1.947 1.00 0.00 C ATOM 103 C ASN A 10 17.739 17.575 -2.672 1.00 0.00 C ATOM 104 O ASN A 10 18.076 16.400 -2.537 1.00 0.00 O ATOM 105 CB ASN A 10 19.789 18.961 -2.720 1.00 0.00 C ATOM 106 CG ASN A 10 19.578 20.050 -3.775 1.00 0.00 C ATOM 107 OD1 ASN A 10 19.186 19.792 -4.901 1.00 0.00 O ATOM 108 ND2 ASN A 10 19.858 21.278 -3.348 1.00 0.00 N ATOM 0 H ASN A 10 18.771 17.260 -0.439 1.00 0.00 H new ATOM 0 HA ASN A 10 17.904 19.603 -1.901 1.00 0.00 H new ATOM 0 HB2 ASN A 10 20.573 19.267 -2.028 1.00 0.00 H new ATOM 0 HB3 ASN A 10 20.129 18.044 -3.202 1.00 0.00 H new ATOM 0 HD21 ASN A 10 19.748 22.074 -3.976 1.00 0.00 H new ATOM 0 HD22 ASN A 10 20.182 21.424 -2.392 1.00 0.00 H new ATOM 115 N GLN A 11 16.728 17.983 -3.425 1.00 0.00 N ATOM 116 CA GLN A 11 15.919 17.035 -4.171 1.00 0.00 C ATOM 117 C GLN A 11 15.164 16.112 -3.212 1.00 0.00 C ATOM 118 O GLN A 11 15.756 15.547 -2.294 1.00 0.00 O ATOM 119 CB GLN A 11 16.780 16.228 -5.145 1.00 0.00 C ATOM 120 CG GLN A 11 17.078 17.034 -6.411 1.00 0.00 C ATOM 121 CD GLN A 11 18.414 16.613 -7.027 1.00 0.00 C ATOM 122 OE1 GLN A 11 18.488 15.739 -7.875 1.00 0.00 O ATOM 123 NE2 GLN A 11 19.462 17.282 -6.555 1.00 0.00 N ATOM 0 H GLN A 11 16.451 18.958 -3.534 1.00 0.00 H new ATOM 0 HA GLN A 11 15.189 17.592 -4.758 1.00 0.00 H new ATOM 0 HB2 GLN A 11 17.715 15.945 -4.661 1.00 0.00 H new ATOM 0 HB3 GLN A 11 16.266 15.304 -5.410 1.00 0.00 H new ATOM 0 HG2 GLN A 11 16.277 16.888 -7.136 1.00 0.00 H new ATOM 0 HG3 GLN A 11 17.102 18.097 -6.172 1.00 0.00 H new ATOM 0 HE21 GLN A 11 19.330 18.002 -5.845 1.00 0.00 H new ATOM 0 HE22 GLN A 11 20.398 17.075 -6.903 1.00 0.00 H new ATOM 132 N ALA A 12 13.868 15.987 -3.459 1.00 0.00 N ATOM 133 CA ALA A 12 13.026 15.143 -2.629 1.00 0.00 C ATOM 134 C ALA A 12 12.482 13.988 -3.472 1.00 0.00 C ATOM 135 O ALA A 12 12.367 14.104 -4.691 1.00 0.00 O ATOM 136 CB ALA A 12 11.912 15.986 -2.007 1.00 0.00 C ATOM 0 H ALA A 12 13.381 16.456 -4.222 1.00 0.00 H new ATOM 0 HA ALA A 12 13.603 14.712 -1.811 1.00 0.00 H new ATOM 0 HB1 ALA A 12 11.281 15.352 -1.384 1.00 0.00 H new ATOM 0 HB2 ALA A 12 12.351 16.774 -1.395 1.00 0.00 H new ATOM 0 HB3 ALA A 12 11.310 16.433 -2.798 1.00 0.00 H new ATOM 142 N PRO A 13 12.152 12.870 -2.771 1.00 0.00 N ATOM 143 CA PRO A 13 11.622 11.695 -3.442 1.00 0.00 C ATOM 144 C PRO A 13 10.164 11.909 -3.853 1.00 0.00 C ATOM 145 O PRO A 13 9.368 12.439 -3.079 1.00 0.00 O ATOM 146 CB PRO A 13 11.797 10.561 -2.445 1.00 0.00 C ATOM 147 CG PRO A 13 11.987 11.223 -1.090 1.00 0.00 C ATOM 148 CD PRO A 13 12.273 12.696 -1.327 1.00 0.00 C ATOM 0 HA PRO A 13 12.142 11.473 -4.374 1.00 0.00 H new ATOM 0 HB2 PRO A 13 10.925 9.906 -2.441 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.658 9.944 -2.702 1.00 0.00 H new ATOM 0 HG2 PRO A 13 11.094 11.101 -0.477 1.00 0.00 H new ATOM 0 HG3 PRO A 13 12.810 10.756 -0.549 1.00 0.00 H new ATOM 0 HD2 PRO A 13 11.565 13.328 -0.791 1.00 0.00 H new ATOM 0 HD3 PRO A 13 13.269 12.967 -0.978 1.00 0.00 H new ATOM 156 N LYS A 14 9.858 11.487 -5.071 1.00 0.00 N ATOM 157 CA LYS A 14 8.510 11.626 -5.595 1.00 0.00 C ATOM 158 C LYS A 14 7.827 10.256 -5.604 1.00 0.00 C ATOM 159 O LYS A 14 8.495 9.226 -5.682 1.00 0.00 O ATOM 160 CB LYS A 14 8.535 12.309 -6.964 1.00 0.00 C ATOM 161 CG LYS A 14 8.223 13.802 -6.837 1.00 0.00 C ATOM 162 CD LYS A 14 7.266 14.258 -7.940 1.00 0.00 C ATOM 163 CE LYS A 14 8.012 14.473 -9.259 1.00 0.00 C ATOM 164 NZ LYS A 14 7.662 15.787 -9.843 1.00 0.00 N ATOM 0 H LYS A 14 10.521 11.048 -5.710 1.00 0.00 H new ATOM 0 HA LYS A 14 7.916 12.275 -4.951 1.00 0.00 H new ATOM 0 HB2 LYS A 14 9.515 12.176 -7.423 1.00 0.00 H new ATOM 0 HB3 LYS A 14 7.807 11.836 -7.624 1.00 0.00 H new ATOM 0 HG2 LYS A 14 7.781 14.003 -5.861 1.00 0.00 H new ATOM 0 HG3 LYS A 14 9.148 14.376 -6.893 1.00 0.00 H new ATOM 0 HD2 LYS A 14 6.483 13.512 -8.078 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.775 15.184 -7.641 1.00 0.00 H new ATOM 0 HE2 LYS A 14 9.087 14.419 -9.089 1.00 0.00 H new ATOM 0 HE3 LYS A 14 7.760 13.678 -9.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 8.176 15.917 -10.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 6.638 15.825 -10.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 7.925 16.543 -9.179 1.00 0.00 H new ATOM 178 N LEU A 15 6.505 10.289 -5.522 1.00 0.00 N ATOM 179 CA LEU A 15 5.724 9.064 -5.520 1.00 0.00 C ATOM 180 C LEU A 15 4.284 9.381 -5.927 1.00 0.00 C ATOM 181 O LEU A 15 3.708 10.366 -5.468 1.00 0.00 O ATOM 182 CB LEU A 15 5.840 8.358 -4.167 1.00 0.00 C ATOM 183 CG LEU A 15 4.944 7.133 -3.971 1.00 0.00 C ATOM 184 CD1 LEU A 15 3.465 7.518 -4.046 1.00 0.00 C ATOM 185 CD2 LEU A 15 5.300 6.028 -4.968 1.00 0.00 C ATOM 0 H LEU A 15 5.955 11.145 -5.456 1.00 0.00 H new ATOM 0 HA LEU A 15 6.115 8.361 -6.256 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.877 8.051 -4.027 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.612 9.079 -3.382 1.00 0.00 H new ATOM 0 HG LEU A 15 5.123 6.735 -2.972 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.850 6.629 -3.904 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.238 8.245 -3.266 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.252 7.954 -5.022 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.649 5.169 -4.807 1.00 0.00 H new ATOM 0 HD22 LEU A 15 5.168 6.399 -5.984 1.00 0.00 H new ATOM 0 HD23 LEU A 15 6.338 5.728 -4.824 1.00 0.00 H new ATOM 197 N HIS A 16 3.744 8.527 -6.785 1.00 0.00 N ATOM 198 CA HIS A 16 2.382 8.704 -7.259 1.00 0.00 C ATOM 199 C HIS A 16 1.511 7.549 -6.760 1.00 0.00 C ATOM 200 O HIS A 16 1.949 6.400 -6.741 1.00 0.00 O ATOM 201 CB HIS A 16 2.352 8.853 -8.781 1.00 0.00 C ATOM 202 CG HIS A 16 0.963 8.988 -9.358 1.00 0.00 C ATOM 203 ND1 HIS A 16 0.195 7.897 -9.726 1.00 0.00 N ATOM 204 CD2 HIS A 16 0.213 10.095 -9.626 1.00 0.00 C ATOM 205 CE1 HIS A 16 -0.963 8.339 -10.193 1.00 0.00 C ATOM 206 NE2 HIS A 16 -0.950 9.702 -10.131 1.00 0.00 N ATOM 0 H HIS A 16 4.225 7.711 -7.164 1.00 0.00 H new ATOM 0 HA HIS A 16 1.969 9.627 -6.853 1.00 0.00 H new ATOM 0 HB2 HIS A 16 2.937 9.729 -9.062 1.00 0.00 H new ATOM 0 HB3 HIS A 16 2.838 7.987 -9.230 1.00 0.00 H new ATOM 0 HD1 HIS A 16 0.473 6.919 -9.650 1.00 0.00 H new ATOM 0 HD2 HIS A 16 0.514 11.118 -9.456 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -1.775 7.728 -10.559 1.00 0.00 H new ATOM 214 N TYR A 17 0.294 7.896 -6.368 1.00 0.00 N ATOM 215 CA TYR A 17 -0.643 6.903 -5.870 1.00 0.00 C ATOM 216 C TYR A 17 -2.074 7.238 -6.293 1.00 0.00 C ATOM 217 O TYR A 17 -2.480 8.398 -6.259 1.00 0.00 O ATOM 218 CB TYR A 17 -0.548 6.962 -4.344 1.00 0.00 C ATOM 219 CG TYR A 17 -0.578 8.381 -3.773 1.00 0.00 C ATOM 220 CD1 TYR A 17 -1.762 9.088 -3.742 1.00 0.00 C ATOM 221 CD2 TYR A 17 0.581 8.955 -3.289 1.00 0.00 C ATOM 222 CE1 TYR A 17 -1.790 10.424 -3.205 1.00 0.00 C ATOM 223 CE2 TYR A 17 0.553 10.290 -2.752 1.00 0.00 C ATOM 224 CZ TYR A 17 -0.631 10.959 -2.737 1.00 0.00 C ATOM 225 OH TYR A 17 -0.657 12.221 -2.230 1.00 0.00 O ATOM 0 H TYR A 17 -0.065 8.851 -6.385 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.403 5.916 -6.266 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -1.373 6.392 -3.917 1.00 0.00 H new ATOM 0 HB3 TYR A 17 0.374 6.474 -4.028 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -2.669 8.639 -4.121 1.00 0.00 H new ATOM 0 HD2 TYR A 17 1.508 8.402 -3.313 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -2.711 10.988 -3.175 1.00 0.00 H new ATOM 0 HE2 TYR A 17 1.452 10.750 -2.370 1.00 0.00 H new ATOM 0 HH TYR A 17 0.242 12.472 -1.932 1.00 0.00 H new ATOM 235 N CYS A 18 -2.800 6.200 -6.683 1.00 0.00 N ATOM 236 CA CYS A 18 -4.177 6.370 -7.114 1.00 0.00 C ATOM 237 C CYS A 18 -5.093 5.792 -6.032 1.00 0.00 C ATOM 238 O CYS A 18 -5.113 4.582 -5.812 1.00 0.00 O ATOM 239 CB CYS A 18 -4.428 5.724 -8.478 1.00 0.00 C ATOM 240 SG CYS A 18 -6.218 5.739 -8.859 1.00 0.00 S ATOM 0 H CYS A 18 -2.460 5.239 -6.709 1.00 0.00 H new ATOM 0 HA CYS A 18 -4.392 7.431 -7.243 1.00 0.00 H new ATOM 0 HB2 CYS A 18 -3.879 6.262 -9.251 1.00 0.00 H new ATOM 0 HB3 CYS A 18 -4.057 4.699 -8.478 1.00 0.00 H new ATOM 0 HG CYS A 18 -6.891 5.410 -7.796 1.00 0.00 H new ATOM 246 N LEU A 19 -5.829 6.685 -5.386 1.00 0.00 N ATOM 247 CA LEU A 19 -6.744 6.280 -4.333 1.00 0.00 C ATOM 248 C LEU A 19 -8.128 6.027 -4.936 1.00 0.00 C ATOM 249 O LEU A 19 -8.608 6.814 -5.750 1.00 0.00 O ATOM 250 CB LEU A 19 -6.745 7.307 -3.199 1.00 0.00 C ATOM 251 CG LEU A 19 -5.375 7.839 -2.775 1.00 0.00 C ATOM 252 CD1 LEU A 19 -4.318 6.735 -2.825 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.975 9.054 -3.616 1.00 0.00 C ATOM 0 H LEU A 19 -5.810 7.688 -5.572 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.416 5.343 -3.882 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -7.363 8.152 -3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -7.223 6.858 -2.329 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.444 8.172 -1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.354 7.140 -2.519 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.603 5.928 -2.150 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.243 6.349 -3.842 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.997 9.413 -3.295 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.930 8.770 -4.667 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.713 9.846 -3.486 1.00 0.00 H new ATOM 265 N ASP A 20 -8.730 4.925 -4.512 1.00 0.00 N ATOM 266 CA ASP A 20 -10.049 4.559 -5.000 1.00 0.00 C ATOM 267 C ASP A 20 -10.686 3.560 -4.032 1.00 0.00 C ATOM 268 O ASP A 20 -10.231 2.423 -3.919 1.00 0.00 O ATOM 269 CB ASP A 20 -9.963 3.895 -6.375 1.00 0.00 C ATOM 270 CG ASP A 20 -9.942 4.863 -7.560 1.00 0.00 C ATOM 271 OD1 ASP A 20 -11.047 5.238 -8.006 1.00 0.00 O ATOM 272 OD2 ASP A 20 -8.820 5.205 -7.993 1.00 0.00 O ATOM 0 H ASP A 20 -8.329 4.274 -3.837 1.00 0.00 H new ATOM 0 HA ASP A 20 -10.645 5.468 -5.076 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -9.063 3.282 -6.410 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -10.812 3.221 -6.490 1.00 0.00 H new ATOM 277 N TYR A 21 -11.730 4.021 -3.358 1.00 0.00 N ATOM 278 CA TYR A 21 -12.434 3.183 -2.403 1.00 0.00 C ATOM 279 C TYR A 21 -13.723 2.625 -3.010 1.00 0.00 C ATOM 280 O TYR A 21 -14.661 3.374 -3.281 1.00 0.00 O ATOM 281 CB TYR A 21 -12.791 4.092 -1.225 1.00 0.00 C ATOM 282 CG TYR A 21 -13.401 3.354 -0.032 1.00 0.00 C ATOM 283 CD1 TYR A 21 -12.590 2.635 0.822 1.00 0.00 C ATOM 284 CD2 TYR A 21 -14.762 3.408 0.190 1.00 0.00 C ATOM 285 CE1 TYR A 21 -13.164 1.941 1.946 1.00 0.00 C ATOM 286 CE2 TYR A 21 -15.336 2.714 1.313 1.00 0.00 C ATOM 287 CZ TYR A 21 -14.509 2.014 2.136 1.00 0.00 C ATOM 288 OH TYR A 21 -15.052 1.358 3.196 1.00 0.00 O ATOM 0 H TYR A 21 -12.105 4.965 -3.455 1.00 0.00 H new ATOM 0 HA TYR A 21 -11.814 2.337 -2.105 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -11.892 4.613 -0.896 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -13.493 4.853 -1.566 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -11.525 2.593 0.648 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -15.396 3.971 -0.479 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -12.541 1.375 2.623 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -16.399 2.748 1.498 1.00 0.00 H new ATOM 0 HH TYR A 21 -14.860 0.400 3.121 1.00 0.00 H new ATOM 298 N ASP A 22 -13.729 1.315 -3.206 1.00 0.00 N ATOM 299 CA ASP A 22 -14.887 0.648 -3.775 1.00 0.00 C ATOM 300 C ASP A 22 -15.847 0.253 -2.651 1.00 0.00 C ATOM 301 O ASP A 22 -15.785 -0.865 -2.142 1.00 0.00 O ATOM 302 CB ASP A 22 -14.480 -0.626 -4.519 1.00 0.00 C ATOM 303 CG ASP A 22 -15.328 -0.956 -5.748 1.00 0.00 C ATOM 304 OD1 ASP A 22 -16.491 -0.500 -5.774 1.00 0.00 O ATOM 305 OD2 ASP A 22 -14.793 -1.657 -6.635 1.00 0.00 O ATOM 0 H ASP A 22 -12.949 0.697 -2.981 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.362 1.337 -4.473 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -13.439 -0.531 -4.829 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -14.530 -1.465 -3.826 1.00 0.00 H new ATOM 310 N CYS A 23 -16.712 1.192 -2.297 1.00 0.00 N ATOM 311 CA CYS A 23 -17.683 0.956 -1.243 1.00 0.00 C ATOM 312 C CYS A 23 -18.270 -0.444 -1.435 1.00 0.00 C ATOM 313 O CYS A 23 -18.573 -1.133 -0.462 1.00 0.00 O ATOM 314 CB CYS A 23 -18.770 2.032 -1.223 1.00 0.00 C ATOM 315 SG CYS A 23 -19.985 1.719 -2.555 1.00 0.00 S ATOM 0 H CYS A 23 -16.760 2.118 -2.722 1.00 0.00 H new ATOM 0 HA CYS A 23 -17.190 1.013 -0.272 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -19.272 2.036 -0.255 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -18.321 3.017 -1.353 1.00 0.00 H new ATOM 0 HG CYS A 23 -20.905 2.637 -2.528 1.00 0.00 H new ATOM 321 N GLN A 24 -18.412 -0.824 -2.696 1.00 0.00 N ATOM 322 CA GLN A 24 -18.957 -2.129 -3.028 1.00 0.00 C ATOM 323 C GLN A 24 -18.101 -3.235 -2.407 1.00 0.00 C ATOM 324 O GLN A 24 -18.629 -4.170 -1.807 1.00 0.00 O ATOM 325 CB GLN A 24 -19.068 -2.307 -4.544 1.00 0.00 C ATOM 326 CG GLN A 24 -19.719 -1.085 -5.194 1.00 0.00 C ATOM 327 CD GLN A 24 -20.943 -1.489 -6.018 1.00 0.00 C ATOM 328 OE1 GLN A 24 -22.079 -1.220 -5.663 1.00 0.00 O ATOM 329 NE2 GLN A 24 -20.649 -2.147 -7.136 1.00 0.00 N ATOM 0 H GLN A 24 -18.159 -0.250 -3.501 1.00 0.00 H new ATOM 0 HA GLN A 24 -19.962 -2.198 -2.613 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -18.077 -2.464 -4.969 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -19.655 -3.198 -4.767 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -20.014 -0.373 -4.423 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -18.995 -0.581 -5.834 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -19.676 -2.339 -7.374 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -21.397 -2.459 -7.756 1.00 0.00 H new ATOM 338 N LYS A 25 -16.795 -3.091 -2.573 1.00 0.00 N ATOM 339 CA LYS A 25 -15.861 -4.067 -2.036 1.00 0.00 C ATOM 340 C LYS A 25 -15.336 -3.575 -0.686 1.00 0.00 C ATOM 341 O LYS A 25 -14.515 -4.239 -0.055 1.00 0.00 O ATOM 342 CB LYS A 25 -14.757 -4.367 -3.052 1.00 0.00 C ATOM 343 CG LYS A 25 -15.257 -4.159 -4.483 1.00 0.00 C ATOM 344 CD LYS A 25 -14.330 -4.839 -5.492 1.00 0.00 C ATOM 345 CE LYS A 25 -15.108 -5.807 -6.386 1.00 0.00 C ATOM 346 NZ LYS A 25 -14.520 -5.845 -7.744 1.00 0.00 N ATOM 0 H LYS A 25 -16.361 -2.314 -3.071 1.00 0.00 H new ATOM 0 HA LYS A 25 -16.364 -5.017 -1.856 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.900 -3.720 -2.865 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -14.414 -5.394 -2.929 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -16.265 -4.561 -4.582 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -15.317 -3.092 -4.700 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.840 -4.084 -6.107 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.544 -5.378 -4.963 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -15.094 -6.806 -5.949 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -16.152 -5.499 -6.