USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 775 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 42 ASN : amide:sc= -0.191 K(o=-0.46,f=-3.4!) USER MOD Set 1.2: A 64 GLN : amide:sc= -0.265 K(o=-0.46,f=-1.3) USER MOD Set 2.1: A 51 SER OG : rot -22:sc= 0.213 USER MOD Set 2.2: A 56 LYS NZ :NH3+ 148:sc= 0.166 (180deg=-0.186) USER MOD Single : A 1 SER N :NH3+ -156:sc=-0.00207 (180deg=-0.155) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0378 USER MOD Single : A 2 GLN : amide:sc=-0.00528 X(o=-0.0053,f=0) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=-0.081) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 41:sc= 0.177 USER MOD Single : A 12 THR OG1 : rot -123:sc= 0.00954 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0.103 USER MOD Single : A 16 GLN : amide:sc= -0.0617 X(o=-0.062,f=-0.017) USER MOD Single : A 20 ASN : amide:sc=-0.00982 X(o=-0.0098,f=0) USER MOD Single : A 27 MET CE :methyl -172:sc= 0 (180deg=-0.0103) USER MOD Single : A 31 ASN : amide:sc= -1.25 K(o=-1.3,f=-6.3!) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot -0:sc= 0.591 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc=-0.00805 X(o=-0.008,f=-0.0063) USER MOD Single : A 66 GLN : amide:sc= -0.579 X(o=-0.58,f=-0.17) USER MOD Single : A 73 GLN : amide:sc= 0.306 X(o=0.31,f=-0.047) USER MOD Single : A 80 SER OG : rot 180:sc= -0.0324 USER MOD Single : A 89 GLN : amide:sc= 0.214 K(o=0.21,f=-0.6) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -12.291 37.411 -9.701 1.00 25.00 N ATOM 2 CA SER A 1 -12.129 36.333 -10.725 1.00 25.00 C ATOM 3 C SER A 1 -11.419 35.095 -10.232 1.00 25.00 C ATOM 4 O SER A 1 -11.618 33.999 -10.713 1.00 25.00 O ATOM 5 CB SER A 1 -11.349 36.906 -11.910 1.00 25.00 C ATOM 6 OG SER A 1 -10.123 37.460 -11.428 1.00 25.00 O ATOM 0 H1 SER A 1 -13.097 38.015 -9.958 1.00 25.00 H new ATOM 0 H2 SER A 1 -12.463 36.982 -8.769 1.00 25.00 H new ATOM 0 H3 SER A 1 -11.425 37.986 -9.663 1.00 25.00 H new ATOM 0 HA SER A 1 -13.135 36.015 -10.998 1.00 25.00 H new ATOM 0 HB2 SER A 1 -11.148 36.125 -12.643 1.00 25.00 H new ATOM 0 HB3 SER A 1 -11.937 37.673 -12.414 1.00 25.00 H new ATOM 0 HG SER A 1 -9.613 37.829 -12.179 1.00 25.00 H new ATOM 14 N GLN A 2 -10.557 35.302 -9.216 1.00 25.00 N ATOM 15 CA GLN A 2 -9.749 34.251 -8.573 1.00 25.00 C ATOM 16 C GLN A 2 -8.880 33.542 -9.622 1.00 25.00 C ATOM 17 O GLN A 2 -8.686 32.333 -9.588 1.00 25.00 O ATOM 18 CB GLN A 2 -10.647 33.252 -7.825 1.00 25.00 C ATOM 19 CG GLN A 2 -11.601 33.919 -6.826 1.00 25.00 C ATOM 20 CD GLN A 2 -12.442 32.913 -6.069 1.00 25.00 C ATOM 21 OE1 GLN A 2 -12.425 32.873 -4.853 1.00 25.00 O ATOM 22 NE2 GLN A 2 -13.183 32.104 -6.784 1.00 25.00 N ATOM 0 H GLN A 2 -10.401 36.226 -8.812 1.00 25.00 H new ATOM 0 HA GLN A 2 -9.091 34.714 -7.838 1.00 25.00 H new ATOM 0 HB2 GLN A 2 -11.231 32.686 -8.551 1.00 25.00 H new ATOM 0 HB3 GLN A 2 -10.019 32.537 -7.294 1.00 25.00 H new ATOM 0 HG2 GLN A 2 -11.023 34.512 -6.117 1.00 25.00 H new ATOM 0 HG3 GLN A 2 -12.256 34.608 -7.359 1.00 25.00 H new ATOM 0 HE21 GLN A 2 -13.171 32.167 -7.802 1.00 25.00 H new ATOM 0 HE22 GLN A 2 -13.772 31.411 -6.323 1.00 25.00 H new ATOM 31 N GLN A 3 -8.407 34.323 -10.582 1.00 25.00 N ATOM 32 CA GLN A 3 -7.621 33.816 -11.699 1.00 25.00 C ATOM 33 C GLN A 3 -6.190 33.480 -11.251 1.00 25.00 C ATOM 34 O GLN A 3 -5.599 34.212 -10.455 1.00 25.00 O ATOM 35 CB GLN A 3 -7.597 34.885 -12.801 1.00 25.00 C ATOM 36 CG GLN A 3 -7.036 34.429 -14.136 1.00 25.00 C ATOM 37 CD GLN A 3 -7.130 35.512 -15.187 1.00 25.00 C ATOM 38 OE1 GLN A 3 -8.184 36.078 -15.417 1.00 25.00 O ATOM 39 NE2 GLN A 3 -6.029 35.804 -15.823 1.00 25.00 N ATOM 0 H GLN A 3 -8.558 35.331 -10.609 1.00 25.00 H new ATOM 0 HA GLN A 3 -8.073 32.899 -12.077 1.00 25.00 H new ATOM 0 HB2 GLN A 3 -8.614 35.245 -12.957 1.00 25.00 H new ATOM 0 HB3 GLN A 3 -7.009 35.733 -12.449 1.00 25.00 H new ATOM 0 HG2 GLN A 3 -5.994 34.135 -14.010 1.00 25.00 H new ATOM 0 HG3 GLN A 3 -7.578 33.546 -14.475 1.00 25.00 H new ATOM 0 HE21 GLN