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.060 -6.507 -8.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.556 -4.894 -8.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.531 -6.161 -7.685 1.00 0.00 H new ATOM 360 N ALA A 26 -15.832 -2.414 -0.282 1.00 0.00 N ATOM 361 CA ALA A 26 -15.423 -1.826 0.983 1.00 0.00 C ATOM 362 C ALA A 26 -13.919 -2.029 1.172 1.00 0.00 C ATOM 363 O ALA A 26 -13.459 -2.283 2.284 1.00 0.00 O ATOM 364 CB ALA A 26 -16.243 -2.439 2.120 1.00 0.00 C ATOM 0 H ALA A 26 -16.513 -1.865 -0.808 1.00 0.00 H new ATOM 0 HA ALA A 26 -15.613 -0.753 0.987 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -15.936 -1.998 3.069 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -17.302 -2.241 1.953 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -16.076 -3.516 2.150 1.00 0.00 H new ATOM 370 N GLU A 27 -13.194 -1.909 0.070 1.00 0.00 N ATOM 371 CA GLU A 27 -11.751 -2.077 0.101 1.00 0.00 C ATOM 372 C GLU A 27 -11.068 -0.935 -0.656 1.00 0.00 C ATOM 373 O GLU A 27 -11.411 -0.653 -1.803 1.00 0.00 O ATOM 374 CB GLU A 27 -11.344 -3.435 -0.473 1.00 0.00 C ATOM 375 CG GLU A 27 -11.445 -4.532 0.589 1.00 0.00 C ATOM 376 CD GLU A 27 -10.060 -4.920 1.110 1.00 0.00 C ATOM 377 OE1 GLU A 27 -9.181 -4.031 1.101 1.00 0.00 O ATOM 378 OE2 GLU A 27 -9.911 -6.096 1.504 1.00 0.00 O ATOM 0 H GLU A 27 -13.579 -1.697 -0.851 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.424 -2.046 1.140 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.985 -3.683 -1.319 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -10.323 -3.383 -0.851 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.065 -4.186 1.416 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -11.937 -5.408 0.166 1.00 0.00 H new ATOM 385 N LEU A 28 -10.114 -0.310 0.017 1.00 0.00 N ATOM 386 CA LEU A 28 -9.380 0.794 -0.577 1.00 0.00 C ATOM 387 C LEU A 28 -8.431 0.253 -1.648 1.00 0.00 C ATOM 388 O LEU A 28 -8.157 -0.946 -1.691 1.00 0.00 O ATOM 389 CB LEU A 28 -8.678 1.616 0.507 1.00 0.00 C ATOM 390 CG LEU A 28 -7.994 2.901 0.036 1.00 0.00 C ATOM 391 CD1 LEU A 28 -9.020 3.909 -0.486 1.00 0.00 C ATOM 392 CD2 LEU A 28 -7.121 3.495 1.144 1.00 0.00 C ATOM 0 H LEU A 28 -9.832 -0.547 0.968 1.00 0.00 H new ATOM 0 HA LEU A 28 -10.064 1.482 -1.074 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.412 1.877 1.270 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.930 0.985 0.987 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.335 2.652 -0.796 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -8.507 4.813 -0.814 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.563 3.474 -1.326 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -9.722 4.159 0.310 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -6.646 4.407 0.783 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.740 3.726 2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.354 2.775 1.428 1.00 0.00 H new ATOM 404 N PHE A 29 -7.956 1.162 -2.487 1.00 0.00 N ATOM 405 CA PHE A 29 -7.044 0.790 -3.555 1.00 0.00 C ATOM 406 C PHE A 29 -5.985 1.872 -3.773 1.00 0.00 C ATOM 407 O PHE A 29 -6.290 3.063 -3.728 1.00 0.00 O ATOM 408 CB PHE A 29 -7.881 0.649 -4.828 1.00 0.00 C ATOM 409 CG PHE A 29 -8.747 -0.612 -4.866 1.00 0.00 C ATOM 410 CD1 PHE A 29 -9.956 -0.625 -4.243 1.00 0.00 C ATOM 411 CD2 PHE A 29 -8.309 -1.719 -5.523 1.00 0.00 C ATOM 412 CE1 PHE A 29 -10.760 -1.794 -4.278 1.00 0.00 C ATOM 413 CE2 PHE A 29 -9.114 -2.889 -5.559 1.00 0.00 C ATOM 414 CZ PHE A 29 -10.322 -2.902 -4.935 1.00 0.00 C ATOM 0 H PHE A 29 -8.186 2.155 -2.449 1.00 0.00 H new ATOM 0 HA PHE A 29 -6.531 -0.137 -3.300 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -8.525 1.523 -4.926 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.215 0.646 -5.690 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -10.304 0.254 -3.722 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -7.349 -1.709 -6.018 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -11.720 -1.804 -3.783 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -8.767 -3.768 -6.082 1.00 0.00 H new ATOM 0 HZ PHE A 29 -10.934 -3.792 -4.961 1.00 0.00 H new ATOM 424 N VAL A 30 -4.761 1.420 -4.004 1.00 0.00 N ATOM 425 CA VAL A 30 -3.655 2.335 -4.229 1.00 0.00 C ATOM 426 C VAL A 30 -2.906 1.920 -5.498 1.00 0.00 C ATOM 427 O VAL A 30 -1.805 1.377 -5.423 1.00 0.00 O ATOM 428 CB VAL A 30 -2.755 2.382 -2.992 1.00 0.00 C ATOM 429 CG1 VAL A 30 -1.622 3.393 -3.177 1.00 0.00 C ATOM 430 CG2 VAL A 30 -3.569 2.694 -1.735 1.00 0.00 C ATOM 0 H VAL A 30 -4.511 0.432 -4.040 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.023 3.349 -4.385 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.307 1.397 -2.865 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.997 3.407 -2.284 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.018 3.109 -4.038 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.043 4.385 -3.341 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.906 2.722 -0.870 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.058 3.662 -1.849 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.324 1.921 -1.589 1.00 0.00 H new ATOM 440 N THR A 31 -3.533 2.193 -6.632 1.00 0.00 N ATOM 441 CA THR A 31 -2.940 1.855 -7.915 1.00 0.00 C ATOM 442 C THR A 31 -2.103 3.023 -8.439 1.00 0.00 C ATOM 443 O THR A 31 -1.863 3.992 -7.720 1.00 0.00 O ATOM 444 CB THR A 31 -4.067 1.442 -8.863 1.00 0.00 C ATOM 445 OG1 THR A 31 -5.023 2.493 -8.746 1.00 0.00 O ATOM 446 CG2 THR A 31 -4.817 0.201 -8.376 1.00 0.00 C ATOM 0 H THR A 31 -4.446 2.644 -6.690 1.00 0.00 H new ATOM 0 HA THR A 31 -2.250 1.016 -7.823 1.00 0.00 H new ATOM 0 HB THR A 31 -3.655 1.252 -9.854 1.00 0.00 H new ATOM 0 HG1 THR A 31 -5.788 2.306 -9.330 1.00 0.00 H new ATOM 0 HG21 THR A 31 -5.606 -0.049 -9.085 1.00 0.00 H new ATOM 0 HG22 THR A 31 -4.123 -0.636 -8.296 1.00 0.00 H new ATOM 0 HG23 THR A 31 -5.257 0.402 -7.399 1.00 0.00 H new ATOM 454 N ARG A 32 -1.680 2.893 -9.688 1.00 0.00 N ATOM 455 CA ARG A 32 -0.875 3.926 -10.317 1.00 0.00 C ATOM 456 C ARG A 32 0.291 4.318 -9.407 1.00 0.00 C ATOM 457 O ARG A 32 0.365 5.454 -8.941 1.00 0.00 O ATOM 458 CB ARG A 32 -1.713 5.168 -10.624 1.00 0.00 C ATOM 459 CG ARG A 32 -2.967 4.801 -11.421 1.00 0.00 C ATOM 460 CD ARG A 32 -2.803 5.163 -12.898 1.00 0.00 C ATOM 461 NE ARG A 32 -4.011 5.866 -13.384 1.00 0.00 N ATOM 462 CZ ARG A 32 -4.377 5.929 -14.671 1.00 0.00 C ATOM 463 NH1 ARG A 32 -3.631 5.332 -15.610 1.00 0.00 N ATOM 464 NH2 ARG A 32 -5.490 6.589 -15.020 1.00 0.00 N ATOM 0 H ARG A 32 -1.880 2.088 -10.281 1.00 0.00 H new ATOM 0 HA ARG A 32 -0.490 3.522 -11.253 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -2.000 5.657 -9.693 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -1.115 5.884 -11.189 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -3.164 3.733 -11.324 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.830 5.323 -11.009 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -1.926 5.796 -13.030 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -2.636 4.260 -13.486 1.00 0.00 H new ATOM 0 HE ARG A 32 -4.602 6.332 -12.696 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -2.784 4.829 -15.345 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -3.910 5.380 -16.590 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -6.059 7.044 -14.306 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -5.768 6.637 -16.000 1.00 0.00 H new ATOM 478 N LEU A 33 1.172 3.355 -9.180 1.00 0.00 N ATOM 479 CA LEU A 33 2.331 3.585 -8.333 1.00 0.00 C ATOM 480 C LEU A 33 3.537 3.930 -9.209 1.00 0.00 C ATOM 481 O LEU A 33 3.868 3.190 -10.134 1.00 0.00 O ATOM 482 CB LEU A 33 2.564 2.390 -7.408 1.00 0.00 C ATOM 483 CG LEU A 33 1.536 2.194 -6.292 1.00 0.00 C ATOM 484 CD1 LEU A 33 1.509 0.739 -5.820 1.00 0.00 C ATOM 485 CD2 LEU A 33 1.788 3.167 -5.138 1.00 0.00 C ATOM 0 H LEU A 33 1.107 2.414 -9.568 1.00 0.00 H new ATOM 0 HA LEU A 33 2.160 4.438 -7.676 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.588 1.485 -8.015 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.549 2.495 -6.953 1.00 0.00 H new ATOM 0 HG LEU A 33 0.548 2.420 -6.694 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.770 0.628 -5.027 1.00 0.00 H new ATOM 0 HD12 LEU A 33 1.245 0.090 -6.655 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.493 0.461 -5.441 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.044 3.007 -4.358 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.784 2.997 -4.729 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.716 4.191 -5.503 1.00 0.00 H new ATOM 497 N GLU A 34 4.160 5.054 -8.887 1.00 0.00 N ATOM 498 CA GLU A 34 5.322 5.505 -9.634 1.00 0.00 C ATOM 499 C GLU A 34 6.241 6.336 -8.734 1.00 0.00 C ATOM 500 O GLU A 34 5.962 7.503 -8.466 1.00 0.00 O ATOM 501 CB GLU A 34 4.904 6.299 -10.873 1.00 0.00 C ATOM 502 CG GLU A 34 4.297 5.379 -11.934 1.00 0.00 C ATOM 503 CD GLU A 34 2.774 5.319 -11.801 1.00 0.00 C ATOM 504 OE1 GLU A 34 2.166 6.410 -11.745 1.00 0.00 O ATOM 505 OE2 GLU A 34 2.252 4.184 -11.760 1.00 0.00 O ATOM 0 H GLU A 34 3.882 5.666 -8.119 1.00 0.00 H new ATOM 0 HA GLU A 34 5.873 4.629 -9.974 1.00 0.00 H new ATOM 0 HB2 GLU A 34 4.180 7.064 -10.592 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.769 6.816 -11.287 1.00 0.00 H new ATOM 0 HG2 GLU A 34 4.565 5.738 -12.928 1.00 0.00 H new ATOM 0 HG3 GLU A 34 4.714 4.377 -11.833 1.00 0.00 H new ATOM 512 N ALA A 35 7.317 5.701 -8.294 1.00 0.00 N ATOM 513 CA ALA A 35 8.278 6.366 -7.431 1.00 0.00 C ATOM 514 C ALA A 35 9.292 7.123 -8.292 1.00 0.00 C ATOM 515 O ALA A 35 9.749 6.612 -9.313 1.00 0.00 O ATOM 516 CB ALA A 35 8.944 5.335 -6.518 1.00 0.00 C ATOM 0 H ALA A 35 7.545 4.733 -8.519 1.00 0.00 H new ATOM 0 HA ALA A 35 7.779 7.094 -6.791 1.00 0.00 H new ATOM 0 HB1 ALA A 35 9.665 5.834 -5.871 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.185 4.846 -5.907 1.00 0.00 H new ATOM 0 HB3 ALA A 35 9.457 4.589 -7.125 1.00 0.00 H new ATOM 522 N VAL A 36 9.613 8.329 -7.848 1.00 0.00 N ATOM 523 CA VAL A 36 10.564 9.162 -8.565 1.00 0.00 C ATOM 524 C VAL A 36 11.620 9.680 -7.587 1.00 0.00 C ATOM 525 O VAL A 36 11.458 10.751 -7.003 1.00 0.00 O ATOM 526 CB VAL A 36 9.828 10.283 -9.300 1.00 0.00 C ATOM 527 CG1 VAL A 36 10.794 11.396 -9.711 1.00 0.00 C ATOM 528 CG2 VAL A 36 9.070 9.739 -10.513 1.00 0.00 C ATOM 0 H VAL A 36 9.232 8.750 -7.001 1.00 0.00 H new ATOM 0 HA VAL A 36 11.084 8.580 -9.326 1.00 0.00 H new ATOM 0 HB VAL A 36 9.098 10.710 -8.613 1.00 0.00 H new ATOM 0 HG11 VAL A 36 10.245 12.180 -10.232 1.00 0.00 H new ATOM 0 HG12 VAL A 36 11.268 11.813 -8.822 1.00 0.00 H new ATOM 0 HG13 VAL A 36 11.559 10.988 -10.372 1.00 0.00 H new ATOM 0 HG21 VAL A 36 8.556 10.557 -11.017 1.00 0.00 H new ATOM 0 HG22 VAL A 36 9.774 9.273 -11.203 1.00 0.00 H new ATOM 0 HG23 VAL A 36 8.340 8.999 -10.184 1.00 0.00 H new ATOM 538 N THR A 37 12.679 8.897 -7.438 1.00 0.00 N ATOM 539 CA THR A 37 13.761 9.264 -6.541 1.00 0.00 C ATOM 540 C THR A 37 15.028 9.582 -7.336 1.00 0.00 C ATOM 541 O THR A 37 15.511 8.749 -8.101 1.00 0.00 O ATOM 542 CB THR A 37 13.945 8.128 -5.533 1.00 0.00 C ATOM 543 OG1 THR A 37 14.499 7.066 -6.304 1.00 0.00 O ATOM 544 CG2 THR A 37 12.612 7.569 -5.031 1.00 0.00 C ATOM 0 H THR A 37 12.810 8.010 -7.924 1.00 0.00 H new ATOM 0 HA THR A 37 13.525 10.173 -5.988 1.00 0.00 H new ATOM 0 HB THR A 37 14.530 8.486 -4.686 1.00 0.00 H new ATOM 0 HG1 THR A 37 14.762 7.404 -7.185 1.00 0.00 H new ATOM 0 HG21 THR A 37 12.800 6.766 -4.318 1.00 0.00 H new ATOM 0 HG22 THR A 37 12.046 8.362 -4.543 1.00 0.00 H new ATOM 0 HG23 THR A 37 12.040 7.180 -5.874 1.00 0.00 H new ATOM 552 N SER A 38 15.532 10.790 -7.128 1.00 0.00 N ATOM 553 CA SER A 38 16.734 11.229 -7.816 1.00 0.00 C ATOM 554 C SER A 38 17.810 10.143 -7.733 1.00 0.00 C ATOM 555 O SER A 38 18.003 9.382 -8.680 1.00 0.00 O ATOM 556 CB SER A 38 17.258 12.540 -7.228 1.00 0.00 C ATOM 557 OG SER A 38 16.715 12.801 -5.936 1.00 0.00 O ATOM 0 H SER A 38 15.129 11.479 -6.492 1.00 0.00 H new ATOM 0 HA SER A 38 16.484 11.406 -8.862 1.00 0.00 H new ATOM 0 HB2 SER A 38 18.345 12.499 -7.163 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.010 13.363 -7.898 1.00 0.00 H new ATOM 0 HG SER A 38 17.362 13.312 -5.406 1.00 0.00 H new ATOM 563 N ASN A 39 18.482 10.106 -6.592 1.00 0.00 N ATOM 564 CA ASN A 39 19.532 9.127 -6.373 1.00 0.00 C ATOM 565 C ASN A 39 19.345 8.483 -4.998 1.00 0.00 C ATOM 566 O ASN A 39 18.992 9.160 -4.034 1.00 0.00 O ATOM 567 CB ASN A 39 20.913 9.785 -6.403 1.00 0.00 C ATOM 568 CG ASN A 39 22.005 8.755 -6.702 1.00 0.00 C ATOM 569 OD1 ASN A 39 21.883 7.921 -7.584 1.00 0.00 O ATOM 570 ND2 ASN A 39 23.076 8.859 -5.920 1.00 0.00 N ATOM 0 H ASN A 39 18.319 10.739 -5.809 1.00 0.00 H new ATOM 0 HA ASN A 39 19.470 8.383 -7.167 1.00 0.00 H new ATOM 0 HB2 ASN A 39 20.930 10.569 -7.160 1.00 0.00 H new ATOM 0 HB3 ASN A 39 21.112 10.264 -5.444 1.00 0.00 H new ATOM 0 HD21 ASN A 39 23.860 8.217 -6.040 1.00 0.00 H new ATOM 0 HD22 ASN A 39 23.114 9.581 -5.200 1.00 0.00 H new ATOM 577 N HIS A 40 19.591 7.182 -4.951 1.00 0.00 N ATOM 578 CA HIS A 40 19.454 6.438 -3.710 1.00 0.00 C ATOM 579 C HIS A 40 20.090 5.056 -3.867 1.00 0.00 C ATOM 580 O HIS A 40 19.386 4.057 -4.008 1.00 0.00 O ATOM 581 CB HIS A 40 17.988 6.371 -3.276 1.00 0.00 C ATOM 582 CG HIS A 40 17.540 7.546 -2.441 1.00 0.00 C ATOM 583 ND1 HIS