A 3 -5.166 35.308 -15.602 1.00 25.00 H new ATOM 0 HE22 GLN A 3 -6.032 36.529 -16.541 1.00 25.00 H new ATOM 48 N SER A 4 -5.638 32.398 -11.784 1.00 25.00 N ATOM 49 CA SER A 4 -4.280 31.945 -11.456 1.00 25.00 C ATOM 50 C SER A 4 -3.405 31.957 -12.708 1.00 25.00 C ATOM 51 O SER A 4 -3.920 31.955 -13.822 1.00 25.00 O ATOM 52 CB SER A 4 -4.332 30.525 -10.889 1.00 25.00 C ATOM 53 OG SER A 4 -5.158 30.482 -9.742 1.00 25.00 O ATOM 0 H SER A 4 -6.117 31.803 -12.460 1.00 25.00 H new ATOM 0 HA SER A 4 -3.854 32.620 -10.714 1.00 25.00 H new ATOM 0 HB2 SER A 4 -4.713 29.838 -11.645 1.00 25.00 H new ATOM 0 HB3 SER A 4 -3.326 30.192 -10.633 1.00 25.00 H new ATOM 0 HG SER A 4 -5.183 29.567 -9.391 1.00 25.00 H new ATOM 59 N HIS A 5 -2.086 31.956 -12.519 1.00 25.00 N ATOM 60 CA HIS A 5 -1.140 31.978 -13.646 1.00 25.00 C ATOM 61 C HIS A 5 -0.604 30.603 -14.034 1.00 25.00 C ATOM 62 O HIS A 5 -0.275 30.386 -15.195 1.00 25.00 O ATOM 63 CB HIS A 5 0.051 32.870 -13.297 1.00 25.00 C ATOM 64 CG HIS A 5 -0.079 34.265 -13.815 1.00 25.00 C ATOM 65 ND1 HIS A 5 0.128 34.623 -15.120 1.00 25.00 N ATOM 66 CD2 HIS A 5 -0.402 35.420 -13.179 1.00 25.00 C ATOM 67 CE1 HIS A 5 -0.076 35.933 -15.230 1.00 25.00 C ATOM 68 NE2 HIS A 5 -0.409 36.473 -14.075 1.00 25.00 N ATOM 0 H HIS A 5 -1.644 31.940 -11.600 1.00 25.00 H new ATOM 0 HA HIS A 5 -1.702 32.361 -14.498 1.00 25.00 H new ATOM 0 HB2 HIS A 5 0.166 32.902 -12.214 1.00 25.00 H new ATOM 0 HB3 HIS A 5 0.960 32.424 -13.701 1.00 25.00 H new ATOM 0 HD2 HIS A 5 -0.622 35.504 -12.125 1.00 25.00 H new ATOM 0 HE1 HIS A 5 0.020 36.486 -16.153 1.00 25.00 H new ATOM 0 HE2 HIS A 5 -0.624 37.452 -13.884 1.00 25.00 H new ATOM 76 N SER A 6 -0.466 29.712 -13.053 1.00 25.00 N ATOM 77 CA SER A 6 0.077 28.356 -13.266 1.00 25.00 C ATOM 78 C SER A 6 1.392 28.344 -14.061 1.00 25.00 C ATOM 79 O SER A 6 1.598 27.494 -14.921 1.00 25.00 O ATOM 80 CB SER A 6 -0.962 27.497 -13.985 1.00 25.00 C ATOM 81 OG SER A 6 -2.206 27.561 -13.301 1.00 25.00 O ATOM 0 H SER A 6 -0.725 29.903 -12.085 1.00 25.00 H new ATOM 0 HA SER A 6 0.302 27.949 -12.280 1.00 25.00 H new ATOM 0 HB2 SER A 6 -1.084 27.843 -15.011 1.00 25.00 H new ATOM 0 HB3 SER A 6 -0.619 26.464 -14.036 1.00 25.00 H new ATOM 0 HG SER A 6 -2.866 27.009 -13.770 1.00 25.00 H new ATOM 87 N SER A 7 2.263 29.304 -13.784 1.00 25.00 N ATOM 88 CA SER A 7 3.534 29.433 -14.491 1.00 25.00 C ATOM 89 C SER A 7 4.666 29.215 -13.499 1.00 25.00 C ATOM 90 O SER A 7 4.544 29.619 -12.343 1.00 25.00 O ATOM 91 CB SER A 7 3.655 30.839 -15.085 1.00 25.00 C ATOM 92 OG SER A 7 2.534 31.147 -15.903 1.00 25.00 O ATOM 0 H SER A 7 2.112 30.013 -13.067 1.00 25.00 H new ATOM 0 HA SER A 7 3.585 28.697 -15.293 1.00 25.00 H new ATOM 0 HB2 SER A 7 3.735 31.571 -14.281 1.00 25.00 H new ATOM 0 HB3 SER A 7 4.569 30.911 -15.674 1.00 25.00 H new ATOM 0 HG SER A 7 1.716 30.818 -15.474 1.00 25.00 H new ATOM 98 N PRO A 8 5.774 28.581 -13.923 1.00 25.00 N ATOM 99 CA PRO A 8 6.874 28.404 -12.973 1.00 25.00 C ATOM 100 C PRO A 8 7.695 29.679 -12.801 1.00 25.00 C ATOM 101 O PRO A 8 7.548 30.631 -13.559 1.00 25.00 O ATOM 102 CB PRO A 8 7.713 27.316 -13.634 1.00 25.00 C ATOM 103 CG PRO A 8 7.561 27.598 -15.086 1.00 25.00 C ATOM 104 CD PRO A 8 6.107 28.000 -15.239 1.00 25.00 C ATOM 0 HA PRO A 8 6.526 28.153 -11.971 1.00 25.00 H new ATOM 0 HB2 PRO A 8 8.756 27.368 -13.322 1.00 25.00 H new ATOM 0 HB3 PRO A 8 7.353 26.320 -13.378 1.00 25.00 H new ATOM 0 HG2 PRO A 8 8.230 28.396 -15.409 1.00 25.00 H new ATOM 0 HG3 PRO A 8 7.797 26.721 -15.688 1.00 25.00 H new ATOM 0 HD2 PRO A 8 5.972 28.723 -16.043 1.00 25.00 H new ATOM 0 HD3 PRO A 8 5.475 27.143 -15.472 1.00 25.00 H new ATOM 112 N GLY A 9 8.593 29.654 -11.825 1.00 25.00 N ATOM 113 CA GLY A 9 9.507 30.763 -11.574 1.00 25.00 C ATOM 114 C GLY A 9 10.956 30.294 -11.646 1.00 25.00 C ATOM 115 O GLY A 9 11.820 30.796 -10.938 1.00 25.00 O ATOM 0 H GLY A 9 8.709 28.867 -11.186 1.00 25.00 H new ATOM 0 HA2 GLY A 9 9.338 31.553 -12.306 1.00 25.00 H new ATOM 0 HA3 GLY A 9 9.306 31.191 -10.592 1.00 25.00 H new ATOM 119 N GLU A 10 11.204 29.279 -12.469 1.00 25.00 N ATOM 120 CA GLU A 10 12.525 28.610 -12.535 1.00 25.00 C ATOM 121 C GLU A 10 13.649 29.399 -13.250 1.00 25.00 C ATOM 122 O GLU A 10 14.571 28.837 -13.826 1.00 25.00 O ATOM 123 CB GLU A 10 12.346 27.227 -13.179 1.00 25.00 C ATOM 124 CG GLU A 10 13.336 26.175 -12.666 1.00 25.00 C ATOM 125 CD GLU A 10 13.153 25.901 -11.182 1.00 25.00 C ATOM 126 OE1 GLU A 10 14.046 26.290 -10.390 1.00 25.00 O ATOM 127 OE2 GLU A 10 12.104 25.336 -10.800 1.00 25.00 O ATOM 0 H GLU A 10 10.510 28.891 -13.108 1.00 25.00 H new ATOM 0 HA GLU A 10 12.872 28.535 -11.504 1.00 25.00 H new ATOM 0 HB2 GLU A 10 11.330 26.878 -12.993 1.00 25.00 H new ATOM 0 HB3 GLU A 10 12.458 27.322 -14.259 1.00 25.00 H new ATOM 0 HG2 GLU A 10 13.204 25.249 -13.225 1.00 25.00 H new ATOM 0 HG3 GLU A 10 14.355 26.515 -12.849 1.00 25.00 H new ATOM 134 N ILE A 11 13.598 30.719 -13.158 1.00 25.00 N ATOM 135 CA ILE A 11 14.626 31.608 -13.654 1.00 25.00 C ATOM 136 C ILE A 11 15.711 31.771 -12.580 1.00 25.00 C ATOM 137 O ILE A 11 16.433 32.766 -12.522 1.00 25.00 O ATOM 138 CB ILE A 11 14.003 32.997 -13.995 1.00 25.00 C ATOM 139 CG1 ILE A 11 12.474 32.880 -14.242 1.00 25.00 C ATOM 140 CG2 ILE A 11 14.681 33.529 -15.212 1.00 25.00 C ATOM 141 CD1 ILE A 11 11.772 34.190 -14.610 1.00 25.00 C ATOM 0 H ILE A 11 12.817 31.210 -12.723 1.00 25.00 H new ATOM 0 HA ILE A 11 15.068 31.189 -14.558 1.00 25.00 H new ATOM 0 HB ILE A 11 14.148 33.674 -13.153 1.00 25.00 H new ATOM 0 HG12 ILE A 11 12.305 32.159 -15.042 1.00 25.00 H new ATOM 0 HG13 ILE A 11 12.007 32.476 -13.344 1.00 25.00 H new ATOM 0 HG21 ILE A 11 14.259 34.501 -15.468 1.00 25.00 H new ATOM 0 HG22 ILE A 11 15.748 33.636 -15.017 1.00 25.00 H new ATOM 0 HG23 ILE A 11 14.532 32.839 -16.043 1.00 25.00 H new ATOM 0 HD11 ILE A 11 10.709 34.003 -14.762 1.00 25.00 H new ATOM 0 HD12 ILE A 11 11.902 34.911 -13.803 1.00 25.00 H new ATOM 0 HD13 ILE A 11 12.205 34.590 -15.527 1.00 25.00 H new ATOM 153 N THR A 12 15.774 30.807 -11.676 1.00 25.00 N ATOM 154 CA THR A 12 16.626 30.891 -10.505 1.00 25.00 C ATOM 155 C THR A 12 18.122 30.869 -10.850 1.00 25.00 C ATOM 156 O THR A 12 18.587 30.135 -11.728 1.00 25.00 O ATOM 157 CB THR A 12 16.307 29.747 -9.515 1.00 25.00 C ATOM 158 OG1 THR A 12 16.504 28.483 -10.151 1.00 25.00 O ATOM 159 CG2 THR A 12 14.862 29.817 -9.040 1.00 25.00 C ATOM 0 H THR A 12 15.234 29.944 -11.735 1.00 25.00 H new ATOM 0 HA THR A 12 16.412 31.854 -10.041 1.00 25.00 H new ATOM 0 HB THR A 12 16.975 29.856 -8.661 1.00 25.00 H new ATOM 0 HG1 THR A 12 15.674 27.964 -10.111 1.00 25.00 H new ATOM 0 HG21 THR A 12 14.667 29.000 -8.345 1.00 25.00 H new ATOM 0 HG22 THR A 12 14.690 30.769 -8.538 1.00 25.00 H new ATOM 0 HG23 THR A 12 14.193 29.732 -9.896 1.00 25.00 H new ATOM 167 N SER A 13 18.886 31.673 -10.125 1.00 25.00 N ATOM 168 CA SER A 13 20.331 31.741 -10.315 1.00 25.00 C ATOM 169 C SER A 13 21.037 30.730 -9.427 1.00 25.00 C ATOM 170 O SER A 13 22.241 30.502 -9.541 1.00 25.00 O ATOM 171 CB SER A 13 20.827 33.144 -9.989 1.00 25.00 C ATOM 172 OG SER A 13 19.786 34.089 -10.186 1.00 25.00 O ATOM 0 H SER A 13 18.529 32.291 -9.396 1.00 25.00 H new ATOM 0 HA SER A 13 20.555 31.507 -11.356 1.00 25.00 H new ATOM 0 HB2 SER A 13 21.174 33.184 -8.957 1.00 25.00 H new ATOM 0 HB3 SER A 13 21.679 33.393 -10.622 1.00 25.00 H new ATOM 0 HG SER A 13 20.115 34.987 -9.972 1.00 25.00 H new ATOM 178 N SER A 14 20.275 30.108 -8.551 1.00 25.00 N ATOM 179 CA SER A 14 20.809 29.117 -7.619 1.00 25.00 C ATOM 180 C SER A 14 21.544 27.932 -8.289 1.00 25.00 C ATOM 181 O SER A 14 22.664 27.609 -7.888 1.00 25.00 O ATOM 182 CB SER A 14 19.668 28.610 -6.739 1.00 25.00 C ATOM 183 OG SER A 14 18.623 29.570 -6.736 1.00 25.00 O ATOM 0 H SER A 14 19.272 30.269 -8.459 1.00 25.00 H new ATOM 0 HA SER A 14 21.573 29.620 -7.026 1.00 25.00 H new ATOM 0 HB2 SER A 14 19.300 27.655 -7.113 1.00 25.00 H new ATOM 0 HB3 SER A 14 20.024 28.438 -5.723 1.00 25.00 H new ATOM 0 HG SER A 14 