A 40 18.377 8.195 -1.549 1.00 0.00 N ATOM 584 CD2 HIS A 40 16.336 8.184 -2.372 1.00 0.00 C ATOM 585 CE1 HIS A 40 17.696 9.175 -0.974 1.00 0.00 C ATOM 586 NE2 HIS A 40 16.432 9.167 -1.486 1.00 0.00 N ATOM 0 H HIS A 40 19.885 6.624 -5.753 1.00 0.00 H new ATOM 0 HA HIS A 40 19.986 6.955 -2.911 1.00 0.00 H new ATOM 0 HB2 HIS A 40 17.359 6.309 -4.164 1.00 0.00 H new ATOM 0 HB3 HIS A 40 17.829 5.454 -2.709 1.00 0.00 H new ATOM 0 HD2 HIS A 40 15.454 7.932 -2.942 1.00 0.00 H new ATOM 0 HE1 HIS A 40 18.075 9.860 -0.230 1.00 0.00 H new ATOM 0 HE2 HIS A 40 15.683 9.811 -1.230 1.00 0.00 H new ATOM 594 N ASP A 41 21.414 5.042 -3.838 1.00 0.00 N ATOM 595 CA ASP A 41 22.153 3.799 -3.975 1.00 0.00 C ATOM 596 C ASP A 41 21.544 2.744 -3.050 1.00 0.00 C ATOM 597 O ASP A 41 21.007 3.075 -1.994 1.00 0.00 O ATOM 598 CB ASP A 41 23.620 3.984 -3.581 1.00 0.00 C ATOM 599 CG ASP A 41 24.624 3.225 -4.451 1.00 0.00 C ATOM 600 OD1 ASP A 41 24.681 3.541 -5.659 1.00 0.00 O ATOM 601 OD2 ASP A 41 25.312 2.346 -3.889 1.00 0.00 O ATOM 0 H ASP A 41 21.995 5.872 -3.722 1.00 0.00 H new ATOM 0 HA ASP A 41 22.097 3.486 -5.018 1.00 0.00 H new ATOM 0 HB2 ASP A 41 23.860 5.047 -3.619 1.00 0.00 H new ATOM 0 HB3 ASP A 41 23.745 3.666 -2.546 1.00 0.00 H new ATOM 606 N GLY A 42 21.647 1.495 -3.480 1.00 0.00 N ATOM 607 CA GLY A 42 21.113 0.389 -2.703 1.00 0.00 C ATOM 608 C GLY A 42 21.299 -0.939 -3.440 1.00 0.00 C ATOM 609 O GLY A 42 21.925 -1.860 -2.918 1.00 0.00 O ATOM 0 H GLY A 42 22.092 1.224 -4.357 1.00 0.00 H new ATOM 0 HA2 GLY A 42 21.613 0.345 -1.735 1.00 0.00 H new ATOM 0 HA3 GLY A 42 20.054 0.555 -2.507 1.00 0.00 H new ATOM 613 N GLY A 43 20.745 -0.995 -4.642 1.00 0.00 N ATOM 614 CA GLY A 43 20.841 -2.195 -5.456 1.00 0.00 C ATOM 615 C GLY A 43 19.667 -3.137 -5.185 1.00 0.00 C ATOM 616 O GLY A 43 19.193 -3.820 -6.092 1.00 0.00 O ATOM 0 H GLY A 43 20.228 -0.228 -5.072 1.00 0.00 H new ATOM 0 HA2 GLY A 43 20.857 -1.922 -6.511 1.00 0.00 H new ATOM 0 HA3 GLY A 43 21.779 -2.708 -5.245 1.00 0.00 H new ATOM 620 N CYS A 44 19.231 -3.144 -3.934 1.00 0.00 N ATOM 621 CA CYS A 44 18.120 -3.991 -3.533 1.00 0.00 C ATOM 622 C CYS A 44 16.902 -3.620 -4.382 1.00 0.00 C ATOM 623 O CYS A 44 16.975 -2.723 -5.221 1.00 0.00 O ATOM 624 CB CYS A 44 17.830 -3.872 -2.036 1.00 0.00 C ATOM 625 SG CYS A 44 19.072 -4.817 -1.081 1.00 0.00 S ATOM 0 H CYS A 44 19.627 -2.577 -3.184 1.00 0.00 H new ATOM 0 HA CYS A 44 18.376 -5.037 -3.704 1.00 0.00 H new ATOM 0 HB2 CYS A 44 17.848 -2.824 -1.736 1.00 0.00 H new ATOM 0 HB3 CYS A 44 16.830 -4.248 -1.820 1.00 0.00 H new ATOM 0 HG CYS A 44 18.830 -4.691 0.190 1.00 0.00 H new ATOM 631 N ASP A 45 15.811 -4.329 -4.134 1.00 0.00 N ATOM 632 CA ASP A 45 14.579 -4.086 -4.865 1.00 0.00 C ATOM 633 C ASP A 45 13.727 -3.073 -4.098 1.00 0.00 C ATOM 634 O ASP A 45 13.570 -3.182 -2.883 1.00 0.00 O ATOM 635 CB ASP A 45 13.764 -5.372 -5.015 1.00 0.00 C ATOM 636 CG ASP A 45 14.283 -6.347 -6.072 1.00 0.00 C ATOM 637 OD1 ASP A 45 14.765 -5.852 -7.114 1.00 0.00 O ATOM 638 OD2 ASP A 45 14.186 -7.567 -5.816 1.00 0.00 O ATOM 0 H ASP A 45 15.754 -5.072 -3.437 1.00 0.00 H new ATOM 0 HA ASP A 45 14.843 -3.709 -5.853 1.00 0.00 H new ATOM 0 HB2 ASP A 45 13.739 -5.883 -4.052 1.00 0.00 H new ATOM 0 HB3 ASP A 45 12.736 -5.106 -5.261 1.00 0.00 H new ATOM 643 N CYS A 46 13.200 -2.109 -4.838 1.00 0.00 N ATOM 644 CA CYS A 46 12.368 -1.077 -4.243 1.00 0.00 C ATOM 645 C CYS A 46 10.904 -1.413 -4.534 1.00 0.00 C ATOM 646 O CYS A 46 10.566 -1.825 -5.643 1.00 0.00 O ATOM 647 CB CYS A 46 12.745 0.316 -4.749 1.00 0.00 C ATOM 648 SG CYS A 46 12.156 0.539 -6.467 1.00 0.00 S ATOM 0 H CYS A 46 13.333 -2.021 -5.845 1.00 0.00 H new ATOM 0 HA CYS A 46 12.528 -1.055 -3.165 1.00 0.00 H new ATOM 0 HB2 CYS A 46 12.306 1.077 -4.104 1.00 0.00 H new ATOM 0 HB3 CYS A 46 13.826 0.447 -4.707 1.00 0.00 H new ATOM 0 HG CYS A 46 11.259 -0.362 -6.739 1.00 0.00 H new ATOM 654 N TYR A 47 10.073 -1.224 -3.519 1.00 0.00 N ATOM 655 CA TYR A 47 8.653 -1.502 -3.652 1.00 0.00 C ATOM 656 C TYR A 47 7.824 -0.541 -2.798 1.00 0.00 C ATOM 657 O TYR A 47 8.314 -0.009 -1.802 1.00 0.00 O ATOM 658 CB TYR A 47 8.452 -2.928 -3.135 1.00 0.00 C ATOM 659 CG TYR A 47 8.853 -3.121 -1.671 1.00 0.00 C ATOM 660 CD1 TYR A 47 10.148 -3.475 -1.351 1.00 0.00 C ATOM 661 CD2 TYR A 47 7.920 -2.941 -0.670 1.00 0.00 C ATOM 662 CE1 TYR A 47 10.526 -3.658 0.026 1.00 0.00 C ATOM 663 CE2 TYR A 47 8.298 -3.123 0.708 1.00 0.00 C ATOM 664 CZ TYR A 47 9.582 -3.473 0.988 1.00 0.00 C ATOM 665 OH TYR A 47 9.939 -3.644 2.289 1.00 0.00 O ATOM 0 H TYR A 47 10.356 -0.882 -2.601 1.00 0.00 H new ATOM 0 HA TYR A 47 8.334 -1.384 -4.688 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.404 -3.202 -3.253 1.00 0.00 H new ATOM 0 HB3 TYR A 47 9.032 -3.613 -3.753 1.00 0.00 H new ATOM 0 HD1 TYR A 47 10.878 -3.615 -2.134 1.00 0.00 H new ATOM 0 HD2 TYR A 47 6.907 -2.664 -0.920 1.00 0.00 H new ATOM 0 HE1 TYR A 47 11.536 -3.936 0.289 1.00 0.00 H new ATOM 0 HE2 TYR A 47 7.578 -2.985 1.501 1.00 0.00 H new ATOM 0 HH TYR A 47 9.164 -3.478 2.865 1.00 0.00 H new ATOM 675 N VAL A 48 6.583 -0.347 -3.218 1.00 0.00 N ATOM 676 CA VAL A 48 5.681 0.541 -2.504 1.00 0.00 C ATOM 677 C VAL A 48 4.889 -0.265 -1.472 1.00 0.00 C ATOM 678 O VAL A 48 4.594 -1.439 -1.691 1.00 0.00 O ATOM 679 CB VAL A 48 4.786 1.286 -3.496 1.00 0.00 C ATOM 680 CG1 VAL A 48 4.010 2.406 -2.800 1.00 0.00 C ATOM 681 CG2 VAL A 48 5.603 1.832 -4.669 1.00 0.00 C ATOM 0 H VAL A 48 6.180 -0.790 -4.044 1.00 0.00 H new ATOM 0 HA VAL A 48 6.243 1.300 -1.961 1.00 0.00 H new ATOM 0 HB VAL A 48 4.063 0.574 -3.894 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.382 2.920 -3.528 1.00 0.00 H new ATOM 0 HG12 VAL A 48 3.384 1.982 -2.015 1.00 0.00 H new ATOM 0 HG13 VAL A 48 4.711 3.116 -2.361 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.943 2.357 -5.359 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.360 2.522 -4.295 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.089 1.007 -5.189 1.00 0.00 H new ATOM 691 N GLN A 49 4.568 0.397 -0.371 1.00 0.00 N ATOM 692 CA GLN A 49 3.816 -0.243 0.695 1.00 0.00 C ATOM 693 C GLN A 49 2.816 0.742 1.305 1.00 0.00 C ATOM 694 O GLN A 49 3.198 1.823 1.752 1.00 0.00 O ATOM 695 CB GLN A 49 4.753 -0.807 1.765 1.00 0.00 C ATOM 696 CG GLN A 49 3.986 -1.678 2.761 1.00 0.00 C ATOM 697 CD GLN A 49 4.612 -1.599 4.155 1.00 0.00 C ATOM 698 OE1 GLN A 49 5.719 -2.053 4.393 1.00 0.00 O ATOM 699 NE2 GLN A 49 3.844 -0.999 5.060 1.00 0.00 N ATOM 0 H GLN A 49 4.815 1.371 -0.194 1.00 0.00 H new ATOM 0 HA GLN A 49 3.260 -1.078 0.270 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.539 -1.396 1.292 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.242 0.011 2.293 1.00 0.00 H new ATOM 0 HG2 GLN A 49 2.946 -1.355 2.807 1.00 0.00 H new ATOM 0 HG3 GLN A 49 3.983 -2.713 2.418 1.00 0.00 H new ATOM 0 HE21 GLN A 49 2.927 -0.641 4.794 1.00 0.00 H new ATOM 0 HE22 GLN A 49 4.172 -0.897 6.020 1.00 0.00 H new ATOM 708 N GLY A 50 1.556 0.333 1.304 1.00 0.00 N ATOM 709 CA GLY A 50 0.499 1.166 1.852 1.00 0.00 C ATOM 710 C GLY A 50 -0.200 0.467 3.020 1.00 0.00 C ATOM 711 O GLY A 50 -0.655 -0.668 2.887 1.00 0.00 O ATOM 0 H GLY A 50 1.243 -0.564 0.933 1.00 0.00 H new ATOM 0 HA2 GLY A 50 0.917 2.115 2.189 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -0.228 1.396 1.073 1.00 0.00 H new ATOM 715 N SER A 51 -0.264 1.174 4.139 1.00 0.00 N ATOM 716 CA SER A 51 -0.900 0.636 5.329 1.00 0.00 C ATOM 717 C SER A 51 -2.113 1.489 5.706 1.00 0.00 C ATOM 718 O SER A 51 -2.111 2.702 5.500 1.00 0.00 O ATOM 719 CB SER A 51 0.085 0.569 6.498 1.00 0.00 C ATOM 720 OG SER A 51 -0.371 -0.298 7.532 1.00 0.00 O ATOM 0 H SER A 51 0.114 2.115 4.246 1.00 0.00 H new ATOM 0 HA SER A 51 -1.232 -0.379 5.110 1.00 0.00 H new ATOM 0 HB2 SER A 51 1.054 0.224 6.136 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.235 1.570 6.904 1.00 0.00 H new ATOM 0 HG SER A 51 -1.274 -0.615 7.319 1.00 0.00 H new ATOM 726 N VAL A 52 -3.120 0.822 6.250 1.00 0.00 N ATOM 727 CA VAL A 52 -4.336 1.504 6.657 1.00 0.00 C ATOM 728 C VAL A 52 -4.621 1.195 8.128 1.00 0.00 C ATOM 729 O VAL A 52 -4.298 0.112 8.613 1.00 0.00 O ATOM 730 CB VAL A 52 -5.490 1.115 5.730 1.00 0.00 C ATOM 731 CG1 VAL A 52 -6.761 0.821 6.530 1.00 0.00 C ATOM 732 CG2 VAL A 52 -5.741 2.200 4.682 1.00 0.00 C ATOM 0 H VAL A 52 -3.118 -0.184 6.418 1.00 0.00 H new ATOM 0 HA VAL A 52 -4.216 2.584 6.569 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.205 0.203 5.206 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -7.565 0.547 5.847 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -6.575 -0.002 7.220 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -7.050 1.708 7.093 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -6.566 1.898 4.036 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -5.994 3.136 5.180 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -4.842 2.340 4.081 1.00 0.00 H new ATOM 742 N ALA A 53 -5.223 2.167 8.798 1.00 0.00 N ATOM 743 CA ALA A 53 -5.555 2.012 10.204 1.00 0.00 C ATOM 744 C ALA A 53 -7.030 2.360 10.417 1.00 0.00 C ATOM 745 O ALA A 53 -7.424 3.518 10.283 1.00 0.00 O ATOM 746 CB ALA A 53 -4.623 2.884 11.048 1.00 0.00 C ATOM 0 H ALA A 53 -5.489 3.065 8.393 1.00 0.00 H new ATOM 0 HA ALA A 53 -5.411 0.979 10.520 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -4.872 2.768 12.103 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -3.590 2.578 10.883 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -4.742 3.929 10.760 1.00 0.00 H new ATOM 752 N ASN A 54 -7.805 1.337 10.745 1.00 0.00 N ATOM 753 CA ASN A 54 -9.228 1.521 10.978 1.00 0.00 C ATOM 754 C ASN A 54 -9.539 1.243 12.450 1.00 0.00 C ATOM 755 O ASN A 54 -8.693 0.733 13.182 1.00 0.00 O ATOM 756 CB ASN A 54 -10.054 0.552 10.129 1.00 0.00 C ATOM 757 CG ASN A 54 -9.210 -0.645 9.685 1.00 0.00 C ATOM 758 OD1 ASN A 54 -8.371 -1.150 10.413 1.00 0.00 O ATOM 759 ND2 ASN A 54 -9.479 -1.069 8.454 1.00 0.00 N ATOM 0 H ASN A 54 -7.475 0.378 10.855 1.00 0.00 H new ATOM 0 HA ASN A 54 -9.485 2.546 10.709 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -10.913 0.203 10.702 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -10.444 1.071 9.254 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -8.970 -1.863 8.065 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -10.194 -0.600 7.898 1.00 0.00 H new ATOM 766 N ARG A 55 -10.757 1.592 12.840 1.00 0.00 N ATOM 767 CA ARG A 55 -11.191 1.387 14.211 1.00 0.00 C ATOM 768 C ARG A 55 -11.227 -0.107 14.539 1.00 0.00 C ATOM 769 O ARG A 55 -11.336 -0.488 15.703 1.00 0.00 O ATOM 770 CB ARG A 55 -12.578 1.988 14.445 1.00 0.00 C ATOM 771 CG ARG A 55 -12.493 3.238 15.323 1.00 0.00 C ATOM 772 CD ARG A 55 -11.965 4.433 14.526 1.00 0.00 C ATOM 773 NE ARG A 55 -12.157 5.681 15.298 1.00 0.00 N ATOM 774 CZ ARG A 55 -11.439 6.013 16.380 1.00 0.00 C ATOM 775 NH1 ARG A 55 -10.477 5.192 16.823 1.00 0.00 N ATOM 776 NH2 ARG A 55 -11.682 7.166 17.017 1.00 0.00 N ATOM 0 H ARG A 55 -11.456 2.015 12.230 1.00 0.00 H new ATOM 0 HA ARG A 55 -10.476 1.888 14.864 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.034 2.242 13.488 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -13.223 1.249 14.920 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -13.479 3.472 15.726 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -11.839 3.046 16.173 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -10.907 4.293 14.303 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -12.486 4.503 13.571 1.00 0.00 H new ATOM 0 HE ARG A 55 -12.881 6.329 14.987 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -10.291 4.315 16.337 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -9.930 5.444 17.646 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -12.413 7.791 16.679 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -11.136 7.419 17.840 1.00 0.00 H new ATOM 790 N THR A 56 -11.135 -0.912 13.491 1.00 0.00 N ATOM 791 CA THR A 56 -11.156 -2.356 13.652 1.00 0.00 C ATOM 792 C THR A 56 -9.736 -2.893 13.841 1.00 0.00 C ATOM 793 O THR A 56 -9.537 -3.920 14.488 1.00 0.00 O ATOM 794 CB THR A 56 -11.877 -2.957 12.444 1.00 0.00 C ATOM 795 OG1 THR A 56 -11.110 -2.515 11.327 1.00 0.00 O ATOM 796 CG2 THR A 56 -13.257 -2.336 12.217 1.00 0.00 C ATOM 0 H THR A 56 -11.046 -0.592 12.527 1.00 0.00 H new ATOM 0 HA THR A 56 -11.701 -2.645 14.551 1.00 0.00 H new ATOM 0 HB THR A 56 -11.981 -4.033 12.582 1.00 0.00 H new ATOM 0 HG1 THR A 56 -11.507 -2.861 10.500 1.00 0.00 H new ATOM 0 HG21 THR A 56 -13.725 -2.798 11.348 1.00 0.00 H new ATOM 0 HG22 THR A 56 -13.880 -2.502 13.096 1.00 0.00 H new ATOM 0 HG23 THR A 56 -13.150 -1.265 12.045 1.00 0.00 H new ATOM 804 N GLY A 57 -8.785 -2.174 13.264 1.00 0.00 N ATOM 805 CA GLY A 57 -7.388 -2.564 13.360 1.00 0.00 C ATOM 806 C GLY A 57 -6.539 -1.825 12.324 1.00 0.00 C ATOM 807 O GLY A 57 -6.614 -0.603 12.213 1.00 0.00 O ATOM 0 H GLY A 57 -8.954 -1.323 12.728 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -7.015 -2.349 14.361 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -7.296 -3.640 13.210 1.00 0.00 H new ATOM 811 N SER A 58 -5.752 -2.599 11.591 1.00 0.00 N ATOM 812 CA SER A 58 -4.890 -2.033 10.567 1.00 0.00 C ATOM 813 C SER A 58 -4.651 -3.059 9.458 1.00 0.00 C ATOM 814 O SER A 58 -4.839 -4.257 9.665 1.00 0.00 O ATOM 815 CB SER A 58 -3.557 -1.574 11.162 1.00 0.00 C ATOM 816 OG SER A 58 -2.735 -2.674 11.542 1.00 0.00 O ATOM 0 H SER A 58 -5.693 -3.613 11.686 1.00 0.00 H new ATOM 0 HA SER A 58 -5.388 -1.161 10.144 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.027 -0.960 10.434 1.00 0.00 H new ATOM 0 HB3 SER A 58 -3.746 -0.945 12.032 1.00 0.00 H new ATOM 0 HG SER A 58 -1.893 -2.339 11.916 1.00 0.00 H new ATOM 822 N VAL A 59 -4.239 -2.552 8.305 1.00 0.00 N ATOM 823 CA VAL A 59 -3.973 -3.410 7.163 1.00 0.00 C ATOM 824 C VAL A 59 -2.701 -2.933 6.458 1.00 0.00 C ATOM 825 O VAL A 59 -2.206 -1.841 6.735 1.00 0.00 O ATOM 826 CB VAL A 59 -5.192 -3.445 6.239 1.00 0.00 C ATOM 827 CG1 VAL A 59 -6.299 -4.323 6.825 1.00 0.00 C ATOM 828 CG2 VAL A 59 -5.705 -2.032 5.955 1.00 0.00 C ATOM 0 H VAL A 59 -4.083 -1.558 8.137 1.00 0.00 H new ATOM 0 HA VAL