17.886 29.250 -6.174 1.00 25.00 H new ATOM 189 N PRO A 15 20.959 27.293 -9.339 1.00 25.00 N ATOM 190 CA PRO A 15 21.763 26.209 -9.927 1.00 25.00 C ATOM 191 C PRO A 15 22.969 26.698 -10.721 1.00 25.00 C ATOM 192 O PRO A 15 23.960 25.997 -10.853 1.00 25.00 O ATOM 193 CB PRO A 15 20.769 25.500 -10.845 1.00 25.00 C ATOM 194 CG PRO A 15 19.841 26.566 -11.268 1.00 25.00 C ATOM 195 CD PRO A 15 19.660 27.409 -10.033 1.00 25.00 C ATOM 0 HA PRO A 15 22.197 25.575 -9.154 1.00 25.00 H new ATOM 0 HB2 PRO A 15 21.270 25.046 -11.700 1.00 25.00 H new ATOM 0 HB3 PRO A 15 20.245 24.700 -10.322 1.00 25.00 H new ATOM 0 HG2 PRO A 15 20.253 27.149 -12.092 1.00 25.00 H new ATOM 0 HG3 PRO A 15 18.892 26.155 -11.612 1.00 25.00 H new ATOM 0 HD2 PRO A 15 19.431 28.445 -10.285 1.00 25.00 H new ATOM 0 HD3 PRO A 15 18.841 27.043 -9.414 1.00 25.00 H new ATOM 203 N GLN A 16 22.895 27.925 -11.220 1.00 25.00 N ATOM 204 CA GLN A 16 23.999 28.522 -11.973 1.00 25.00 C ATOM 205 C GLN A 16 25.152 28.780 -10.998 1.00 25.00 C ATOM 206 O GLN A 16 26.328 28.665 -11.331 1.00 25.00 O ATOM 207 CB GLN A 16 23.529 29.836 -12.615 1.00 25.00 C ATOM 208 CG GLN A 16 22.300 29.669 -13.520 1.00 25.00 C ATOM 209 CD GLN A 16 21.833 30.989 -14.106 1.00 25.00 C ATOM 210 OE1 GLN A 16 22.610 31.737 -14.676 1.00 25.00 O ATOM 211 NE2 GLN A 16 20.566 31.279 -13.959 1.00 25.00 N ATOM 0 H GLN A 16 22.081 28.531 -11.118 1.00 25.00 H new ATOM 0 HA GLN A 16 24.332 27.854 -12.768 1.00 25.00 H new ATOM 0 HB2 GLN A 16 23.296 30.553 -11.828 1.00 25.00 H new ATOM 0 HB3 GLN A 16 24.346 30.259 -13.199 1.00 25.00 H new ATOM 0 HG2 GLN A 16 22.538 28.979 -14.329 1.00 25.00 H new ATOM 0 HG3 GLN A 16 21.488 29.221 -12.947 1.00 25.00 H new ATOM 0 HE21 GLN A 16 19.947 30.628 -13.476 1.00 25.00 H new ATOM 0 HE22 GLN A 16 20.198 32.156 -14.327 1.00 25.00 H new ATOM 220 N GLY A 17 24.791 29.072 -9.759 1.00 25.00 N ATOM 221 CA GLY A 17 25.768 29.298 -8.711 1.00 25.00 C ATOM 222 C GLY A 17 26.519 28.049 -8.275 1.00 25.00 C ATOM 223 O GLY A 17 27.480 28.150 -7.521 1.00 25.00 O ATOM 0 H GLY A 17 23.821 29.158 -9.455 1.00 25.00 H new ATOM 0 HA2 GLY A 17 26.489 30.039 -9.056 1.00 25.00 H new ATOM 0 HA3 GLY A 17 25.262 29.725 -7.845 1.00 25.00 H new ATOM 227 N LEU A 18 26.107 26.875 -8.743 1.00 25.00 N ATOM 228 CA LEU A 18 26.831 25.648 -8.402 1.00 25.00 C ATOM 229 C LEU A 18 28.096 25.575 -9.232 1.00 25.00 C ATOM 230 O LEU A 18 29.135 25.112 -8.770 1.00 25.00 O ATOM 231 CB LEU A 18 25.978 24.405 -8.673 1.00 25.00 C ATOM 232 CG LEU A 18 24.652 24.321 -7.913 1.00 25.00 C ATOM 233 CD1 LEU A 18 23.899 23.070 -8.357 1.00 25.00 C ATOM 234 CD2 LEU A 18 24.859 24.294 -6.382 1.00 25.00 C ATOM 0 H LEU A 18 25.295 26.744 -9.346 1.00 25.00 H new ATOM 0 HA LEU A 18 27.071 25.673 -7.339 1.00 25.00 H new ATOM 0 HB2 LEU A 18 25.765 24.361 -9.741 1.00 25.00 H new ATOM 0 HB3 LEU A 18 26.570 23.523 -8.429 1.00 25.00 H new ATOM 0 HG LEU A 18 24.073 25.215 -8.145 1.00 25.00 H new ATOM 0 HD11 LEU A 18 22.953 23.004 -7.819 1.00 25.00 H new ATOM 0 HD12 LEU A 18 23.704 23.124 -9.428 1.00 25.00 H new ATOM 0 HD13 LEU A 18 24.501 22.187 -8.141 1.00 25.00 H new ATOM 0 HD21 LEU A 18 23.891 24.234 -5.885 1.00 25.00 H new ATOM 0 HD22 LEU A 18 25.460 23.426 -6.111 1.00 25.00 H new ATOM 0 HD23 LEU A 18 25.372 25.203 -6.068 1.00 25.00 H new ATOM 246 N ASP A 19 27.993 26.059 -10.462 1.00 25.00 N ATOM 247 CA ASP A 19 29.115 26.105 -11.398 1.00 25.00 C ATOM 248 C ASP A 19 29.993 27.299 -11.023 1.00 25.00 C ATOM 249 O ASP A 19 31.218 27.272 -11.104 1.00 25.00 O ATOM 250 CB ASP A 19 28.550 26.273 -12.812 1.00 25.00 C ATOM 251 CG ASP A 19 29.553 25.913 -13.907 1.00 25.00 C ATOM 252 OD1 ASP A 19 29.111 25.750 -15.066 1.00 25.00 O ATOM 253 OD2 ASP A 19 30.753 25.748 -13.616 1.00 25.00 O ATOM 0 H ASP A 19 27.125 26.434 -10.844 1.00 25.00 H new ATOM 0 HA ASP A 19 29.711 25.193 -11.358 1.00 25.00 H new ATOM 0 HB2 ASP A 19 27.664 25.647 -12.919 1.00 25.00 H new ATOM 0 HB3 ASP A 19 28.229 27.306 -12.948 1.00 25.00 H new ATOM 258 N ASN A 20 29.341 28.336 -10.522 1.00 25.00 N ATOM 259 CA ASN A 20 30.026 29.542 -10.071 1.00 25.00 C ATOM 260 C ASN A 20 29.836 29.806 -8.574 1.00 25.00 C ATOM 261 O ASN A 20 29.046 30.675 -8.182 1.00 25.00 O ATOM 262 CB ASN A 20 29.497 30.758 -10.845 1.00 25.00 C ATOM 263 CG ASN A 20 30.062 30.865 -12.237 1.00 25.00 C ATOM 264 OD1 ASN A 20 29.333 30.845 -13.208 1.00 25.00 O ATOM 265 ND2 ASN A 20 31.345 31.063 -12.333 1.00 25.00 N ATOM 0 H ASN A 20 28.327 28.368 -10.416 1.00 25.00 H new ATOM 0 HA ASN A 20 31.089 29.386 -10.257 1.00 25.00 H new ATOM 0 HB2 ASN A 20 28.410 30.699 -10.904 1.00 25.00 H new ATOM 0 HB3 ASN A 20 29.737 31.666 -10.291 1.00 25.00 H new ATOM 0 HD21 ASN A 20 31.772 31.209 -13.248 1.00 25.00 H new ATOM 0 HD22 ASN A 20 31.924 31.073 -11.493 1.00 25.00 H new ATOM 272 N PRO A 21 30.643 29.146 -7.709 1.00 25.00 N ATOM 273 CA PRO A 21 30.554 29.449 -6.277 1.00 25.00 C ATOM 274 C PRO A 21 30.914 30.897 -5.977 1.00 25.00 C ATOM 275 O PRO A 21 30.454 31.472 -5.006 1.00 25.00 O ATOM 276 CB PRO A 21 31.593 28.499 -5.649 1.00 25.00 C ATOM 277 CG PRO A 21 32.523 28.211 -6.734 1.00 25.00 C ATOM 278 CD PRO A 21 31.679 28.130 -7.966 1.00 25.00 C ATOM 0 HA PRO A 21 29.544 29.315 -5.890 1.00 25.00 H new ATOM 0 HB2 PRO A 21 32.100 28.966 -4.805 1.00 25.00 H new ATOM 0 HB3 PRO A 21 31.124 27.589 -5.275 1.00 25.00 H new ATOM 0 HG2 PRO A 21 33.277 28.993 -6.824 1.00 25.00 H new ATOM 0 HG3 PRO A 21 33.054 27.275 -6.559 1.00 25.00 H new ATOM 0 HD2 PRO A 21 32.252 28.353 -8.866 1.00 25.00 H new ATOM 0 HD3 PRO A 21 31.250 27.137 -8.099 1.00 25.00 H new ATOM 286 N ALA A 22 31.726 31.505 -6.837 1.00 25.00 N ATOM 287 CA ALA A 22 32.109 32.898 -6.659 1.00 25.00 C ATOM 288 C ALA A 22 30.878 33.806 -6.722 1.00 25.00 C ATOM 289 O ALA A 22 30.739 34.727 -5.915 1.00 25.00 O ATOM 290 CB ALA A 22 33.134 33.297 -7.731 1.00 25.00 C ATOM 0 H ALA A 22 32.129 31.056 -7.660 1.00 25.00 H new ATOM 0 HA ALA A 22 32.565 33.017 -5.676 1.00 25.00 H new ATOM 0 HB1 ALA A 22 33.417 34.341 -7.593 1.00 25.00 H new ATOM 0 HB2 ALA A 22 34.018 32.666 -7.642 1.00 25.00 H new ATOM 0 HB3 ALA A 22 32.695 33.168 -8.720 1.00 25.00 H new ATOM 296 N LEU A 23 29.991 33.537 -7.677 1.00 25.00 N ATOM 297 CA LEU A 23 28.789 34.341 -7.862 1.00 25.00 C ATOM 298 C LEU A 23 27.722 33.982 -6.837 1.00 25.00 C ATOM 299 O LEU A 23 26.998 34.840 -6.371 1.00 25.00 O ATOM 300 CB LEU A 23 28.219 34.147 -9.275 1.00 25.00 C ATOM 301 CG LEU A 23 29.161 34.453 -10.454 1.00 25.00 C ATOM 302 CD1 LEU A 23 28.415 34.228 -11.774 1.00 25.00 C ATOM 303 CD2 LEU A 23 29.715 35.870 -10.427 1.00 25.00 C ATOM 0 H LEU A 23 30.084 32.765 -8.337 1.00 25.00 H new ATOM 0 HA LEU A 23 29.072 35.385 -7.725 1.00 25.00 H new ATOM 0 HB2 LEU A 23 27.885 33.114 -9.367 1.00 25.00 H new ATOM 0 HB3 LEU A 23 27.336 34.778 -9.374 1.00 25.00 H new ATOM 0 HG LEU A 23 30.010 33.776 -10.364 1.00 25.00 H new ATOM 0 HD11 LEU A 23 29.081 34.444 -12.610 1.00 25.00 H new ATOM 0 HD12 LEU A 23 28.084 33.191 -11.833 1.00 25.00 H new ATOM 0 HD13 LEU A 23 27.549 34.888 -11.820 1.00 25.00 H new ATOM 0 HD21 LEU A 23 30.371 36.021 -11.284 1.00 25.00 H new ATOM 0 HD22 LEU A 23 28.892 36.583 -10.470 1.00 25.00 H new ATOM 0 HD23 LEU A 23 30.279 36.023 -9.507 1.00 25.00 H new ATOM 315 N LEU A 24 27.651 32.711 -6.460 1.00 25.00 N ATOM 316 CA LEU A 24 26.681 32.281 -5.451 1.00 25.00 C ATOM 317 C LEU A 24 27.014 32.922 -4.116 1.00 25.00 C ATOM 318 O LEU A 24 26.135 33.389 -3.413 1.00 25.00 O ATOM 319 CB LEU A 24 26.675 30.756 -5.321 1.00 25.00 C ATOM 320 CG LEU A 24 25.630 30.138 -4.372 1.00 25.00 C ATOM 321 CD1 LEU A 24 24.235 30.731 -4.542 1.00 25.00 C ATOM 322 CD2 LEU A 24 25.566 28.642 -4.625 1.00 25.00 C ATOM 0 H LEU A 24 28.243 31.967 -6.829 1.00 25.00 H new ATOM 0 HA LEU A 24 25.686 32.599 -5.763 1.00 25.00 H new ATOM 0 HB2 LEU A 24 26.523 30.332 -6.314 1.00 25.00 H new ATOM 0 HB3 LEU A 24 27.664 30.441 -4.987 1.00 25.00 H new ATOM 0 HG LEU A 24 25.947 30.361 -3.353 1.00 25.00 H new ATOM 0 HD11 LEU A 24 23.548 30.252 -3.844 1.00 25.00 H new ATOM 0 HD12 LEU A 24 24.268 31.802 -4.341 1.00 25.00 H new ATOM 0 HD13 LEU A 24 23.890 30.564 -5.563 1.00 25.00 H new ATOM 0 HD21 LEU A 24 24.830 28.192 -3.959 1.00 25.00 H new ATOM 0 HD22 LEU A 24 25.278 28.460 -5.661 1.00 25.00 H new ATOM 0 HD23 LEU A 24 26.544 28.199 -4.437 1.00 25.00 H new ATOM 334 N ARG A 25 28.298 32.992 -3.805 1.00 25.00 N ATOM 335 CA ARG A 25 28.770 33.652 -2.587 1.00 25.00 C ATOM 336 C ARG A 25 28.331 35.110 -2.613 1.00 25.00 C ATOM 337 O ARG A 25 27.890 35.642 -1.611 1.00 25.00 O ATOM 338 CB ARG A 25 30.307 33.512 -2.527 1.00 25.00 C ATOM 339 CG ARG A 25 31.032 34.333 -1.451 1.00 25.00 C ATOM 340 CD ARG A 25 31.499 35.692 -1.976 1.00 25.00 C ATOM 341 NE ARG A 25 32.418 35.579 -3.125 1.00 25.00 N ATOM 342 CZ ARG A 25 33.716 35.838 -3.106 1.00 25.00 C ATOM 343 NH1 ARG A 25 34.351 36.204 -2.017 1.00 25.00 N ATOM 344 NH2 ARG A 25 34.392 35.728 -4.215 1.00 25.00 N ATOM 0 H ARG A 25 29.042 32.598 -4.381 1.00 25.00 H new ATOM 0 HA ARG A 25 28.346 33.194 -1.693 1.00 25.00 H new ATOM 0 HB2 ARG A 25 30.547 32.460 -2.372 1.00 25.00 H new ATOM 0 HB3 ARG A 25 30.713 33.792 -3.499 1.00 25.00 H new ATOM 0 HG2 ARG A 25 30.366 34.483 -0.601 1.00 25.00 H new ATOM 0 HG3 ARG A 25 31.892 33.771 -1.086 1.00 25.00 H new ATOM 0 HD2 ARG A 25 30.630 36.281 -2.269 1.00 25.00 H new ATOM 0 HD3 ARG A 25 31.996 36.235 -1.172 1.00 25.00 H new ATOM 0 HE ARG A 25 32.018 35.274 -4.012 1.00 25.00 H new ATOM 0 HH11 ARG A 25 33.843 36.299 -1.138 1.00 25.00 H new ATOM 0 HH12 ARG A 25 35.353 36.393 -2.050 1.00 25.00 H new ATOM 0 HH21 ARG A 25 33.920 35.447 -5.074 1.00 25.00 H new ATOM 0 HH22 ARG A 25 35.393 35.923 -4.223 1.00 25.00 H new ATOM 358 N ASP A 26 28.444 35.745 -3.773 1.00 25.00 N ATOM 359 CA ASP A 26 28.089 37.158 -3.900 1.00 25.00 C ATOM 360 C ASP A 26 26.584 37.368 -3.701 1.00 25.00 C ATOM 361 O ASP A 26 26.161 38.215 -2.919 1.00 25.00 O ATOM 362 CB ASP A 26 28.502 37.666 -5.284 1.00 25.00 C ATOM 363 CG ASP A 26 28.467 39.167 -5.381 1.00 25.00 C ATOM 364 OD1 ASP A 26 29.187 39.820 -4.597 1.00 25.00 O ATOM 365 OD2 ASP A 26 27.796 39.692 -6.283 1.00 25.00 O ATOM 0 H ASP A 26 28.776 35.311 -4.634 1.00 25.00 H new ATOM 0 HA ASP A 26 28.617 37.717 -3.127 1.00 25.00 H new ATOM 0 HB2 ASP A 26 29.508 37.314 -5.511 1.00 25.00 H new ATOM 0 HB3 ASP A 26 27.838 37.241 -6.037 1.00 25.00 H new ATOM 370 N MET A 27 25.782 36.533 -4.350 1.00 25.00 N ATOM 371 CA MET A 27 24.323 36.601 -4.230 1.00 25.00 C ATOM 372 C MET A 27 23.888 36.333 -2.800 1.00 25.00 C ATOM 373 O MET A 27 23.004 36.997 -2.286 1.00 25.00 O ATOM 374 CB MET A 27 23.669 35.581 -5.157 1.00 25.00 C ATOM 375 CG MET A 27 22.151 35.732 -5.261 1.00 25.00 C ATOM 376 SD MET A 27 21.411 34.561 -6.431 1.00 25.00 S ATOM 377 CE MET A 27 21.308 33.044 -5.442 1.00 25.00 C ATOM 0 H MET A 27 26.116 35.795 -4.970 1.00 25.00 H new ATOM 0 HA MET A 27 24.007 37.605 -4.514 1.00 25.00 H new ATOM 0 HB2 MET A 27 24.104 35.676 -6.152 1.00 25.00 H new ATOM 0 HB3 MET A 27 23.902 34.577 -4.801 1.00 25.00 H new ATOM 0 HG2 MET A 27 21.707 35.585 -4.276 1.00 25.00 H new ATOM 0 HG3 MET A 27 21.911 36.749 -5.571 1.00 25.00 H new ATOM 0 HE1 MET A 27 21.006 32.214 -6.080 1.00 25.00 H new ATOM 0 HE2 MET A 27 22.282 32.829 -5.004 1.00 25.00 H new ATOM 0 HE3 MET A 27 20.574 33.177 -4.647 1.00 25.00 H new ATOM 387 N LEU A 28 24.518 35.367 -2.160 1.00 25.00 N ATOM 388 CA LEU A 28 24.179 35.019 -0.788 1.00 25.00 C ATOM 389 C LEU A 28 24.494 36.153 0.165 1.00 25.00 C ATOM 390 O LEU A 28 23.709 36.464 1.042 1.00 25.00 O ATOM 391 CB LEU A 28 24.949 33.787 -0.353 1.00 25.00 C ATOM 392 CG LEU A 28 24.296 32.458 -0.726 1.00 25.00 C ATOM 393 CD1 LEU A 28 25.308 31.368 -0.579 1.00 25.00 C ATOM 394 CD2 LEU A 28 23.105 32.188 0.175 1.00 25.00 C ATOM 0 H LEU A 28 25.268 34.807 -2.566 1.00 25.00 H new ATOM 0 HA LEU A 28 23.108 34.821 -0.758 1.00 25.00 H new ATOM 0 HB2 LEU A 28 25.945 33.823 -0.795 1.00 25.00 H new ATOM 0 HB3 LEU A 28 25.079 33.821 0.729 1.00 25.00 H new ATOM 0 