A 59 -3.799 -4.436 7.488 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.882 -3.885 5.291 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.154 -4.331 6.149 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.928 -5.340 6.952 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.605 -3.925 7.792 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -6.572 -2.085 5.296 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -5.990 -1.553 6.892 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -4.919 -1.449 5.475 1.00 0.00 H new ATOM 838 N GLU A 60 -2.210 -3.774 5.560 1.00 0.00 N ATOM 839 CA GLU A 60 -1.006 -3.451 4.813 1.00 0.00 C ATOM 840 C GLU A 60 -1.001 -4.186 3.471 1.00 0.00 C ATOM 841 O GLU A 60 -1.715 -5.173 3.297 1.00 0.00 O ATOM 842 CB GLU A 60 0.248 -3.783 5.624 1.00 0.00 C ATOM 843 CG GLU A 60 0.564 -2.670 6.626 1.00 0.00 C ATOM 844 CD GLU A 60 1.875 -2.951 7.363 1.00 0.00 C ATOM 845 OE1 GLU A 60 2.925 -2.920 6.685 1.00 0.00 O ATOM 846 OE2 GLU A 60 1.797 -3.191 8.587 1.00 0.00 O ATOM 0 H GLU A 60 -2.624 -4.678 5.333 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.000 -2.379 4.618 1.00 0.00 H new ATOM 0 HB2 GLU A 60 0.104 -4.724 6.154 1.00 0.00 H new ATOM 0 HB3 GLU A 60 1.094 -3.923 4.951 1.00 0.00 H new ATOM 0 HG2 GLU A 60 0.633 -1.715 6.104 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -0.250 -2.582 7.346 1.00 0.00 H new ATOM 853 N ALA A 61 -0.188 -3.678 2.557 1.00 0.00 N ATOM 854 CA ALA A 61 -0.081 -4.273 1.236 1.00 0.00 C ATOM 855 C ALA A 61 1.082 -3.625 0.482 1.00 0.00 C ATOM 856 O ALA A 61 1.582 -2.577 0.887 1.00 0.00 O ATOM 857 CB ALA A 61 -1.412 -4.121 0.498 1.00 0.00 C ATOM 0 H ALA A 61 0.403 -2.860 2.705 1.00 0.00 H new ATOM 0 HA ALA A 61 0.129 -5.340 1.312 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -1.332 -4.567 -0.493 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -2.199 -4.624 1.060 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -1.655 -3.063 0.401 1.00 0.00 H new ATOM 863 N GLN A 62 1.478 -4.276 -0.602 1.00 0.00 N ATOM 864 CA GLN A 62 2.572 -3.775 -1.417 1.00 0.00 C ATOM 865 C GLN A 62 2.514 -4.388 -2.818 1.00 0.00 C ATOM 866 O GLN A 62 1.729 -5.301 -3.068 1.00 0.00 O ATOM 867 CB GLN A 62 3.922 -4.054 -0.753 1.00 0.00 C ATOM 868 CG GLN A 62 3.995 -5.493 -0.240 1.00 0.00 C ATOM 869 CD GLN A 62 4.681 -6.405 -1.259 1.00 0.00 C ATOM 870 OE1 GLN A 62 4.088 -6.857 -2.224 1.00 0.00 O ATOM 871 NE2 GLN A 62 5.961 -6.648 -0.991 1.00 0.00 N ATOM 0 H GLN A 62 1.061 -5.145 -0.935 1.00 0.00 H new ATOM 0 HA GLN A 62 2.465 -2.694 -1.509 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.726 -3.878 -1.468 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.074 -3.361 0.075 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.542 -5.519 0.703 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.990 -5.861 -0.036 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.396 -6.237 -0.165 1.00 0.00 H new ATOM 0 HE22 GLN A 62 6.508 -7.245 -1.612 1.00 0.00 H new ATOM 880 N THR A 63 3.356 -3.861 -3.695 1.00 0.00 N ATOM 881 CA THR A 63 3.410 -4.344 -5.064 1.00 0.00 C ATOM 882 C THR A 63 4.596 -5.293 -5.248 1.00 0.00 C ATOM 883 O THR A 63 5.342 -5.550 -4.304 1.00 0.00 O ATOM 884 CB THR A 63 3.454 -3.129 -5.993 1.00 0.00 C ATOM 885 OG1 THR A 63 4.566 -2.372 -5.522 1.00 0.00 O ATOM 886 CG2 THR A 63 2.258 -2.197 -5.795 1.00 0.00 C ATOM 0 H THR A 63 4.006 -3.104 -3.484 1.00 0.00 H new ATOM 0 HA THR A 63 2.524 -4.929 -5.312 1.00 0.00 H new ATOM 0 HB THR A 63 3.484 -3.466 -7.029 1.00 0.00 H new ATOM 0 HG1 THR A 63 5.208 -2.245 -6.252 1.00 0.00 H new ATOM 0 HG21 THR A 63 2.338 -1.352 -6.478 1.00 0.00 H new ATOM 0 HG22 THR A 63 1.335 -2.741 -5.998 1.00 0.00 H new ATOM 0 HG23 THR A 63 2.246 -1.833 -4.768 1.00 0.00 H new ATOM 894 N ALA A 64 4.733 -5.788 -6.469 1.00 0.00 N ATOM 895 CA ALA A 64 5.815 -6.703 -6.789 1.00 0.00 C ATOM 896 C ALA A 64 7.127 -5.921 -6.883 1.00 0.00 C ATOM 897 O ALA A 64 7.172 -4.846 -7.479 1.00 0.00 O ATOM 898 CB ALA A 64 5.488 -7.450 -8.084 1.00 0.00 C ATOM 0 H ALA A 64 4.112 -5.573 -7.249 1.00 0.00 H new ATOM 0 HA ALA A 64 5.931 -7.449 -6.003 1.00 0.00 H new ATOM 0 HB1 ALA A 64 6.300 -8.136 -8.323 1.00 0.00 H new ATOM 0 HB2 ALA A 64 4.563 -8.013 -7.956 1.00 0.00 H new ATOM 0 HB3 ALA A 64 5.367 -6.734 -8.897 1.00 0.00 H new ATOM 904 N LEU A 65 8.163 -6.492 -6.286 1.00 0.00 N ATOM 905 CA LEU A 65 9.473 -5.862 -6.295 1.00 0.00 C ATOM 906 C LEU A 65 9.816 -5.430 -7.722 1.00 0.00 C ATOM 907 O LEU A 65 9.348 -6.033 -8.687 1.00 0.00 O ATOM 908 CB LEU A 65 10.516 -6.786 -5.665 1.00 0.00 C ATOM 909 CG LEU A 65 10.540 -6.825 -4.135 1.00 0.00 C ATOM 910 CD1 LEU A 65 10.749 -5.425 -3.554 1.00 0.00 C ATOM 911 CD2 LEU A 65 9.279 -7.493 -3.584 1.00 0.00 C ATOM 0 H LEU A 65 8.122 -7.384 -5.793 1.00 0.00 H new ATOM 0 HA LEU A 65 9.467 -4.961 -5.681 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.345 -7.798 -6.032 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.502 -6.482 -6.017 1.00 0.00 H new ATOM 0 HG LEU A 65 11.389 -7.433 -3.822 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.762 -5.481 -2.466 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.698 -5.022 -3.908 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.936 -4.773 -3.874 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.321 -7.508 -2.495 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.401 -6.933 -3.905 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.215 -8.515 -3.958 1.00 0.00 H new ATOM 923 N LYS A 66 10.631 -4.389 -7.811 1.00 0.00 N ATOM 924 CA LYS A 66 11.043 -3.870 -9.104 1.00 0.00 C ATOM 925 C LYS A 66 12.445 -3.269 -8.985 1.00 0.00 C ATOM 926 O LYS A 66 12.775 -2.652 -7.973 1.00 0.00 O ATOM 927 CB LYS A 66 9.999 -2.891 -9.646 1.00 0.00 C ATOM 928 CG LYS A 66 8.864 -3.636 -10.353 1.00 0.00 C ATOM 929 CD LYS A 66 8.638 -3.082 -11.760 1.00 0.00 C ATOM 930 CE LYS A 66 7.235 -3.425 -12.266 1.00 0.00 C ATOM 931 NZ LYS A 66 6.956 -2.722 -13.538 1.00 0.00 N ATOM 0 H LYS A 66 11.017 -3.891 -7.009 1.00 0.00 H new ATOM 0 HA LYS A 66 11.102 -4.676 -9.836 1.00 0.00 H new ATOM 0 HB2 LYS A 66 9.594 -2.296 -8.828 1.00 0.00 H new ATOM 0 HB3 LYS A 66 10.472 -2.197 -10.341 1.00 0.00 H new ATOM 0 HG2 LYS A 66 9.102 -4.698 -10.410 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.947 -3.546 -9.771 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.772 -2.000 -11.755 1.00 0.00 H new ATOM 0 HD3 LYS A 66 9.384 -3.492 -12.440 1.00 0.00 H new ATOM 0 HE2 LYS A 66 7.148 -4.502 -12.412 1.00 0.00 H new ATOM 0 HE3 LYS A 66 6.494 -3.144 -11.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.105 -3.126 -13.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.801 -1.711 -13.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.766 -2.834 -14.181 1.00 0.00 H new ATOM 945 N LYS A 67 13.231 -3.470 -10.032 1.00 0.00 N ATOM 946 CA LYS A 67 14.590 -2.955 -10.057 1.00 0.00 C ATOM 947 C LYS A 67 14.559 -1.436 -9.881 1.00 0.00 C ATOM 948 O LYS A 67 13.734 -0.754 -10.487 1.00 0.00 O ATOM 949 CB LYS A 67 15.313 -3.412 -11.326 1.00 0.00 C ATOM 950 CG LYS A 67 15.392 -2.279 -12.350 1.00 0.00 C ATOM 951 CD LYS A 67 14.020 -2.002 -12.969 1.00 0.00 C ATOM 952 CE LYS A 67 13.703 -3.013 -14.072 1.00 0.00 C ATOM 953 NZ LYS A 67 13.233 -2.319 -15.292 1.00 0.00 N ATOM 0 H LYS A 67 12.953 -3.982 -10.869 1.00 0.00 H new ATOM 0 HA LYS A 67 15.166 -3.361 -9.225 1.00 0.00 H new ATOM 0 HB2 LYS A 67 16.318 -3.750 -11.074 1.00 0.00 H new ATOM 0 HB3 LYS A 67 14.790 -4.264 -11.760 1.00 0.00 H new ATOM 0 HG2 LYS A 67 15.767 -1.375 -11.870 1.00 0.00 H new ATOM 0 HG3 LYS A 67 16.102 -2.542 -13.134 1.00 0.00 H new ATOM 0 HD2 LYS A 67 13.252 -2.048 -12.197 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.999 -0.992 -13.379 1.00 0.00 H new ATOM 0 HE2 LYS A 67 14.592 -3.601 -14.301 1.00 0.00 H new ATOM 0 HE3 LYS A 67 12.940 -3.710 -13.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 13.022 -3.020 -16.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 12.373 -1.777 -15.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 13.973 -1.672 -15.630 1.00 0.00 H new ATOM 967 N ARG A 68 15.467 -0.950 -9.047 1.00 0.00 N ATOM 968 CA ARG A 68 15.554 0.476 -8.784 1.00 0.00 C ATOM 969 C ARG A 68 15.724 1.249 -10.093 1.00 0.00 C ATOM 970 O ARG A 68 16.562 0.896 -10.922 1.00 0.00 O ATOM 971 CB ARG A 68 16.728 0.794 -7.856 1.00 0.00 C ATOM 972 CG ARG A 68 18.062 0.442 -8.518 1.00 0.00 C ATOM 973 CD ARG A 68 19.008 -0.231 -7.522 1.00 0.00 C ATOM 974 NE ARG A 68 20.227 0.591 -7.348 1.00 0.00 N ATOM 975 CZ ARG A 68 21.215 0.671 -8.249 1.00 0.00 C ATOM 976 NH1 ARG A 68 21.134 -0.020 -9.394 1.00 0.00 N ATOM 977 NH2 ARG A 68 22.283 1.442 -8.006 1.00 0.00 N ATOM 0 H ARG A 68 16.149 -1.519 -8.545 1.00 0.00 H new ATOM 0 HA ARG A 68 14.627 0.780 -8.297 1.00 0.00 H new ATOM 0 HB2 ARG A 68 16.715 1.853 -7.597 1.00 0.00 H new ATOM 0 HB3 ARG A 68 16.622 0.237 -6.925 1.00 0.00 H new ATOM 0 HG2 ARG A 68 17.888 -0.222 -9.365 1.00 0.00 H new ATOM 0 HG3 ARG A 68 18.526 1.346 -8.912 1.00 0.00 H new ATOM 0 HD2 ARG A 68 18.507 -0.361 -6.563 1.00 0.00 H new ATOM 0 HD3 ARG A 68 19.277 -1.225 -7.878 1.00 0.00 H new ATOM 0 HE ARG A 68 20.320 1.131 -6.487 1.00 0.00 H new ATOM 0 HH11 ARG A 68 20.320 -0.607 -9.579 1.00 0.00 H new ATOM 0 HH12 ARG A 68 21.886 0.041 -10.080 1.00 0.00 H new ATOM 0 HH21 ARG A 68 22.344 1.969 -7.135 1.00 0.00 H new ATOM 0 HH22 ARG A 68 23.035 1.503 -8.692 1.00 0.00 H new ATOM 991 N GLN A 69 14.916 2.289 -10.239 1.00 0.00 N ATOM 992 CA GLN A 69 14.967 3.114 -11.434 1.00 0.00 C ATOM 993 C GLN A 69 14.602 4.561 -11.095 1.00 0.00 C ATOM 994 O GLN A 69 13.886 4.814 -10.127 1.00 0.00 O ATOM 995 CB GLN A 69 14.048 2.558 -12.524 1.00 0.00 C ATOM 996 CG GLN A 69 14.761 1.480 -13.343 1.00 0.00 C ATOM 997 CD GLN A 69 16.068 2.013 -13.931 1.00 0.00 C ATOM 998 OE1 GLN A 69 16.161 3.142 -14.384 1.00 0.00 O ATOM 999 NE2 GLN A 69 17.072 1.140 -13.900 1.00 0.00 N ATOM 0 H GLN A 69 14.222 2.579 -9.550 1.00 0.00 H new ATOM 0 HA GLN A 69 15.986 3.097 -11.821 1.00 0.00 H new ATOM 0 HB2 GLN A 69 13.150 2.140 -12.069 1.00 0.00 H new ATOM 0 HB3 GLN A 69 13.726 3.366 -13.181 1.00 0.00 H new ATOM 0 HG2 GLN A 69 14.968 0.616 -12.712 1.00 0.00 H new ATOM 0 HG3 GLN A 69 14.109 1.138 -14.147 1.00 0.00 H new ATOM 0 HE21 GLN A 69 16.927 0.210 -13.507 1.00 0.00 H new ATOM 0 HE22 GLN A 69 17.986 1.401 -14.270 1.00 0.00 H new ATOM 1008 N LEU A 70 15.110 5.472 -11.911 1.00 0.00 N ATOM 1009 CA LEU A 70 14.846 6.887 -11.710 1.00 0.00 C ATOM 1010 C LEU A 70 13.335 7.123 -11.697 1.00 0.00 C ATOM 1011 O LEU A 70 12.857 8.076 -11.083 1.00 0.00 O ATOM 1012 CB LEU A 70 15.590 7.724 -12.753 1.00 0.00 C ATOM 1013 CG LEU A 70 16.001 9.131 -12.314 1.00 0.00 C ATOM 1014 CD1 LEU A 70 14.783 9.948 -11.879 1.00 0.00 C ATOM 1015 CD2 LEU A 70 17.072 9.074 -11.223 1.00 0.00 C ATOM 0 H LEU A 70 15.703 5.258 -12.713 1.00 0.00 H new ATOM 0 HA LEU A 70 15.228 7.212 -10.742 1.00 0.00 H new ATOM 0 HB2 LEU A 70 16.487 7.182 -13.053 1.00 0.00 H new ATOM 0 HB3 LEU A 70 14.959 7.811 -13.638 1.00 0.00 H new ATOM 0 HG LEU A 70 16.441 9.641 -13.171 1.00 0.00 H new ATOM 0 HD11 LEU A 70 15.103 10.944 -11.572 1.00 0.00 H new ATOM 0 HD12 LEU A 70 14.085 10.032 -12.712 1.00 0.00 H new ATOM 0 HD13 LEU A 70 14.291 9.451 -11.043 1.00 0.00 H new ATOM 0 HD21 LEU A 70 17.346 10.087 -10.929 1.00 0.00 H new ATOM 0 HD22 LEU A 70 16.682 8.538 -10.358 1.00 0.00 H new ATOM 0 HD23 LEU A 70 17.952 8.556 -11.604 1.00 0.00 H new ATOM 1027 N HIS A 71 12.624 6.238 -12.381 1.00 0.00 N ATOM 1028 CA HIS A 71 11.176 6.338 -12.455 1.00 0.00 C ATOM 1029 C HIS A 71 10.571 4.939 -12.582 1.00 0.00 C ATOM 1030 O HIS A 71 10.210 4.512 -13.677 1.00 0.00 O ATOM 1031 CB HIS A 71 10.754 7.272 -13.592 1.00 0.00 C ATOM 1032 CG HIS A 71 9.260 7.462 -13.707 1.00 0.00 C ATOM 1033 ND1 HIS A 71 8.635 7.781 -14.900 1.00 0.00 N ATOM 1034 CD2 HIS A 71 8.275 7.374 -12.768 1.00 0.00 C ATOM 1035 CE1 HIS A 71 7.333 7.879 -14.676 1.00 0.00 C ATOM 1036 NE2 HIS A 71 7.112 7.627 -13.354 1.00 0.00 N ATOM 0 H HIS A 71 13.024 5.449 -12.889 1.00 0.00 H new ATOM 0 HA HIS A 71 10.791 6.781 -11.536 1.00 0.00 H new ATOM 0 HB2 HIS A 71 11.223 8.244 -13.443 1.00 0.00 H new ATOM 0 HB3 HIS A 71 11.133 6.876 -14.534 1.00 0.00 H new ATOM 0 HD1 HIS A 71 9.098 7.917 -15.799 1.00 0.00 H new ATOM 0 HD2 HIS A 71 8.418 7.138 -11.724 1.00 0.00 H new ATOM 0 HE1 HIS A 71 6.579 8.117 -15.411 1.00 0.00 H new ATOM 1044 N THR A 72 10.479 4.264 -11.446 1.00 0.00 N ATOM 1045 CA THR A 72 9.924 2.922 -11.416 1.00 0.00 C ATOM 1046 C THR A 72 8.398 2.973 -11.508 1.00 0.00 C ATOM 1047 O THR A 72 7.777 3.932 -11.051 1.00 0.00 O ATOM 1048 CB THR A 72 10.433 2.228 -10.150 1.00 0.00 C ATOM 1049 OG1 THR A 72 11.850 2.229 -10.300 1.00 0.00 O ATOM 1050 CG2 THR A 72 10.064 0.743 -10.108 1.00 0.00 C ATOM 0 H THR A 72 10.780 4.622 -10.539 1.00 0.00 H new ATOM 0 HA THR A 72 10.251 2.340 -12.278 1.00 0.00 H new ATOM 0 HB THR A 72 10.025 2.729 -9.272 1.00 0.00 H new ATOM 0 HG1 THR A 72 12.262 1.799 -9.522 1.00 0.00 H new ATOM 0 HG21 THR A 72 10.449 0.298 -9.190 1.00 0.00 H new ATOM 0 HG22 THR A 72 8.980 0.637 -10.136 1.00 0.00 H new ATOM 0 HG23 THR A 72 10.501 0.235 -10.968 1.00 0.00 H new ATOM 1058 N THR A 73 7.837 1.930 -12.102 1.00 0.00 N ATOM 1059 CA THR A 73 6.395 1.845 -12.260 1.00 0.00 C ATOM 1060 C THR A 73 5.918 0.408 -12.038 1.00 0.00 C ATOM 1061 O THR A 73 6.665 -0.541 -12.271 1.00 0.00 O ATOM 1062 CB THR A 73 6.037 2.397 -13.642 1.00 0.00 C ATOM 1063 OG1 THR A 73 6.778 1.580 -14.545 1.00 0.00 O ATOM 1064 CG2 THR A 73 6.593 3.804 -13.872 1.00 0.00 C ATOM 0 H THR A 73 8.355 1.137 -12.480 1.00 0.00 H new ATOM 0 HA THR A 73 5.879 2.445 -11.511 1.00 0.00 H new ATOM 0 HB THR A 73 4.953 2.411 -13.758 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.603 1.868 -15.465 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.311 4.149 -14.867 1.00 0.00 H new ATOM 0 HG22 THR A 73 6.185 4.483 -13.123 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.680 3.784 -13.790 1.00 0.00 H new ATOM 1072 N TRP A 74 4.677 0.294 -11.590 1.00 0.00 N ATOM 1073 CA TRP A 74 4.091 -1.011 -11.333 1.00 0.00 