HG LEU A 28 23.944 32.499 -1.757 1.00 25.00 H new ATOM 0 HD11 LEU A 28 24.854 30.412 -0.842 1.00 25.00 H new ATOM 0 HD12 LEU A 28 26.152 31.564 -1.240 1.00 25.00 H new ATOM 0 HD13 LEU A 28 25.656 31.332 0.453 1.00 25.00 H new ATOM 0 HD21 LEU A 28 22.648 31.238 -0.101 1.00 25.00 H new ATOM 0 HD22 LEU A 28 23.436 32.144 1.212 1.00 25.00 H new ATOM 0 HD23 LEU A 28 22.374 32.989 0.062 1.00 25.00 H new ATOM 406 N LEU A 29 25.642 36.788 -0.022 1.00 25.00 N ATOM 407 CA LEU A 29 26.036 37.908 0.835 1.00 25.00 C ATOM 408 C LEU A 29 25.066 39.066 0.674 1.00 25.00 C ATOM 409 O LEU A 29 24.734 39.760 1.633 1.00 25.00 O ATOM 410 CB LEU A 29 27.449 38.391 0.485 1.00 25.00 C ATOM 411 CG LEU A 29 28.598 37.501 0.969 1.00 25.00 C ATOM 412 CD1 LEU A 29 29.891 37.950 0.296 1.00 25.00 C ATOM 413 CD2 LEU A 29 28.764 37.534 2.489 1.00 25.00 C ATOM 0 H LEU A 29 26.315 36.553 -0.752 1.00 25.00 H new ATOM 0 HA LEU A 29 26.021 37.557 1.867 1.00 25.00 H new ATOM 0 HB2 LEU A 29 27.521 38.488 -0.598 1.00 25.00 H new ATOM 0 HB3 LEU A 29 27.586 39.388 0.904 1.00 25.00 H new ATOM 0 HG LEU A 29 28.361 36.472 0.698 1.00 25.00 H new ATOM 0 HD11 LEU A 29 30.715 37.322 0.635 1.00 25.00 H new ATOM 0 HD12 LEU A 29 29.788 37.861 -0.786 1.00 25.00 H new ATOM 0 HD13 LEU A 29 30.096 38.988 0.557 1.00 25.00 H new ATOM 0 HD21 LEU A 29 29.592 36.886 2.779 1.00 25.00 H new ATOM 0 HD22 LEU A 29 28.972 38.555 2.810 1.00 25.00 H new ATOM 0 HD23 LEU A 29 27.847 37.185 2.963 1.00 25.00 H new ATOM 425 N ALA A 30 24.594 39.254 -0.547 1.00 25.00 N ATOM 426 CA ALA A 30 23.643 40.312 -0.854 1.00 25.00 C ATOM 427 C ALA A 30 22.214 39.961 -0.412 1.00 25.00 C ATOM 428 O ALA A 30 21.335 40.821 -0.425 1.00 25.00 O ATOM 429 CB ALA A 30 23.666 40.590 -2.368 1.00 25.00 C ATOM 0 H ALA A 30 24.856 38.682 -1.350 1.00 25.00 H new ATOM 0 HA ALA A 30 23.943 41.200 -0.298 1.00 25.00 H new ATOM 0 HB1 ALA A 30 22.955 41.382 -2.603 1.00 25.00 H new ATOM 0 HB2 ALA A 30 24.667 40.901 -2.666 1.00 25.00 H new ATOM 0 HB3 ALA A 30 23.392 39.684 -2.908 1.00 25.00 H new ATOM 435 N ASN A 31 21.960 38.702 -0.072 1.00 25.00 N ATOM 436 CA ASN A 31 20.604 38.259 0.235 1.00 25.00 C ATOM 437 C ASN A 31 20.441 37.845 1.700 1.00 25.00 C ATOM 438 O ASN A 31 20.772 36.715 2.081 1.00 25.00 O ATOM 439 CB ASN A 31 20.233 37.093 -0.679 1.00 25.00 C ATOM 440 CG ASN A 31 18.761 36.850 -0.718 1.00 25.00 C ATOM 441 OD1 ASN A 31 18.080 36.896 0.303 1.00 25.00 O ATOM 442 ND2 ASN A 31 18.252 36.605 -1.893 1.00 25.00 N ATOM 0 H ASN A 31 22.670 37.973 -0.002 1.00 25.00 H new ATOM 0 HA ASN A 31 19.935 39.102 0.064 1.00 25.00 H new ATOM 0 HB2 ASN A 31 20.592 37.296 -1.688 1.00 25.00 H new ATOM 0 HB3 ASN A 31 20.739 36.190 -0.336 1.00 25.00 H new ATOM 0 HD21 ASN A 31 17.250 36.442 -1.991 1.00 25.00 H new ATOM 0 HD22 ASN A 31 18.856 36.576 -2.715 1.00 25.00 H new ATOM 449 N PRO A 32 19.897 38.735 2.547 1.00 25.00 N ATOM 450 CA PRO A 32 19.806 38.387 3.968 1.00 25.00 C ATOM 451 C PRO A 32 18.886 37.208 4.303 1.00 25.00 C ATOM 452 O PRO A 32 19.091 36.530 5.307 1.00 25.00 O ATOM 453 CB PRO A 32 19.296 39.685 4.603 1.00 25.00 C ATOM 454 CG PRO A 32 18.558 40.361 3.512 1.00 25.00 C ATOM 455 CD PRO A 32 19.383 40.097 2.301 1.00 25.00 C ATOM 0 HA PRO A 32 20.769 38.038 4.340 1.00 25.00 H new ATOM 0 HB2 PRO A 32 18.648 39.483 5.456 1.00 25.00 H new ATOM 0 HB3 PRO A 32 20.119 40.300 4.967 1.00 25.00 H new ATOM 0 HG2 PRO A 32 17.550 39.960 3.404 1.00 25.00 H new ATOM 0 HG3 PRO A 32 18.457 41.430 3.701 1.00 25.00 H new ATOM 0 HD2 PRO A 32 18.789 40.147 1.388 1.00 25.00 H new ATOM 0 HD3 PRO A 32 20.191 40.821 2.196 1.00 25.00 H new ATOM 463 N HIS A 33 17.881 36.948 3.476 1.00 25.00 N ATOM 464 CA HIS A 33 16.987 35.825 3.737 1.00 25.00 C ATOM 465 C HIS A 33 17.646 34.503 3.355 1.00 25.00 C ATOM 466 O HIS A 33 17.533 33.501 4.048 1.00 25.00 O ATOM 467 CB HIS A 33 15.700 35.985 2.938 1.00 25.00 C ATOM 468 CG HIS A 33 14.679 34.930 3.231 1.00 25.00 C ATOM 469 ND1 HIS A 33 13.871 34.917 4.345 1.00 25.00 N ATOM 470 CD2 HIS A 