C ATOM 1074 C TRP A 74 2.831 -1.141 -12.191 1.00 0.00 C ATOM 1075 O TRP A 74 2.424 -0.186 -12.851 1.00 0.00 O ATOM 1076 CB TRP A 74 3.821 -1.207 -9.840 1.00 0.00 C ATOM 1077 CG TRP A 74 5.085 -1.371 -8.994 1.00 0.00 C ATOM 1078 CD1 TRP A 74 5.657 -2.508 -8.576 1.00 0.00 C ATOM 1079 CD2 TRP A 74 5.918 -0.311 -8.478 1.00 0.00 C ATOM 1080 NE1 TRP A 74 6.791 -2.260 -7.831 1.00 0.00 N ATOM 1081 CE2 TRP A 74 6.955 -0.881 -7.770 1.00 0.00 C ATOM 1082 CE3 TRP A 74 5.798 1.084 -8.606 1.00 0.00 C ATOM 1083 CZ2 TRP A 74 7.952 -0.132 -7.133 1.00 0.00 C ATOM 1084 CZ3 TRP A 74 6.802 1.819 -7.964 1.00 0.00 C ATOM 1085 CH2 TRP A 74 7.853 1.259 -7.247 1.00 0.00 C ATOM 0 H TRP A 74 4.061 1.084 -11.398 1.00 0.00 H new ATOM 0 HA TRP A 74 4.784 -1.806 -11.610 1.00 0.00 H new ATOM 0 HB2 TRP A 74 3.256 -0.352 -9.468 1.00 0.00 H new ATOM 0 HB3 TRP A 74 3.191 -2.087 -9.708 1.00 0.00 H new ATOM 0 HD1 TRP A 74 5.278 -3.495 -8.795 1.00 0.00 H new ATOM 0 HE1 TRP A 74 7.398 -2.960 -7.403 1.00 0.00 H new ATOM 0 HE3 TRP A 74 4.995 1.552 -9.156 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 8.754 -0.603 -6.583 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 6.757 2.896 -8.030 1.00 0.00 H new ATOM 0 HH2 TRP A 74 8.590 1.895 -6.780 1.00 0.00 H new ATOM 1096 N GLU A 75 2.249 -2.331 -12.154 1.00 0.00 N ATOM 1097 CA GLU A 75 1.043 -2.598 -12.920 1.00 0.00 C ATOM 1098 C GLU A 75 -0.173 -2.656 -11.993 1.00 0.00 C ATOM 1099 O GLU A 75 -1.210 -2.064 -12.286 1.00 0.00 O ATOM 1100 CB GLU A 75 1.181 -3.891 -13.726 1.00 0.00 C ATOM 1101 CG GLU A 75 1.686 -3.604 -15.141 1.00 0.00 C ATOM 1102 CD GLU A 75 3.025 -4.298 -15.397 1.00 0.00 C ATOM 1103 OE1 GLU A 75 3.256 -5.342 -14.749 1.00 0.00 O ATOM 1104 OE2 GLU A 75 3.788 -3.769 -16.234 1.00 0.00 O ATOM 0 H GLU A 75 2.590 -3.121 -11.606 1.00 0.00 H new ATOM 0 HA GLU A 75 0.897 -1.782 -13.627 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.870 -4.567 -13.220 1.00 0.00 H new ATOM 0 HB3 GLU A 75 0.217 -4.397 -13.776 1.00 0.00 H new ATOM 0 HG2 GLU A 75 0.950 -3.945 -15.870 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.797 -2.529 -15.280 1.00 0.00 H new ATOM 1111 N GLU A 76 -0.004 -3.376 -10.893 1.00 0.00 N ATOM 1112 CA GLU A 76 -1.075 -3.519 -9.922 1.00 0.00 C ATOM 1113 C GLU A 76 -0.922 -2.482 -8.807 1.00 0.00 C ATOM 1114 O GLU A 76 0.037 -1.712 -8.797 1.00 0.00 O ATOM 1115 CB GLU A 76 -1.110 -4.938 -9.350 1.00 0.00 C ATOM 1116 CG GLU A 76 0.132 -5.219 -8.503 1.00 0.00 C ATOM 1117 CD GLU A 76 0.005 -6.555 -7.769 1.00 0.00 C ATOM 1118 OE1 GLU A 76 -0.770 -6.592 -6.789 1.00 0.00 O ATOM 1119 OE2 GLU A 76 0.685 -7.509 -8.205 1.00 0.00 O ATOM 0 H GLU A 76 0.858 -3.866 -10.653 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.024 -3.343 -10.428 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.006 -5.067 -8.742 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.170 -5.661 -10.164 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.016 -5.233 -9.141 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.273 -4.415 -7.780 1.00 0.00 H new ATOM 1126 N GLY A 77 -1.883 -2.496 -7.894 1.00 0.00 N ATOM 1127 CA GLY A 77 -1.867 -1.566 -6.777 1.00 0.00 C ATOM 1128 C GLY A 77 -2.084 -2.299 -5.452 1.00 0.00 C ATOM 1129 O GLY A 77 -1.950 -3.519 -5.383 1.00 0.00 O ATOM 0 H GLY A 77 -2.677 -3.136 -7.905 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -0.914 -1.037 -6.753 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -2.645 -0.815 -6.913 1.00 0.00 H new ATOM 1133 N LEU A 78 -2.416 -1.522 -4.431 1.00 0.00 N ATOM 1134 CA LEU A 78 -2.653 -2.081 -3.111 1.00 0.00 C ATOM 1135 C LEU A 78 -4.158 -2.258 -2.900 1.00 0.00 C ATOM 1136 O LEU A 78 -4.960 -1.830 -3.728 1.00 0.00 O ATOM 1137 CB LEU A 78 -1.978 -1.226 -2.037 1.00 0.00 C ATOM 1138 CG LEU A 78 -0.525 -0.832 -2.309 1.00 0.00 C ATOM 1139 CD1 LEU A 78 0.109 -0.189 -1.074 1.00 0.00 C ATOM 1140 CD2 LEU A 78 0.283 -2.031 -2.810 1.00 0.00 C ATOM 0 H LEU A 78 -2.526 -0.510 -4.492 1.00 0.00 H new ATOM 0 HA LEU A 78 -2.200 -3.069 -3.029 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.562 -0.315 -1.906 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -2.016 -1.768 -1.092 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.516 -0.084 -3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.142 0.082 -1.294 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.451 0.706 -0.802 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.088 -0.896 -0.245 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.312 -1.724 -2.996 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.270 -2.819 -2.057 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.157 -2.405 -3.735 1.00 0.00 H new ATOM 1152 N VAL A 79 -4.497 -2.890 -1.785 1.00 0.00 N ATOM 1153 CA VAL A 79 -5.891 -3.129 -1.455 1.00 0.00 C ATOM 1154 C VAL A 79 -6.042 -3.219 0.065 1.00 0.00 C ATOM 1155 O VAL A 79 -5.836 -4.281 0.651 1.00 0.00 O ATOM 1156 CB VAL A 79 -6.395 -4.379 -2.180 1.00 0.00 C ATOM 1157 CG1 VAL A 79 -7.905 -4.544 -2.003 1.00 0.00 C ATOM 1158 CG2 VAL A 79 -6.017 -4.342 -3.662 1.00 0.00 C ATOM 0 H VAL A 79 -3.830 -3.243 -1.099 1.00 0.00 H new ATOM 0 HA VAL A 79 -6.511 -2.300 -1.796 1.00 0.00 H new ATOM 0 HB VAL A 79 -5.909 -5.246 -1.732 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -8.237 -5.440 -2.528 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -8.139 -4.637 -0.942 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.417 -3.673 -2.412 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -6.387 -5.241 -4.154 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.462 -3.464 -4.129 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.932 -4.295 -3.760 1.00 0.00 H new ATOM 1168 N LEU A 80 -6.401 -2.091 0.660 1.00 0.00 N ATOM 1169 CA LEU A 80 -6.582 -2.029 2.100 1.00 0.00 C ATOM 1170 C LEU A 80 -8.076 -2.081 2.425 1.00 0.00 C ATOM 1171 O LEU A 80 -8.851 -1.265 1.929 1.00 0.00 O ATOM 1172 CB LEU A 80 -5.869 -0.804 2.678 1.00 0.00 C ATOM 1173 CG LEU A 80 -4.351 -0.921 2.829 1.00 0.00 C ATOM 1174 CD1 LEU A 80 -3.876 -2.340 2.512 1.00 0.00 C ATOM 1175 CD2 LEU A 80 -3.633 0.128 1.978 1.00 0.00 C ATOM 0 H LEU A 80 -6.571 -1.212 0.171 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.121 -2.893 2.579 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.086 0.053 2.040 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -6.296 -0.588 3.657 1.00 0.00 H new ATOM 0 HG LEU A 80 -4.095 -0.721 3.869 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -2.794 -2.396 2.627 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -4.350 -3.044 3.196 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -4.145 -2.593 1.487 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.555 0.023 2.104 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.892 -0.015 0.929 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.940 1.125 2.294 1.00 0.00 H new ATOM 1187 N PRO A 81 -8.444 -3.074 3.278 1.00 0.00 N ATOM 1188 CA PRO A 81 -9.832 -3.243 3.675 1.00 0.00 C ATOM 1189 C PRO A 81 -10.247 -2.172 4.686 1.00 0.00 C ATOM 1190 O PRO A 81 -9.616 -2.022 5.731 1.00 0.00 O ATOM 1191 CB PRO A 81 -9.912 -4.653 4.236 1.00 0.00 C ATOM 1192 CG PRO A 81 -8.482 -5.053 4.562 1.00 0.00 C ATOM 1193 CD PRO A 81 -7.553 -4.058 3.886 1.00 0.00 C ATOM 0 HA PRO A 81 -10.526 -3.120 2.843 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -10.539 -4.684 5.127 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -10.354 -5.337 3.512 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -8.322 -5.053 5.640 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -8.279 -6.064 4.210 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -6.880 -3.592 4.606 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -6.929 -4.545 3.136 1.00 0.00 H new ATOM 1201 N LEU A 82 -11.307 -1.456 4.340 1.00 0.00 N ATOM 1202 CA LEU A 82 -11.814 -0.404 5.205 1.00 0.00 C ATOM 1203 C LEU A 82 -13.326 -0.273 5.008 1.00 0.00 C ATOM 1204 O LEU A 82 -13.860 -0.686 3.980 1.00 0.00 O ATOM 1205 CB LEU A 82 -11.048 0.899 4.969 1.00 0.00 C ATOM 1206 CG LEU A 82 -11.604 2.140 5.670 1.00 0.00 C ATOM 1207 CD1 LEU A 82 -11.307 2.102 7.170 1.00 0.00 C ATOM 1208 CD2 LEU A 82 -11.082 3.420 5.014 1.00 0.00 C ATOM 0 H LEU A 82 -11.829 -1.584 3.473 1.00 0.00 H new ATOM 0 HA LEU A 82 -11.649 -0.658 6.252 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -10.017 0.755 5.292 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -11.022 1.093 3.897 1.00 0.00 H new ATOM 0 HG LEU A 82 -12.688 2.139 5.557 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -11.713 2.996 7.644 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.767 1.217 7.610 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -10.229 2.066 7.327 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -11.492 4.287 5.531 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -9.994 3.442 5.075 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -11.387 3.443 3.968 1.00 0.00 H new ATOM 1220 N ALA A 83 -13.973 0.304 6.010 1.00 0.00 N ATOM 1221 CA ALA A 83 -15.412 0.495 5.960 1.00 0.00 C ATOM 1222 C ALA A 83 -15.718 1.973 5.710 1.00 0.00 C ATOM 1223 O ALA A 83 -15.069 2.849 6.279 1.00 0.00 O ATOM 1224 CB ALA A 83 -16.041 -0.020 7.257 1.00 0.00 C ATOM 0 H ALA A 83 -13.527 0.645 6.861 1.00 0.00 H new ATOM 0 HA ALA A 83 -15.846 -0.075 5.138 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -17.121 0.123 7.220 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -15.820 -1.081 7.373 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -15.631 0.530 8.104 1.00 0.00 H new ATOM 1230 N GLU A 84 -16.706 2.204 4.859 1.00 0.00 N ATOM 1231 CA GLU A 84 -17.106 3.561 4.526 1.00 0.00 C ATOM 1232 C GLU A 84 -17.438 4.343 5.799 1.00 0.00 C ATOM 1233 O GLU A 84 -17.460 5.573 5.788 1.00 0.00 O ATOM 1234 CB GLU A 84 -18.290 3.562 3.557 1.00 0.00 C ATOM 1235 CG GLU A 84 -18.462 4.934 2.904 1.00 0.00 C ATOM 1236 CD GLU A 84 -19.943 5.287 2.751 1.00 0.00 C ATOM 1237 OE1 GLU A 84 -20.512 4.908 1.704 1.00 0.00 O ATOM 1238 OE2 GLU A 84 -20.474 5.926 3.685 1.00 0.00 O ATOM 0 H GLU A 84 -17.242 1.474 4.389 1.00 0.00 H new ATOM 0 HA GLU A 84 -16.271 4.053 4.027 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -18.135 2.806 2.787 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -19.201 3.292 4.090 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -17.964 5.693 3.508 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -17.981 4.938 1.926 1.00 0.00 H new ATOM 1245 N GLU A 85 -17.690 3.597 6.865 1.00 0.00 N ATOM 1246 CA GLU A 85 -18.020 4.205 8.142 1.00 0.00 C ATOM 1247 C GLU A 85 -16.744 4.530 8.921 1.00 0.00 C ATOM 1248 O GLU A 85 -16.790 5.234 9.929 1.00 0.00 O ATOM 1249 CB GLU A 85 -18.945 3.300 8.958 1.00 0.00 C ATOM 1250 CG GLU A 85 -18.322 1.917 9.157 1.00 0.00 C ATOM 1251 CD GLU A 85 -18.904 1.226 10.393 1.00 0.00 C ATOM 1252 OE1 GLU A 85 -18.909 1.880 11.458 1.00 0.00 O ATOM 1253 OE2 GLU A 85 -19.329 0.060 10.243 1.00 0.00 O ATOM 0 H GLU A 85 -17.672 2.577 6.870 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.553 5.136 7.951 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -19.144 3.756 9.928 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -19.904 3.201 8.450 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -18.501 1.303 8.274 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -17.242 2.013 9.264 1.00 0.00 H new ATOM 1260 N GLU A 86 -15.635 4.001 8.425 1.00 0.00 N ATOM 1261 CA GLU A 86 -14.348 4.226 9.062 1.00 0.00 C ATOM 1262 C GLU A 86 -13.454 5.083 8.165 1.00 0.00 C ATOM 1263 O GLU A 86 -12.323 5.399 8.529 1.00 0.00 O ATOM 1264 CB GLU A 86 -13.668 2.899 9.407 1.00 0.00 C ATOM 1265 CG GLU A 86 -14.652 1.936 10.075 1.00 0.00 C ATOM 1266 CD GLU A 86 -13.984 1.182 11.227 1.00 0.00 C ATOM 1267 OE1 GLU A 86 -12.741 1.274 11.320 1.00 0.00 O ATOM 1268 OE2 GLU A 86 -14.732 0.531 11.988 1.00 0.00 O ATOM 0 H GLU A 86 -15.601 3.417 7.589 1.00 0.00 H new ATOM 0 HA GLU A 86 -14.515 4.764 9.995 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -13.268 2.445 8.501 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -12.824 3.081 10.072 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -15.512 2.491 10.449 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.027 1.225 9.339 1.00 0.00 H new ATOM 1275 N LEU A 87 -13.995 5.436 7.008 1.00 0.00 N ATOM 1276 CA LEU A 87 -13.261 6.251 6.055 1.00 0.00 C ATOM 1277 C LEU A 87 -12.667 7.462 6.778 1.00 0.00 C ATOM 1278 O LEU A 87 -11.475 7.738 6.657 1.00 0.00 O ATOM 1279 CB LEU A 87 -14.151 6.619 4.866 1.00 0.00 C ATOM 1280 CG LEU A 87 -14.169 5.621 3.707 1.00 0.00 C ATOM 1281 CD1 LEU A 87 -15.328 5.911 2.752 1.00 0.00 C ATOM 1282 CD2 LEU A 87 -12.822 5.596 2.983 1.00 0.00 C ATOM 0 H LEU A 87 -14.934 5.172 6.709 1.00 0.00 H new ATOM 0 HA LEU A 87 -12.427 5.689 5.636 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -15.172 6.745 5.227 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -13.828 7.586 4.481 1.00 0.00 H new ATOM 0 HG LEU A 87 -14.332 4.624 4.117 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -15.318 5.187 1.937 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -16.272 5.836 3.292 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -15.221 6.917 2.345 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -12.863 4.878 2.164 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -12.604 6.588 2.586 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -12.038 5.304 3.682 1.00 0.00 H new ATOM 1294 N PRO A 88 -13.550 8.170 7.532 1.00 0.00 N ATOM 1295 CA PRO A 88 -13.125 9.345 8.274 1.00 0.00 C ATOM 1296 C PRO A 88 -12.327 8.950 9.517 1.00 0.00 C ATOM 1297 O PRO A 88 -11.562 9.753 10.050 1.00 0.00 O ATOM 1298 CB PRO A 88 -14.410 10.087 8.604 1.00 0.00 C ATOM 1299 CG PRO A 88 -15.530 9.073 8.443 1.00 0.00 C ATOM 1300 CD PRO A 88 -14.969 7.873 7.698 1.00 0.00 C ATOM 0 HA PRO A 88 -12.448 9.981 7.703 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -14.383 10.481 9.620 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -14.553 10.936 7.936 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -15.915 8.772 9.417 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -16.363 9.509 7.892 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -15.117 6.952 8.262 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -15.461 7.740 6.735 1.00 0.00 H new ATOM 1308 N THR A 89 -12.532 7.712 9.944 1.00 0.00 N ATOM 1309 CA THR A 89 -11.841 7.201 11.115 1.00 0.00 C ATOM 1310 C THR A 89 -10.696 6.276 10.697 1.00 0.00 C ATOM 1311 O THR A 89 -10.310 5.381 11.448 1.00 0.00 O ATOM 1312 CB THR A 89 -12.874 6.519 12.014 1.00 0.00 C ATOM 1313 OG1 THR A 89 -13.024 5.220 11.449 1.00 0.00 O ATOM 1314 CG2 THR A 89 -14.265 7.144 11.885 1.00 0.00 C ATOM 0 H THR A 89 -13.167 7.049 9.500 1.00 0.00 H new ATOM 0 HA THR A 89 -11.376 8.007 11.683 1.00 0.00 H new ATOM 0 HB THR A 89 -12.545 6.575 13.052 1.00 0.00 H new ATOM 0 HG1 THR A 89 -13.775 4.761 11.880 1.00 0.00 H new ATOM 0 HG21 THR A 89 -14.960 6.623 12.544 1.00 0.00 H new ATOM 0 HG22 THR A 89 -14.218 8.196 12.165 1.00 0.00 H new ATOM 0 HG23 THR A 89 -14.608 7.058 10.854 1.00 0.00 H new ATOM 1322 N ALA A 90 -10.184 6.524 9.500 1.00 0.00 N ATOM 1323 CA ALA A 90 -9.091 5.725 8.973 1.00 0.00 C ATOM 1324 C ALA A 90 -8.133 6.629 8.195 1.00 0.00 C ATOM 1325 O ALA A 90 -8.521 7.704 7.738 1.00 0.00 O ATOM 1326 CB ALA A 90 -9.655 4.594 8.111 1.00 0.00 C ATOM 0 H ALA A 90 -10.506 7.267 8.880 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.525 5.266 9.784 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -8.835 3.994 7.715 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -10.306 3.964 8.718 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.227 5.017 7.285 1.00 0.00 H new ATOM 1332 N THR A 91 -6.900 6.161 8.067 1.00 0.00 N ATOM 1333 CA THR A 91 -5.884 6.914 7.352 1.00 0.00 C ATOM 1334 C THR A 91 -4.959 5.966 6.586 1.00 0.00 C ATOM 1335 O THR A 91 -4.605 4.899 7.086 1.00 0.00 O ATOM 1336 CB THR A 91 -5.149 7.795 8.364 1.00 0.00 C ATOM 1337 OG1 THR A 91 -6.176 8.245 9.244 1.00 0.00 O ATOM 1338 CG2 THR A 91 -4.606 9.080 7.736 1.00 0.00 C ATOM 0 H THR A 91 -6.582 5.269 8.447 1.00 0.00 H new ATOM 0 HA THR A 91 -6.329 7.563 6.598 1.00 0.00 H new ATOM 0 HB THR A 91 -4.327 7.232 8.806 1.00 0.00 H new ATOM 0 HG1 THR A 91 -5.786 8.822 9.933 1.00 0.00 H new ATOM 0 HG21 THR A 91 -4.094 9.669 8.497 1.00 0.00 H new ATOM 0 HG22 THR A 91 -3.906 8.828 6.940 1.00 0.00 H new ATOM 0 HG23 THR A 91 -5.431 9.660 7.323 1.00 0.00 H new ATOM 1346 N LEU A 92 -4.593 6.390 5.385 1.00 0.00 N ATOM 1347 CA LEU A 92 -3.716 5.593 4.545 1.00 0.00 C ATOM 1348 C LEU A 92 -2.350 6.275 4.450 1.00 0.00 C ATOM 1349 O LEU A 92 -2.269 7.485 4.246 1.00 0.00 O ATOM 1350 CB LEU A 92 -4.369 5.331 3.186 1.00 0.00 C ATOM 1351 CG LEU A 92 -3.483 4.657 2.136 1.00 0.00 C ATOM 1352 CD1 LEU A 92 -2.473 5.646 1.553 1.00 0.00 C ATOM 1353 CD2 LEU A 92 -2.802 3.413 2.710 1.00 0.00 C ATOM 0 H LEU A 92 -4.888 7.276 4.974 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.552 4.611 4.989 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -5.250 4.709 3.342 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.717 6.282 2.783 1.00 0.00 H new ATOM 0 HG LEU A 92 -4.119 4.326 1.315 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.856 5.141 0.810 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -3.004 6.473 1.082 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -1.838 6.030 2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.178 2.953 1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.182 3.697 3.560 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.560 2.701 3.036 1.00 0.00 H new ATOM 1365 N THR A 93 -1.310 5.468 4.603 1.00 0.00 N ATOM 1366 CA THR A 93 0.049 5.979 4.537 1.00 0.00 C ATOM 1367 C THR A 93 0.903 5.103 3.618 1.00 0.00 C ATOM 1368 O THR A 93 0.906 3.880 3.746 1.00 0.00 O ATOM 1369 CB THR A 93 0.590 6.069 5.965 1.00 0.00 C ATOM 1370 OG1 THR A 93 -0.001 7.258 6.485 1.00 0.00 O ATOM 1371 CG2 THR A 93 2.093 6.352 6.005 1.00 0.00 C ATOM 0 H THR A 93 -1.381 4.465 4.772 1.00 0.00 H new ATOM 0 HA THR A 93 0.076 6.977 4.100 1.00 0.00 H new ATOM 0 HB THR A 93 0.382 5.138 6.492 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.295 7.393 7.410 1.00 0.00 H new ATOM 0 HG21 THR A 93 2.426 6.406 7.042 1.00 0.00 H new ATOM 0 HG22 THR A 93 2.628 5.552 5.494 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.298 7.300 5.508 1.00 0.00 H new ATOM 1379 N LEU A 94 1.609 5.764 2.712 1.00 0.00 N ATOM 1380 CA LEU A 94 2.466 5.062 1.772 1.00 0.00 C ATOM 1381 C LEU A 94 3.880 4.969 2.348 1.00 0.00 C ATOM 1382 O LEU A 94 4.309 5.850 3.092 1.00 0.00 O ATOM 1383 CB LEU A 94 2.405 5.723 0.394 1.00 0.00 C ATOM 1384 CG LEU A 94 1.343 5.181 -0.565 1.00 0.00 C ATOM 1385 CD1 LEU A 94 0.010 4.970 0.157 1.00 0.00 C ATOM 1386 CD2 LEU A 94 1.195 6.087 -1.789 1.00 0.00 C ATOM 0 H LEU A 94 1.605 6.779 2.609 1.00 0.00 H new ATOM 0 HA LEU A 94 2.114 4.041 1.625 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.230 6.790 0.532 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.381 5.619 -0.080 1.00 0.00 H new ATOM 0 HG LEU A 94 1.673 4.206 -0.925 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.728 4.584 -0.547 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.145 4.256 0.969 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.338 5.920 0.563 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.434 5.679 -2.454 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.899 7.086 -1.469 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.147 6.143 -2.318 1.00 0.00 H new ATOM 1398 N THR A 95 4.565 3.896 1.982 1.00 0.00 N ATOM 1399 CA THR A 95 5.922 3.677 2.454 1.00 0.00 C ATOM 1400 C THR A 95 6.737 2.924 1.401 1.00 0.00 C ATOM 1401 O THR A 95 6.290 1.905 0.877 1.00 0.00 O ATOM 1402 CB THR A 95 5.844 2.950 3.797 1.00 0.00 C ATOM 1403 OG1 THR A 95 4.447 2.854 4.060 1.00 0.00 O ATOM 1404 CG2 THR A 95 6.384 3.795 4.953 1.00 0.00 C ATOM 0 H THR A 95 4.206 3.168 1.364 1.00 0.00 H new ATOM 0 HA THR A 95 6.444 4.621 2.610 1.00 0.00 H new ATOM 0 HB THR A 95 6.404 2.017 3.737 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.306 2.393 4.913 1.00 0.00 H new ATOM 0 HG21 THR A 95 6.305 3.232 5.883 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.429 4.042 4.766 1.00 0.00 H new ATOM 0 HG23 THR A 95 5.803 4.714 5.035 1.00 0.00 H new ATOM 1412 N LEU A 96 7.919 3.454 1.123 1.00 0.00 N ATOM 1413 CA LEU A 96 8.801 2.845 0.143 1.00 0.00 C ATOM 1414 C LEU A 96 9.987 2.198 0.862 1.00 0.00 C ATOM 1415 O LEU A 96 10.943 2.880 1.226 1.00 0.00 O ATOM 1416 CB LEU A 96 9.209 3.867 -0.920 1.00 0.00 C ATOM 1417 CG LEU A 96 10.346 3.447 -1.853 1.00 0.00 C ATOM 1418 CD1 LEU A 96 9.848 2.466 -2.917 1.00 0.00 C ATOM 1419 CD2 LEU A 96 11.026 4.669 -2.474 1.00 0.00 C ATOM 0 H LEU A 96 8.286 4.299 1.560 1.00 0.00 H new ATOM 0 HA LEU A 96 8.282 2.051 -0.394 1.00 0.00 H new ATOM 0 HB2 LEU A 96 8.334 4.099 -1.527 1.00 0.00 H new ATOM 0 HB3 LEU A 96 9.501 4.789 -0.416 1.00 0.00 H new ATOM 0 HG LEU A 96 11.099 2.926 -1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 96 10.676 2.183 -3.567 1.00 0.00 H new ATOM 0 HD12 LEU A 96 9.447 1.576 -2.432 1.00 0.00 H new ATOM 0 HD13 LEU A 96 9.066 2.939 -3.511 1.00 0.00 H new ATOM 0 HD21 LEU A 96 11.830 4.342 -3.133 1.00 0.00 H new ATOM 0 HD22 LEU A 96 10.296 5.239 -3.048 1.00 0.00 H new ATOM 0 HD23 LEU A 96 11.437 5.297 -1.684 1.00 0.00 H new ATOM 1431 N ARG A 97 9.885 0.890 1.045 1.00 0.00 N ATOM 1432 CA ARG A 97 10.937 0.144 1.714 1.00 0.00 C ATOM 1433 C ARG A 97 11.836 -0.545 0.685 1.00 0.00 C ATOM 1434 O ARG A 97 11.438 -0.736 -0.463 1.00 0.00 O ATOM 1435 CB ARG A 97 10.352 -0.910 2.656 1.00 0.00 C ATOM 1436 CG ARG A 97 9.904 -0.278 3.975 1.00 0.00 C ATOM 1437 CD ARG A 97 8.388 -0.389 4.149 1.00 0.00 C ATOM 1438 NE ARG A 97 8.033 -0.275 5.581 1.00 0.00 N ATOM 1439 CZ ARG A 97 8.231 -1.245 6.484 1.00 0.00 C ATOM 1440 NH1 ARG A 97 8.782 -2.407 6.108 1.00 0.00 N ATOM 1441 NH2 ARG A 97 7.878 -1.053 7.762 1.00 0.00 N ATOM 0 H ARG A 97 9.090 0.328 0.742 1.00 0.00 H new ATOM 0 HA ARG A 97 11.524 0.852 2.299 1.00 0.00 H new ATOM 0 HB2 ARG A 97 9.504 -1.400 2.177 1.00 0.00 H new ATOM 0 HB3 ARG A 97 11.097 -1.681 2.853 1.00 0.00 H new ATOM 0 HG2 ARG A 97 10.406 -0.771 4.808 1.00 0.00 H new ATOM 0 HG3 ARG A 97 10.201 0.771 3.999 1.00 0.00 H new ATOM 0 HD2 ARG A 97 7.890 0.395 3.579 1.00 0.00 H new ATOM 0 HD3 ARG A 97 8.037 -1.342 3.754 1.00 0.00 H new ATOM 0 HE ARG A 97 7.611 0.597 5.901 1.00 0.00 H new ATOM 0 HH11 ARG A 97 9.051 -2.553 5.135 1.00 0.00 H new ATOM 0 HH12 ARG A 97 8.933 -3.146 6.795 1.00 0.00 H new ATOM 0 HH21 ARG A 97 7.458 -0.168 8.048 1.00 0.00 H new ATOM 0 HH22 ARG A 97 8.029 -1.792 8.449 1.00 0.00 H new ATOM 1455 N THR A 98 13.031 -0.899 1.133 1.00 0.00 N ATOM 1456 CA THR A 98 13.990 -1.563 0.266 1.00 0.00 C ATOM 1457 C THR A 98 14.196 -3.012 0.709 1.00 0.00 C ATOM 1458 O THR A 98 14.459 -3.275 1.881 1.00 0.00 O ATOM 1459 CB THR A 98 15.278 -0.738 0.267 1.00 0.00 C ATOM 1460 OG1 THR A 98 15.541 -0.506 1.648 1.00 0.00 O ATOM 1461 CG2 THR A 98 15.078 0.663 -0.315 1.00 0.00 C ATOM 0 H THR A 98 13.358 -0.739 2.086 1.00 0.00 H new ATOM 0 HA THR A 98 13.624 -1.619 -0.759 1.00 0.00 H new ATOM 0 HB THR A 98 16.044 -1.262 -0.305 1.00 0.00 H new ATOM 0 HG1 THR A 98 15.301 -1.303 2.165 1.00 0.00 H new ATOM 0 HG21 THR A 98 16.023 1.206 -0.290 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.732 0.583 -1.346 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.336 1.200 0.276 1.00 0.00 H new ATOM 1469 N CYS A 99 14.069 -3.915 -0.253 1.00 0.00 N ATOM 1470 CA CYS A 99 14.238 -5.332 0.024 1.00 0.00 C ATOM 1471 C CYS A 99 15.592 -5.529 0.708 1.00 0.00 C ATOM 1472 O CYS A 99 16.612 -5.686 0.039 1.00 0.00 O ATOM 1473 CB CYS A 99 14.111 -6.175 -1.247 1.00 0.00 C ATOM 1474 SG CYS A 99 13.953 -7.945 -0.810 1.00 0.00 S ATOM 0 H CYS A 99 13.851 -3.693 -1.224 1.00 0.00 H new ATOM 0 HA CYS A 99 13.444 -5.674 0.688 1.00 0.00 H new ATOM 0 HB2 CYS A 99 13.241 -5.854 -1.821 1.00 0.00 H new ATOM 0 HB3 CYS A 99 14.984 -6.025 -1.882 1.00 0.00 H new ATOM 0 HG CYS A 99 13.844 -8.652 -1.896 1.00 0.00 H new ATOM 1480 N ASP A 100 15.558 -5.516 2.032 1.00 0.00 N ATOM 1481 CA ASP A 100 16.770 -5.692 2.814 1.00 0.00 C ATOM 1482 C ASP A 100 16.445 -6.489 4.079 1.00 0.00 C ATOM 1483 O ASP A 100 15.283 -6.590 4.472 1.00 0.00 O ATOM 1484 CB ASP A 100 17.350 -4.343 3.241 1.00 0.00 C ATOM 1485 CG ASP A 100 18.818 -4.122 2.868 1.00 0.00 C ATOM 1486 OD1 ASP A 100 19.076 -3.960 1.656 1.00 0.00 O ATOM 1487 OD2 ASP A 100 19.647 -4.121 3.803 1.00 0.00 O ATOM 0 H ASP A 100 14.710 -5.386 2.584 1.00 0.00 H new ATOM 0 HA ASP A 100 17.497 -6.218 2.195 1.00 0.00 H new ATOM 0 HB2 ASP A 100 16.753 -3.549 2.791 1.00 0.00 H new ATOM 0 HB3 ASP A 100 17.247 -4.246 4.322 1.00 0.00 H new ATOM 1492 N ARG A 101 17.491 -7.035 4.681 1.00 0.00 N ATOM 1493 CA ARG A 101 17.331 -7.819 5.894 1.00 0.00 C ATOM 1494 C ARG A 101 16.521 -7.037 6.930 1.00 0.00 C ATOM 1495 O ARG A 101 15.397 -7.412 7.257 1.00 0.00 O ATOM 1496 CB ARG A 101 18.689 -8.191 6.493 1.00 0.00 C ATOM 1497 CG ARG A 101 18.573 -9.424 7.391 1.00 0.00 C ATOM 1498 CD ARG A 101 19.763 -10.364 7.187 1.00 0.00 C ATOM 1499 NE ARG A 101 19.398 -11.739 7.596 1.00 0.00 N ATOM 1500 CZ ARG A 101 20.087 -12.834 7.249 1.00 0.00 C ATOM 1501 NH1 ARG A 101 21.181 -12.723 6.484 1.00 0.00 N ATOM 1502 NH2 ARG A 101 19.681 -14.041 7.667 1.00 0.00 N ATOM 0 H ARG A 101 18.453 -6.950 4.352 1.00 0.00 H new ATOM 0 HA ARG A 101 16.801 -8.734 5.629 1.00 0.00 H new ATOM 0 HB2 ARG A 101 19.403 -8.386 5.692 1.00 0.00 H new ATOM 0 HB3 ARG A 101 19.078 -7.352 7.070 1.00 0.00 H new ATOM 0 HG2 ARG A 101 18.524 -9.115 8.435 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.645 -9.953 7.171 1.00 0.00 H new ATOM 0 HD2 ARG A 101 20.068 -10.356 6.141 1.00 0.00 H new ATOM 0 HD3 ARG A 101 20.616 -10.016 7.770 1.00 0.00 H new ATOM 0 HE ARG A 101 18.570 -11.860 8.179 1.00 0.00 H new ATOM 0 HH11 ARG A 101 21.490 -11.804 6.166 1.00 0.00 H new ATOM 0 HH12 ARG A 101 21.705 -13.557 6.220 1.00 0.00 H new ATOM 0 HH21 ARG A 101 18.848 -14.125 8.249 1.00 0.00 H new ATOM 0 HH22 ARG A 101 20.205 -14.875 7.403 1.00 0.00 H new ATOM 1516 N PHE A 102 17.125 -5.963 7.417 1.00 0.00 N ATOM 1517 CA PHE A 102 16.475 -5.124 8.410 1.00 0.00 C ATOM 1518 C PHE A 102 16.045 -3.788 7.801 1.00 0.00 C ATOM 1519 O PHE A 102 14.991 -3.255 8.146 1.00 0.00 O ATOM 1520 CB PHE A 102 17.500 -4.861 9.515 1.00 0.00 C ATOM 1521 CG PHE A 102 18.028 -6.129 10.188 1.00 0.00 C ATOM 1522 CD1 PHE A 102 17.299 -6.735 11.164 1.00 0.00 C ATOM 1523 CD2 PHE A 102 19.226 -6.651 9.812 1.00 0.00 C ATOM 1524 CE1 PHE A 102 17.789 -7.912 11.789 1.00 0.00 C ATOM 1525 CE2 PHE A 102 19.716 -7.828 10.437 1.00 0.00 C ATOM 1526 CZ PHE A 102 18.987 -8.433 11.413 1.00 0.00 C ATOM 0 H PHE A 102 18.058 -5.654 7.143 1.00 0.00 H new ATOM 0 HA PHE A 102 15.584 -5.622 8.792 1.00 0.00 H new ATOM 0 HB2 PHE A 102 18.340 -4.309 9.093 1.00 0.00 H new ATOM 0 HB3 PHE A 102 17.047 -4.222 10.273 1.00 0.00 H new ATOM 0 HD1 PHE A 102 16.348 -6.321 11.463 1.00 0.00 H new ATOM 0 HD2 PHE A 102 19.805 -6.170 9.038 1.00 0.00 H new ATOM 0 HE1 PHE A 102 17.210 -8.393 12.563 1.00 0.00 H new ATOM 0 HE2 PHE A 102 20.667 -8.243 10.138 1.00 0.00 H new ATOM 0 HZ PHE A 102 19.360 -9.328 11.889 1.00 0.00 H new ATOM 1536 N SER A 103 16.882 -3.285 6.905 1.00 0.00 N ATOM 1537 CA SER A 103 16.601 -2.021 6.245 1.00 0.00 C ATOM 1538 C SER A 103 16.695 -0.873 7.252 1.00 0.00 C ATOM 1539 O SER A 103 15.761 -0.085 7.389 1.00 0.00 O ATOM 1540 CB SER A 103 15.220 -2.038 5.587 1.00 0.00 C ATOM 1541 OG SER A 103 14.985 -3.248 4.872 1.00 0.00 O ATOM 0 H SER A 103 17.755 -3.730 6.621 1.00 0.00 H new ATOM 0 HA SER A 103 17.345 -1.871 5.462 1.00 0.00 H new ATOM 0 HB2 SER A 103 14.453 -1.913 6.351 1.00 0.00 H new ATOM 0 HB3 SER A 103 15.132 -1.191 4.906 1.00 0.00 H new ATOM 0 HG SER A 103 14.852 -3.046 3.922 1.00 0.00 H new ATOM 1547 N ARG A 104 17.832 -0.815 7.931 1.00 0.00 N ATOM 1548 CA ARG A 104 18.060 0.224 8.921 1.00 0.00 C ATOM 1549 C ARG A 104 17.530 1.566 8.413 1.00 0.00 C ATOM 1550 O ARG A 104 17.318 1.741 7.214 1.00 0.00 O ATOM 1551 CB ARG A 104 19.549 0.360 9.244 1.00 0.00 C ATOM 1552 CG ARG A 104 20.000 -0.729 10.220 1.00 0.00 C ATOM 1553 CD ARG A 104 19.512 -0.429 11.639 1.00 0.00 C ATOM 1554 NE ARG A 104 20.564 -0.776 12.620 1.00 0.00 N ATOM 1555 CZ ARG A 104 20.529 -0.429 13.914 1.00 0.00 C ATOM 1556 NH1 ARG A 104 19.496 0.279 14.390 1.00 0.00 N ATOM 1557 NH2 ARG A 104 21.529 -0.788 14.731 1.00 0.00 N ATOM 0 H ARG A 104 18.605 -1.471 7.815 1.00 0.00 H new ATOM 0 HA ARG A 104 17.528 -0.060 9.829 1.00 0.00 H new ATOM 0 HB2 ARG A 104 20.132 0.294 8.325 1.00 0.00 H new ATOM 0 HB3 ARG A 104 19.743 1.342 9.675 1.00 0.00 H new ATOM 0 HG2 ARG A 104 19.614 -1.696 9.896 1.00 0.00 H new ATOM 0 HG3 ARG A 104 21.088 -0.801 10.213 1.00 0.00 H new ATOM 0 HD2 ARG A 104 19.254 0.626 11.728 1.00 0.00 H new ATOM 0 HD3 ARG A 104 18.606 -0.998 11.849 1.00 0.00 H new ATOM 0 HE ARG A 104 21.366 -1.313 12.291 1.00 0.00 H new ATOM 0 HH11 ARG A 104 18.736 0.554 13.768 1.00 0.00 H new ATOM 0 HH12 ARG A 104 19.469 0.543 15.375 1.00 0.00 H new ATOM 0 HH21 ARG A 104 22.316 -1.325 14.368 1.00 0.00 H new ATOM 0 HH22 ARG A 104 21.503 -0.524 15.716 1.00 0.00 H new ATOM 1571 N HIS A 105 17.332 2.481 9.351 1.00 0.00 N ATOM 1572 CA HIS A 105 16.832 3.803 9.014 1.00 0.00 C ATOM 1573 C HIS A 105 15.379 3.697 8.546 1.00 0.00 C ATOM 1574 O HIS A 105 14.950 2.646 8.073 1.00 0.00 O ATOM 1575 CB HIS A 105 17.738 4.481 7.985 1.00 0.00 C ATOM 1576 CG HIS A 105 18.744 5.434 8.585 1.00 0.00 C ATOM 1577 ND1 HIS A 105 18.743 6.791 8.317 1.00 0.00 N ATOM 1578 CD2 HIS A 105 19.780 5.212 9.444 1.00 0.00 C ATOM 1579 CE1 HIS A 105 19.739 7.351 8.988 1.00 0.00 C ATOM 1580 NE2 HIS A 105 20.381 6.370 9.685 1.00 0.00 N ATOM 0 H HIS A 105 17.509 2.333 10.345 1.00 0.00 H new ATOM 0 HA HIS A 105 16.848 4.438 9.899 1.00 0.00 H new ATOM 0 HB2 HIS A 105 18.270 3.713 7.423 1.00 0.00 H new ATOM 0 HB3 HIS A 105 17.118 5.025 7.273 1.00 0.00 H new ATOM 0 HD2 HIS A 105 20.063 4.255 9.858 1.00 0.00 H new ATOM 0 HE1 HIS A 105 19.997 8.400 8.984 1.00 0.00 H new ATOM 0 HE2 HIS A 105 21.190 6.504 10.292 1.00 0.00 H new ATOM 1588 N SER A 106 14.661 4.801 8.694 1.00 0.00 N ATOM 1589 CA SER A 106 13.266 4.846 8.293 1.00 0.00 C ATOM 1590 C SER A 106 13.122 4.373 6.845 1.00 0.00 C ATOM 1591 O SER A 106 14.116 4.220 6.137 1.00 0.00 O ATOM 1592 CB SER A 106 12.693 6.256 8.449 1.00 0.00 C ATOM 1593 OG SER A 106 13.624 7.258 8.052 1.00 0.00 O ATOM 0 H SER A 106 15.020 5.671 9.086 1.00 0.00 H new ATOM 0 HA SER A 106 12.702 4.179 8.945 1.00 0.00 H new ATOM 0 HB2 SER A 106 11.786 6.347 7.851 1.00 0.00 H new ATOM 0 HB3 SER A 106 12.407 6.418 9.488 1.00 0.00 H new ATOM 0 HG SER A 106 13.220 8.143 8.165 1.00 0.00 H new ATOM 1599 N VAL A 107 11.877 4.154 6.448 1.00 0.00 N ATOM 1600 CA VAL A 107 11.591 3.702 5.097 1.00 0.00 C ATOM 1601 C VAL A 107 12.307 4.611 4.096 1.00 0.00 C ATOM 1602 O VAL A 107 12.820 5.666 4.467 1.00 0.00 O ATOM 1603 CB VAL A 107 10.078 3.642 4.875 1.00 0.00 C ATOM 1604 CG1 VAL A 107 9.385 2.903 6.021 1.00 0.00 C ATOM 1605 CG2 VAL A 107 9.495 5.045 4.693 1.00 0.00 C ATOM 0 H VAL A 107 11.055 4.281 7.038 1.00 0.00 H new ATOM 0 HA VAL A 107 11.969 2.691 4.945 1.00 0.00 H new ATOM 0 HB VAL A 107 9.895 3.082 3.958 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.311 2.875 5.839 1.00 0.00 H new ATOM 0 HG12 VAL A 107 9.770 1.885 6.083 1.00 0.00 H new ATOM 0 HG13 VAL A 107 9.580 3.422 6.959 1.00 0.00 H new ATOM 0 HG21 VAL A 107 8.419 4.974 4.537 1.00 0.00 H new ATOM 0 HG22 VAL A 107 9.694 5.640 5.584 1.00 0.00 H new ATOM 0 HG23 VAL A 107 9.956 5.521 3.828 1.00 0.00 H new ATOM 1615 N ALA A 108 12.319 4.170 2.847 1.00 0.00 N ATOM 1616 CA ALA A 108 12.963 4.931 1.791 1.00 0.00 C ATOM 1617 C ALA A 108 12.125 6.172 1.478 1.00 0.00 C ATOM 1618 O ALA A 108 12.597 7.093 0.814 1.00 0.00 O ATOM 1619 CB ALA A 108 13.161 4.037 0.565 1.00 0.00 C ATOM 0 H ALA A 108 11.893 3.295 2.543 1.00 0.00 H new ATOM 0 HA ALA A 108 13.948 5.271 2.110 1.00 0.00 H new ATOM 0 HB1 ALA A 108 13.644 4.608 -0.228 1.00 0.00 H new ATOM 0 HB2 ALA A 108 13.787 3.186 0.833 1.00 0.00 H new ATOM 0 HB3 ALA A 108 12.193 3.679 0.215 1.00 0.00 H new ATOM 1625 N GLY A 109 10.895 6.155 1.970 1.00 0.00 N ATOM 1626 CA GLY A 109 9.987 7.268 1.752 1.00 0.00 C ATOM 1627 C GLY A 109 8.570 6.918 2.213 1.00 0.00 C ATOM 1628 O GLY A 109 8.004 5.915 1.783 1.00 0.00 O ATOM 0 H GLY A 109 10.506 5.388 2.519 1.00 0.00 H new ATOM 0 HA2 GLY A 109 10.343 8.144 2.294 1.00 0.00 H new ATOM 0 HA3 GLY A 109 9.975 7.530 0.694 1.00 0.00 H new ATOM 1632 N GLU A 110 8.039 7.765 3.082 1.00 0.00 N ATOM 1633 CA GLU A 110 6.700 7.558 3.606 1.00 0.00 C ATOM 1634 C GLU A 110 5.777 8.698 3.170 1.00 0.00 C ATOM 1635 O GLU A 110 6.187 9.857 3.141 1.00 0.00 O ATOM 1636 CB GLU A 110 6.722 7.424 5.130 1.00 0.00 C ATOM 1637 CG GLU A 110 5.347 7.728 5.727 1.00 0.00 C ATOM 1638 CD GLU A 110 5.386 7.662 7.256 1.00 0.00 C ATOM 1639 OE1 GLU A 110 6.095 8.509 7.841 1.00 0.00 O ATOM 1640 OE2 GLU A 110 4.707 6.768 7.803 1.00 0.00 O ATOM 0 H GLU A 110 8.512 8.596 3.436 1.00 0.00 H new ATOM 0 HA GLU A 110 6.312 6.625 3.197 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.027 6.414 5.405 1.00 0.00 H new ATOM 0 HB3 GLU A 110 7.463 8.106 5.548 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.020 8.718 5.410 1.00 0.00 H new ATOM 0 HG3 GLU A 110 4.616 7.014 5.347 1.00 0.00 H new ATOM 1647 N LEU A 111 4.548 8.329 2.841 1.00 0.00 N ATOM 1648 CA LEU A 111 3.563 9.306 2.408 1.00 0.00 C ATOM 1649 C LEU A 111 2.283 9.132 3.227 1.00 0.00 C ATOM 1650 O LEU A 111 2.000 8.040 3.718 1.00 0.00 O ATOM 1651 CB LEU A 111 3.343 9.210 0.896 1.00 0.00 C ATOM 1652 CG LEU A 111 3.622 10.484 0.097 1.00 0.00 C ATOM 1653 CD1 LEU A 111 4.206 10.152 -1.278 1.00 0.00 C ATOM 1654 CD2 LEU A 111 2.366 11.351 -0.009 1.00 0.00 C ATOM 0 H LEU A 111 4.211 7.366 2.866 1.00 0.00 H new ATOM 0 HA LEU A 111 3.924 10.318 2.592 1.00 0.00 H new ATOM 0 HB2 LEU A 111 3.977 8.414 0.506 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.310 8.911 0.717 1.00 0.00 H new ATOM 0 HG LEU A 111 4.371 11.066 0.634 1.00 0.00 H new ATOM 0 HD11 LEU A 111 4.395 11.075 -1.826 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.141 9.606 -1.154 1.00 0.00 H new ATOM 0 HD13 LEU A 111 3.498 9.538 -1.835 1.00 0.00 H new ATOM 0 HD21 LEU A 111 2.592 12.250 -0.582 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.578 10.790 -0.511 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.032 11.631 0.990 1.00 0.00 H new ATOM 1666 N ARG A 112 1.544 10.224 3.350 1.00 0.00 N ATOM 1667 CA ARG A 112 0.301 10.206 4.102 1.00 0.00 C ATOM 1668 C ARG A 112 -0.865 10.637 3.210 1.00 0.00 C ATOM 1669 O ARG A 112 -0.696 11.469 2.319 1.00 0.00 O ATOM 1670 CB ARG A 112 0.377 11.137 5.314 1.00 0.00 C ATOM 1671 CG ARG A 112 -1.018 11.423 5.874 1.00 0.00 C ATOM 1672 CD ARG A 112 -1.658 10.149 6.430 1.00 0.00 C ATOM 1673 NE ARG A 112 -1.505 10.107 7.902 1.00 0.00 N ATOM 1674 CZ ARG A 112 -2.018 11.022 8.736 1.00 0.00 C ATOM 1675 NH1 ARG A 112 -2.718 12.055 8.249 1.00 0.00 N ATOM 1676 NH2 ARG A 112 -1.829 10.904 10.058 1.00 0.00 N ATOM 0 H ARG A 112 1.782 11.128 2.941 1.00 0.00 H new ATOM 0 HA ARG A 112 0.139 9.186 4.451 1.00 0.00 H new ATOM 0 HB2 ARG A 112 0.997 10.683 6.087 1.00 0.00 H new ATOM 0 HB3 ARG A 112 0.857 12.073 5.029 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.951 12.174 6.661 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -1.650 11.839 5.090 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.715 10.117 6.165 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -1.191 9.272 5.982 1.00 0.00 H new ATOM 0 HE ARG A 112 -0.977 9.334 8.306 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -2.861 12.145 7.243 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -3.108 12.751 8.884 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -1.295 10.118 10.429 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.219 11.600 10.693 1.00 0.00 H new ATOM 1690 N LEU A 113 -2.023 10.050 3.479 1.00 0.00 N ATOM 1691 CA LEU A 113 -3.216 10.363 2.712 1.00 0.00 C ATOM 1692 C LEU A 113 -4.447 10.217 3.609 1.00 0.00 C ATOM 1693 O LEU A 113 -4.339 9.763 4.748 1.00 0.00 O ATOM 1694 CB LEU A 113 -3.276 9.510 1.443 1.00 0.00 C ATOM 1695 CG LEU A 113 -2.002 9.479 0.596 1.00 0.00 C ATOM 1696 CD1 LEU A 113 -2.047 8.334 -0.418 1.00 0.00 C ATOM 1697 CD2 LEU A 113 -1.758 10.831 -0.077 1.00 0.00 C ATOM 0 H LEU A 113 -2.159 9.360 4.217 1.00 0.00 H new ATOM 0 HA LEU A 113 -3.189 11.398 2.372 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -3.525 8.488 1.727 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -4.093 9.876 0.821 1.00 0.00 H new ATOM 0 HG LEU A 113 -1.156 9.291 1.257 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -1.130 8.334 -1.007 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -2.140 7.385 0.109 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -2.903 8.467 -1.079 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.847 10.782 -0.673 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -2.601 11.073 -0.724 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.652 11.603 0.685 1.00 0.00 H new ATOM 1709 N GLY A 114 -5.588 10.610 3.063 1.00 0.00 N ATOM 1710 CA GLY A 114 -6.838 10.528 3.800 1.00 0.00 C ATOM 1711 C GLY A 114 -7.930 9.868 2.956 1.00 0.00 C ATOM 1712 O GLY A 114 -8.043 10.137 1.761 1.00 0.00 O ATOM 0 H GLY A 114 -5.674 10.986 2.119 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.687 9.958 4.716 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.156 11.528 4.096 1.00 0.00 H new ATOM 1716 N LEU A 115 -8.706 9.017 3.611 1.00 0.00 N ATOM 1717 CA LEU A 115 -9.785 8.317 2.936 1.00 0.00 C ATOM 1718 C LEU A 115 -11.111 9.018 3.239 1.00 0.00 C ATOM 1719 O LEU A 115 -12.181 8.459 3.004 1.00 0.00 O ATOM 1720 CB LEU A 115 -9.776 6.833 3.308 1.00 0.00 C ATOM 1721 CG LEU A 115 -8.397 6.194 3.482 1.00 0.00 C ATOM 1722 CD1 LEU A 115 -7.355 6.891 2.606 1.00 0.00 C ATOM 1723 CD2 LEU A 115 -7.985 6.172 4.956 1.00 0.00 C ATOM 0 H LEU A 115 -8.609 8.797 4.602 1.00 0.00 H new ATOM 0 HA LEU A 115 -9.644 8.353 1.856 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.332 6.708 4.237 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.315 6.282 2.537 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.456 5.158 3.149 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -6.384 6.417 2.749 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -7.647 6.811 1.559 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -7.290 7.943 2.885 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -7.001 5.713 5.052 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -7.948 7.192 5.339 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.712 5.596 5.528 1.00 0.00 H new ATOM 1735 N ASP A 116 -10.997 10.233 3.755 1.00 0.00 N ATOM 1736 CA ASP A 116 -12.173 11.016 4.093 1.00 0.00 C ATOM 1737 C ASP A 116 -12.621 11.811 2.864 1.00 0.00 C ATOM 1738 O ASP A 116 -13.778 12.219 2.772 1.00 0.00 O ATOM 1739 CB ASP A 116 -11.868 12.012 5.214 1.00 0.00 C ATOM 1740 CG ASP A 116 -11.044 13.229 4.792 1.00 0.00 C ATOM 1741 OD1 ASP A 116 -11.658 14.167 4.238 1.00 0.00 O ATOM 1742 OD2 ASP A 116 -9.818 13.195 5.032 1.00 0.00 O ATOM 0 H ASP A 116 -10.108 10.694 3.947 1.00 0.00 H new ATOM 0 HA ASP A 116 -12.952 10.329 4.423 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -12.811 12.359 5.637 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -11.335 11.489 6.009 1.00 0.00 H new ATOM 1747 N GLY A 117 -11.681 12.006 1.951 1.00 0.00 N ATOM 1748 CA GLY A 117 -11.965 12.745 0.732 1.00 0.00 C ATOM 1749 C GLY A 117 -11.591 14.220 0.885 1.00 0.00 C ATOM 1750 O GLY A 117 -12.292 15.097 0.383 1.00 0.00 O ATOM 0 H GLY A 117 -10.723 11.666 2.030 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -11.410 12.310 -0.099 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -13.024 12.658 0.488 1.00 0.00 H new ATOM 1754 N THR A 118 -10.486 14.449 1.580 1.00 0.00 N ATOM 1755 CA THR A 118 -10.011 15.803 1.805 1.00 0.00 C ATOM 1756 C THR A 118 -8.611 15.982 1.214 1.00 0.00 C ATOM 1757 O THR A 118 -8.461 16.515 0.116 1.00 0.00 O ATOM 1758 CB THR A 118 -10.076 16.083 3.308 1.00 0.00 C ATOM 1759 OG1 THR A 118 -11.434 16.451 3.534 1.00 0.00 O ATOM 1760 CG2 THR A 118 -9.281 17.328 3.707 1.00 0.00 C ATOM 0 H THR A 118 -9.906 13.719 1.995 1.00 0.00 H new ATOM 0 HA THR A 118 -10.641 16.533 1.296 1.00 0.00 H new ATOM 0 HB THR A 118 -9.696 15.220 3.855 1.00 0.00 H new ATOM 0 HG1 THR A 118 -11.865 15.778 4.101 1.00 0.00 H new ATOM 0 HG21 THR A 118 -9.361 17.481 4.783 1.00 0.00 H new ATOM 0 HG22 THR A 118 -8.234 17.193 3.436 1.00 0.00 H new ATOM 0 HG23 THR A 118 -9.682 18.198 3.186 1.00 0.00 H new ATOM 1768 N SER A 119 -7.622 15.527 1.969 1.00 0.00 N ATOM 1769 CA SER A 119 -6.239 15.630 1.533 1.00 0.00 C ATOM 1770 C SER A 119 -6.136 15.308 0.041 1.00 0.00 C ATOM 1771 O SER A 119 -5.654 16.126 -0.742 1.00 0.00 O ATOM 1772 CB SER A 119 -5.336 14.696 2.341 1.00 0.00 C ATOM 1773 OG SER A 119 -5.257 15.083 3.710 1.00 0.00 O ATOM 0 H SER A 119 -7.750 15.086 2.880 1.00 0.00 H new ATOM 0 HA SER A 119 -5.902 16.653 1.702 1.00 0.00 H new ATOM 0 HB2 SER A 119 -5.716 13.677 2.274 1.00 0.00 H new ATOM 0 HB3 SER A 119 -4.336 14.693 1.907 1.00 0.00 H new ATOM 0 HG SER A 119 -4.673 14.461 4.192 1.00 0.00 H new ATOM 1779 N VAL A 120 -6.596 14.116 -0.309 1.00 0.00 N ATOM 1780 CA VAL A 120 -6.561 13.677 -1.693 1.00 0.00 C ATOM 1781 C VAL A 120 -7.909 13.054 -2.060 1.00 0.00 C ATOM 1782 O VAL A 120 -8.487 12.306 -1.272 1.00 0.00 O ATOM 1783 CB VAL A 120 -5.384 12.724 -1.910 1.00 0.00 C ATOM 1784 CG1 VAL A 120 -4.093 13.500 -2.180 1.00 0.00 C ATOM 1785 CG2 VAL A 120 -5.216 11.779 -0.719 1.00 0.00 C ATOM 0 H VAL A 120 -6.995 13.440 0.343 1.00 0.00 H new ATOM 0 HA VAL A 120 -6.402 14.525 -2.359 1.00 0.00 H new ATOM 0 HB VAL A 120 -5.602 12.118 -2.790 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -3.272 12.799 -2.331 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -4.216 14.112 -3.074 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -3.870 14.143 -1.328 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.373 11.113 -0.899 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -5.032 12.361 0.184 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -6.124 11.189 -0.592 1.00 0.00 H new ATOM 1795 N PRO A 121 -8.384 13.394 -3.288 1.00 0.00 N ATOM 1796 CA PRO A 121 -9.654 12.877 -3.769 1.00 0.00 C ATOM 1797 C PRO A 121 -9.526 11.410 -4.187 1.00 0.00 C ATOM 1798 O PRO A 121 -8.422 10.870 -4.239 1.00 0.00 O ATOM 1799 CB PRO A 121 -10.040 13.790 -4.921 1.00 0.00 C ATOM 1800 CG PRO A 121 -8.761 14.495 -5.342 1.00 0.00 C ATOM 1801 CD PRO A 121 -7.728 14.277 -4.248 1.00 0.00 C ATOM 0 HA PRO A 121 -10.427 12.879 -3.000 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.461 13.218 -5.748 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.799 14.509 -4.612 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.401 14.099 -6.291 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -8.942 15.560 -5.489 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.820 13.824 -4.646 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.438 15.220 -3.784 1.00 0.00 H new ATOM 1809 N LEU A 122 -10.670 10.807 -4.473 1.00 0.00 N ATOM 1810 CA LEU A 122 -10.700 9.414 -4.884 1.00 0.00 C ATOM 1811 C LEU A 122 -10.760 9.339 -6.411 1.00 0.00 C ATOM 1812 O LEU A 122 -11.191 10.286 -7.067 1.00 0.00 O ATOM 1813 CB LEU A 122 -11.843 8.674 -4.187 1.00 0.00 C ATOM 1814 CG LEU A 122 -11.668 8.431 -2.686 1.00 0.00 C ATOM 1815 CD1 LEU A 122 -12.988 8.001 -2.043 1.00 0.00 C ATOM 1816 CD2 LEU A 122 -10.546 7.425 -2.421 1.00 0.00 C ATOM 0 H LEU A 122 -11.584 11.258 -4.428 1.00 0.00 H new ATOM 0 HA LEU A 122 -9.787 8.906 -4.575 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.762 9.240 -4.339 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.978 7.710 -4.678 1.00 0.00 H new ATOM 0 HG LEU A 122 -11.374 9.371 -2.219 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.836 7.835 -0.977 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -13.734 8.783 -2.186 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.336 7.079 -2.508 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -10.442 7.270 -1.347 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -10.786 6.477 -2.903 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.609 7.810 -2.824 1.00 0.00 H new ATOM 1828 N GLY A 123 -10.321 8.203 -6.934 1.00 0.00 N ATOM 1829 CA GLY A 123 -10.319 7.991 -8.371 1.00 0.00 C ATOM 1830 C GLY A 123 -9.550 9.103 -9.088 1.00 0.00 C ATOM 1831 O GLY A 123 -9.753 9.335 -10.279 1.00 0.00 O ATOM 0 H GLY A 123 -9.964 7.419 -6.387 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -9.867 7.026 -8.599 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -11.345 7.958 -8.739 1.00 0.00 H new ATOM 1835 N ALA A 124 -8.684 9.762 -8.332 1.00 0.00 N ATOM 1836 CA ALA A 124 -7.884 10.844 -8.880 1.00 0.00 C ATOM 1837 C ALA A 124 -6.402 10.554 -8.632 1.00 0.00 C ATOM 1838 O ALA A 124 -5.901 10.762 -7.528 1.00 0.00 O ATOM 1839 CB ALA A 124 -8.329 12.171 -8.263 1.00 0.00 C ATOM 0 H ALA A 124 -8.519 9.567 -7.344 1.00 0.00 H new ATOM 0 HA ALA A 124 -8.029 10.920 -9.958 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -7.729 12.983 -8.674 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -9.380 12.345 -8.493 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -8.195 12.133 -7.182 1.00 0.00 H new ATOM 1845 N ALA A 125 -5.742 10.077 -9.678 1.00 0.00 N ATOM 1846 CA ALA A 125 -4.328 9.756 -9.587 1.00 0.00 C ATOM 1847 C ALA A 125 -3.518 11.053 -9.520 1.00 0.00 C ATOM 1848 O ALA A 125 -3.508 11.832 -10.472 1.00 0.00 O ATOM 1849 CB ALA A 125 -3.927 8.879 -10.775 1.00 0.00 C ATOM 0 H ALA A 125 -6.161 9.905 -10.592 1.00 0.00 H new ATOM 0 HA ALA A 125 -4.120 9.190 -8.679 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -2.866 8.638 -10.707 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -4.510 7.958 -10.761 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -4.119 9.415 -11.704 1.00 0.00 H new ATOM 1855 N GLN A 126 -2.860 11.243 -8.386 1.00 0.00 N ATOM 1856 CA GLN A 126 -2.050 12.432 -8.182 1.00 0.00 C ATOM 1857 C GLN A 126 -0.693 12.053 -7.585 1.00 0.00 C ATOM 1858 O GLN A 126 -0.587 11.075 -6.847 1.00 0.00 O ATOM 1859 CB GLN A 126 -2.776 13.445 -7.295 1.00 0.00 C ATOM 1860 CG GLN A 126 -3.448 12.752 -6.108 1.00 0.00 C ATOM 1861 CD GLN A 126 -4.972 12.802 -6.235 1.00 0.00 C ATOM 1862 OE1 GLN A 126 -5.529 13.513 -7.055 1.00 0.00 O ATOM 1863 NE2 GLN A 126 -5.612 12.009 -5.380 1.00 0.00 N ATOM 0 H GLN A 126 -2.871 10.594 -7.599 1.00 0.00 H new ATOM 0 HA GLN A 126 -1.881 12.903 -9.150 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.068 14.190 -6.932 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -3.525 13.977 -7.882 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -3.118 11.715 -6.053 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -3.141 13.234 -5.180 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -5.083 11.439 -4.719 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -6.631 11.971 -5.385 1.00 0.00 H new ATOM 1872 N TRP A 127 0.311 12.848 -7.926 1.00 0.00 N ATOM 1873 CA TRP A 127 1.656 12.608 -7.433 1.00 0.00 C ATOM 1874 C TRP A 127 1.740 13.152 -6.005 1.00 0.00 C ATOM 1875 O TRP A 127 0.882 13.924 -5.580 1.00 0.00 O ATOM 1876 CB TRP A 127 2.701 13.220 -8.368 1.00 0.00 C ATOM 1877 CG TRP A 127 2.960 12.400 -9.633 1.00 0.00 C ATOM 1878 CD1 TRP A 127 2.166 12.259 -10.703 1.00 0.00 C ATOM 1879 CD2 TRP A 127 4.133 11.608 -9.919 1.00 0.00 C ATOM 1880 NE1 TRP A 127 2.738 11.438 -11.653 1.00 0.00 N ATOM 1881 CE2 TRP A 127 3.972 11.029 -11.161 1.00 0.00 C ATOM 1882 CE3 TRP A 127 5.291 11.387 -9.152 1.00 0.00 C ATOM 1883 CZ2 TRP A 127 4.929 10.192 -11.747 1.00 0.00 C ATOM 1884 CZ3 TRP A 127 6.238 10.549 -9.752 1.00 0.00 C ATOM 1885 CH2 TRP A 127 6.091 9.958 -11.001 1.00 0.00 C ATOM 0 H TRP A 127 0.219 13.659 -8.538 1.00 0.00 H new ATOM 0 HA TRP A 127 1.874 11.540 -7.413 1.00 0.00 H new ATOM 0 HB2 TRP A 127 2.375 14.220 -8.656 1.00 0.00 H new ATOM 0 HB3 TRP A 127 3.638 13.335 -7.823 1.00 0.00 H new ATOM 0 HD1 TRP A 127 1.199 12.729 -10.809 1.00 0.00 H new ATOM 0 HE1 TRP A 127 2.330 11.179 -12.551 1.00 0.00 H new ATOM 0 HE3 TRP A 127 5.438 11.829 -8.177 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 4.779 9.751 -12.721 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 7.147 10.347 -9.205 1.00 0.00 H new ATOM 0 HH2 TRP A 127 6.869 9.321 -11.395 1.00 0.00 H new ATOM 1896 N GLY A 128 2.782 12.728 -5.305 1.00 0.00 N ATOM 1897 CA GLY A 128 2.989 13.163 -3.934 1.00 0.00 C ATOM 1898 C GLY A 128 4.424 12.887 -3.482 1.00 0.00 C ATOM 1899 O GLY A 128 4.932 11.780 -3.657 1.00 0.00 O ATOM 0 H GLY A 128 3.492 12.088 -5.661 1.00 0.00 H new ATOM 0 HA2 GLY A 128 2.776 14.229 -3.851 1.00 0.00 H new ATOM 0 HA3 GLY A 128 2.291 12.646 -3.275 1.00 0.00 H new ATOM 1903 N GLU A 129 5.038 13.911 -2.908 1.00 0.00 N ATOM 1904 CA GLU A 129 6.405 13.792 -2.429 1.00 0.00 C ATOM 1905 C GLU A 129 6.457 12.892 -1.193 1.00 0.00 C ATOM 1906 O GLU A 129 5.619 13.009 -0.300 1.00 0.00 O ATOM 1907 CB GLU A 129 7.003 15.168 -2.132 1.00 0.00 C ATOM 1908 CG GLU A 129 8.197 15.053 -1.182 1.00 0.00 C ATOM 1909 CD GLU A 129 8.841 16.421 -0.943 1.00 0.00 C ATOM 1910 OE1 GLU A 129 8.901 17.198 -1.920 1.00 0.00 O ATOM 1911 OE2 GLU A 129 9.258 16.657 0.211 1.00 0.00 O ATOM 0 H GLU A 129 4.614 14.827 -2.764 1.00 0.00 H new ATOM 0 HA GLU A 129 7.007 13.333 -3.214 1.00 0.00 H new ATOM 0 HB2 GLU A 129 7.318 15.640 -3.063 1.00 0.00 H new ATOM 0 HB3 GLU A 129 6.242 15.811 -1.690 1.00 0.00 H new ATOM 0 HG2 GLU A 129 7.871 14.629 -0.232 1.00 0.00 H new ATOM 0 HG3 GLU A 129 8.934 14.368 -1.600 1.00 0.00 H new ATOM 1918 N LEU A 130 7.451 12.016 -1.180 1.00 0.00 N ATOM 1919 CA LEU A 130 7.624 11.097 -0.068 1.00 0.00 C ATOM 1920 C LEU A 130 8.260 11.841 1.108 1.00 0.00 C ATOM 1921 O LEU A 130 9.244 12.559 0.934 1.00 0.00 O ATOM 1922 CB LEU A 130 8.409 9.861 -0.511 1.00 0.00 C ATOM 1923 CG LEU A 130 7.682 8.911 -1.466 1.00 0.00 C ATOM 1924 CD1 LEU A 130 8.678 8.063 -2.259 1.00 0.00 C ATOM 1925 CD2 LEU A 130 6.667 8.049 -0.713 1.00 0.00 C ATOM 0 H LEU A 130 8.145 11.923 -1.922 1.00 0.00 H new ATOM 0 HA LEU A 130 6.658 10.726 0.274 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.330 10.193 -0.991 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.697 9.300 0.378 1.00 0.00 H new ATOM 0 HG LEU A 130 7.125 9.510 -2.186 1.00 0.00 H new ATOM 0 HD11 LEU A 130 8.136 7.397 -2.930 1.00 0.00 H new ATOM 0 HD12 LEU A 130 9.328 8.715 -2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 130 9.282 7.472 -1.570 1.00 0.00 H new ATOM 0 HD21 LEU A 130 6.164 7.383 -1.414 1.00 0.00 H new ATOM 0 HD22 LEU A 130 7.182 7.457 0.044 1.00 0.00 H new ATOM 0 HD23 LEU A 130 5.930 8.692 -0.231 1.00 0.00 H new ATOM 1937 N LYS A 131 7.673 11.643 2.279 1.00 0.00 N ATOM 1938 CA LYS A 131 8.171 12.286 3.483 1.00 0.00 C ATOM 1939 C LYS A 131 9.153 11.348 4.189 1.00 0.00 C ATOM 1940 O LYS A 131 8.901 10.910 5.311 1.00 0.00 O ATOM 1941 CB LYS A 131 7.008 12.738 4.369 1.00 0.00 C ATOM 1942 CG LYS A 131 6.046 13.640 3.593 1.00 0.00 C ATOM 1943 CD LYS A 131 6.568 15.077 3.537 1.00 0.00 C ATOM 1944 CE LYS A 131 6.792 15.524 2.091 1.00 0.00 C ATOM 1945 NZ LYS A 131 6.258 16.888 1.881 1.00 0.00 N ATOM 0 H LYS A 131 6.858 11.047 2.420 1.00 0.00 H new ATOM 0 HA LYS A 131 8.721 13.193 3.231 1.00 0.00 H new ATOM 0 HB2 LYS A 131 6.472 11.866 4.744 1.00 0.00 H new ATOM 0 HB3 LYS A 131 7.394 13.273 5.237 1.00 0.00 H new ATOM 0 HG2 LYS A 131 5.918 13.256 2.581 1.00 0.00 H new ATOM 0 HG3 LYS A 131 5.064 13.624 4.067 1.00 0.00 H new ATOM 0 HD2 LYS A 131 5.856 15.745 4.022 1.00 0.00 H new ATOM 0 HD3 LYS A 131 7.503 15.150 4.093 1.00 0.00 H new ATOM 0 HE2 LYS A 131 7.857 15.504 1.859 1.00 0.00 H new ATOM 0 HE3 LYS A 131 6.304 14.827 1.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 6.418 17.176 0.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 5.238 16.896 2.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 6.742 17.552 2.518 1.00 0.00 H new ATOM 1959 N THR A 132 10.250 11.067 3.502 1.00 0.00 N ATOM 1960 CA THR A 132 11.271 10.189 4.049 1.00 0.00 C ATOM 1961 C THR A 132 11.443 10.440 5.548 1.00 0.00 C ATOM 1962 O THR A 132 11.510 9.497 6.335 1.00 0.00 O ATOM 1963 CB THR A 132 12.556 10.400 3.246 1.00 0.00 C ATOM 1964 OG1 THR A 132 12.857 11.781 3.430 1.00 0.00 O ATOM 1965 CG2 THR A 132 12.333 10.265 1.738 1.00 0.00 C ATOM 0 H THR A 132 10.455 11.432 2.572 1.00 0.00 H new ATOM 0 HA THR A 132 10.982 9.142 3.958 1.00 0.00 H new ATOM 0 HB THR A 132 13.308 9.679 3.568 1.00 0.00 H new ATOM 0 HG1 THR A 132 13.678 12.004 2.944 1.00 0.00 H new ATOM 0 HG21 THR A 132 13.276 10.424 1.215 1.00 0.00 H new ATOM 0 HG22 THR A 132 11.957 9.267 1.514 1.00 0.00 H new ATOM 0 HG23 THR A 132 11.606 11.008 1.410 1.00 0.00 H new ATOM 1973 N SER A 133 11.510 11.716 5.898 1.00 0.00 N ATOM 1974 CA SER A 133 11.673 12.103 7.289 1.00 0.00 C ATOM 1975 C SER A 133 10.379 11.837 8.061 1.00 0.00 C ATOM 1976 O SER A 133 9.317 12.337 7.692 1.00 0.00 O ATOM 1977 CB SER A 133 12.069 13.577 7.408 1.00 0.00 C ATOM 1978 OG SER A 133 11.197 14.425 6.665 1.00 0.00 O ATOM 0 H SER A 133 11.454 12.495 5.242 1.00 0.00 H new ATOM 0 HA SER A 133 12.475 11.503 7.719 1.00 0.00 H new ATOM 0 HB2 SER A 133 12.055 13.873 8.457 1.00 0.00 H new ATOM 0 HB3 SER A 133 13.091 13.708 7.053 1.00 0.00 H new ATOM 0 HG SER A 133 11.099 15.282 7.131 1.00 0.00 H new ATOM 1984 N GLY A 134 10.510 11.052 9.120 1.00 0.00 N ATOM 1985 CA GLY A 134 9.365 10.713 9.948 1.00 0.00 C ATOM 1986 C GLY A 134 9.352 9.220 10.282 1.00 0.00 C ATOM 1987 O GLY A 134 9.969 8.419 9.582 1.00 0.00 O ATOM 0 H GLY A 134 11.392 10.641 9.424 1.00 0.00 H new ATOM 0 HA2 GLY A 134 9.393 11.295 10.869 1.00 0.00 H new ATOM 0 HA3 GLY A 134 8.445 10.981 9.429 1.00 0.00 H new ATOM 1991 N PRO A 135 8.622 8.883 11.379 1.00 0.00 N ATOM 1992 CA PRO A 135 8.520 7.501 11.814 1.00 0.00 C ATOM 1993 C PRO A 135 7.581 6.707 10.903 1.00 0.00 C ATOM 1994 O PRO A 135 6.776 7.288 10.178 1.00 0.00 O ATOM 1995 CB PRO A 135 8.031 7.576 13.251 1.00 0.00 C ATOM 1996 CG PRO A 135 7.435 8.964 13.416 1.00 0.00 C ATOM 1997 CD PRO A 135 7.878 9.806 12.231 1.00 0.00 C ATOM 0 HA PRO A 135 9.471 6.971 11.758 1.00 0.00 H new ATOM 0 HB2 PRO A 135 7.287 6.805 13.451 1.00 0.00 H new ATOM 0 HB3 PRO A 135 8.851 7.417 13.951 1.00 0.00 H new ATOM 0 HG2 PRO A 135 6.347 8.909 13.460 1.00 0.00 H new ATOM 0 HG3 PRO A 135 7.770 9.414 14.351 1.00 0.00 H new ATOM 0 HD2 PRO A 135 7.023 10.229 11.704 1.00 0.00 H new ATOM 0 HD3 PRO A 135 8.502 10.641 12.550 1.00 0.00 H new ATOM 2005 N SER A 136 7.717 5.391 10.971 1.00 0.00 N ATOM 2006 CA SER A 136 6.891 4.511 10.161 1.00 0.00 C ATOM 2007 C SER A 136 5.784 3.896 11.020 1.00 0.00 C ATOM 2008 O SER A 136 6.054 3.067 11.887 1.00 0.00 O ATOM 2009 CB SER A 136 7.731 3.410 9.511 1.00 0.00 C ATOM 2010 OG SER A 136 6.923 2.449 8.837 1.00 0.00 O ATOM 0 H SER A 136 8.386 4.913 11.574 1.00 0.00 H new ATOM 0 HA SER A 136 6.439 5.103 9.365 1.00 0.00 H new ATOM 0 HB2 SER A 136 8.429 3.857 8.803 1.00 0.00 H new ATOM 0 HB3 SER A 136 8.327 2.911 10.275 1.00 0.00 H new ATOM 0 HG SER A 136 7.494 1.858 8.303 1.00 0.00 H new ATOM 2016 N SER A 137 4.560 4.327 10.749 1.00 0.00 N ATOM 2017 CA SER A 137 3.411 3.829 11.486 1.00 0.00 C ATOM 2018 C SER A 137 2.145 4.564 11.040 1.00 0.00 C ATOM 2019 O SER A 137 2.136 5.790 10.945 1.00 0.00 O ATOM 2020 CB SER A 137 3.613 3.988 12.994 1.00 0.00 C ATOM 2021 OG SER A 137 3.297 2.793 13.703 1.00 0.00 O ATOM 0 H SER A 137 4.339 5.015 10.029 1.00 0.00 H new ATOM 0 HA SER A 137 3.301 2.766 11.271 1.00 0.00 H new ATOM 0 HB2 SER A 137 4.648 4.266 13.194 1.00 0.00 H new ATOM 0 HB3 SER A 137 2.988 4.803 13.360 1.00 0.00 H new ATOM 0 HG SER A 137 3.440 2.934 14.662 1.00 0.00 H new ATOM 2027 N GLY A 138 1.107 3.783 10.778 1.00 0.00 N ATOM 2028 CA GLY A 138 -0.161 4.344 10.345 1.00 0.00 C ATOM 2029 C GLY A 138 -0.836 5.115 11.481 1.00 0.00 C ATOM 2030 O GLY A 138 -0.771 4.705 12.639 1.00 0.00 O ATOM 0 H GLY A 138 1.119 2.766 10.857 1.00 0.00 H new ATOM 0 HA2 GLY A 138 0.002 5.008 9.496 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -0.818 3.545 10.002 1.00 0.00 H new TER 2034 GLY A 138