33 14.346 33.807 2.542 1.00 25.00 C ATOM 471 CE1 HIS A 33 13.108 33.833 4.292 1.00 25.00 C ATOM 472 NE2 HIS A 33 13.352 33.123 3.209 1.00 25.00 N ATOM 0 H HIS A 33 17.666 37.486 2.636 1.00 25.00 H new ATOM 0 HA HIS A 33 16.764 35.816 4.804 1.00 25.00 H new ATOM 0 HB2 HIS A 33 15.270 36.964 3.149 1.00 25.00 H new ATOM 0 HB3 HIS A 33 15.937 35.964 1.874 1.00 25.00 H new ATOM 0 HD2 HIS A 33 14.794 33.496 1.610 1.00 25.00 H new ATOM 0 HE1 HIS A 33 12.378 33.566 5.042 1.00 25.00 H new ATOM 0 HE2 HIS A 33 12.902 32.253 2.925 1.00 25.00 H new ATOM 480 N GLU A 34 18.344 34.513 2.240 1.00 25.00 N ATOM 481 CA GLU A 34 18.974 33.305 1.728 1.00 25.00 C ATOM 482 C GLU A 34 20.161 32.945 2.610 1.00 25.00 C ATOM 483 O GLU A 34 20.434 31.784 2.877 1.00 25.00 O ATOM 484 CB GLU A 34 19.411 33.526 0.282 1.00 25.00 C ATOM 485 CG GLU A 34 18.480 32.927 -0.751 1.00 25.00 C ATOM 486 CD GLU A 34 18.885 31.505 -1.127 1.00 25.00 C ATOM 487 OE1 GLU A 34 19.328 31.297 -2.283 1.00 25.00 O ATOM 488 OE2 GLU A 34 18.773 30.599 -0.274 1.00 25.00 O ATOM 0 H GLU A 34 18.492 35.343 1.666 1.00 25.00 H new ATOM 0 HA GLU A 34 18.264 32.478 1.746 1.00 25.00 H new ATOM 0 HB2 GLU A 34 19.495 34.597 0.100 1.00 25.00 H new ATOM 0 HB3 GLU A 34 20.406 33.101 0.147 1.00 25.00 H new ATOM 0 HG2 GLU A 34 17.461 32.924 -0.363 1.00 25.00 H new ATOM 0 HG3 GLU A 34 18.479 33.552 -1.644 1.00 25.00 H new ATOM 495 N LEU A 35 20.836 33.953 3.134 1.00 25.00 N ATOM 496 CA LEU A 35 21.967 33.713 4.020 1.00 25.00 C ATOM 497 C LEU A 35 21.497 33.253 5.411 1.00 25.00 C ATOM 498 O LEU A 35 22.192 32.489 6.083 1.00 25.00 O ATOM 499 CB LEU A 35 22.852 34.956 4.053 1.00 25.00 C ATOM 500 CG LEU A 35 22.663 36.132 5.016 1.00 25.00 C ATOM 501 CD1 LEU A 35 23.000 35.829 6.478 1.00 25.00 C ATOM 502 CD2 LEU A 35 23.562 37.233 4.502 1.00 25.00 C ATOM 0 H LEU A 35 20.626 34.937 2.965 1.00 25.00 H new ATOM 0 HA LEU A 35 22.573 32.892 3.637 1.00 25.00 H new ATOM 0 HB2 LEU A 35 23.869 34.598 4.211 1.00 25.00 H new ATOM 0 HB3 LEU A 35 22.815 35.379 3.049 1.00 25.00 H new ATOM 0 HG LEU A 35 21.606 36.399 5.031 1.00 25.00 H new ATOM 0 HD11 LEU A 35 22.835 36.721 7.082 1.00 25.00 H new ATOM 0 HD12 LEU A 35 22.361 35.023 6.839 1.00 25.00 H new ATOM 0 HD13 LEU A 35 24.044 35.526 6.555 1.00 25.00 H new ATOM 0 HD21 LEU A 35 23.474 38.106 5.148 1.00 25.00 H new ATOM 0 HD22 LEU A 35 24.596 36.887 4.499 1.00 25.00 H new ATOM 0 HD23 LEU A 35 23.266 37.501 3.488 1.00 25.00 H new ATOM 514 N SER A 36 20.327 33.705 5.841 1.00 25.00 N ATOM 515 CA SER A 36 19.792 33.321 7.150 1.00 25.00 C ATOM 516 C SER A 36 19.240 31.898 7.141 1.00 25.00 C ATOM 517 O SER A 36 19.490 31.142 8.068 1.00 25.00 O ATOM 518 CB SER A 36 18.737 34.304 7.652 1.00 25.00 C ATOM 519 OG SER A 36 17.706 34.482 6.713 1.00 25.00 O ATOM 0 H SER A 36 19.728 34.336 5.308 1.00 25.00 H new ATOM 0 HA SER A 36 20.630 33.353 7.846 1.00 25.00 H new ATOM 0 HB2 SER A 36 18.317 33.940 8.590 1.00 25.00 H new ATOM 0 HB3 SER A 36 19.206 35.265 7.864 1.00 25.00 H new ATOM 0 HG SER A 36 17.885 33.932 5.922 1.00 25.00 H new ATOM 525 N LEU A 37 18.566 31.487 6.068 1.00 25.00 N ATOM 526 CA LEU A 37 18.104 30.102 5.985 1.00 25.00 C ATOM 527 C LEU A 37 19.288 29.203 5.881 1.00 25.00 C ATOM 528 O LEU A 37 19.274 28.078 6.340 1.00 25.00 O ATOM 529 CB LEU A 37 17.164 29.896 4.810 1.00 25.00 C ATOM 530 CG LEU A 37 17.610 29.938 3.344 1.00 25.00 C ATOM 531 CD1 LEU A 37 18.162 28.607 2.853 1.00 25.00 C ATOM 532 CD2 LEU A 37 16.430 30.346 2.480 1.00 25.00 C ATOM 0 H LEU A 37 18.333 32.073 5.266 1.00 25.00 H new ATOM 0 HA LEU A 37 17.540 29.863 6.887 1.00 25.00 H new ATOM 0 HB2 LEU A 37 16.697 28.922 4.959 1.00 25.00 H new ATOM 0 HB3 LEU A 37 16.379 30.645 4.912 1.00 25.00 H new ATOM 0 HG LEU A 37 18.419 30.664 3.270 1.00 25.00 H new ATOM 0 HD11 LEU A 37 18.461 28.700 1.809 1.00 25.00 H new ATOM 0 HD12 LEU A 37 19.027 28.328 3.454 1.00 25.00 H new ATOM 0 HD13 LEU A 37 17.394 27.839 2.944 1.00 25.00 H new ATOM 0 HD21 LEU A 37 16.738 30.379 1.435 1.00 25.00 H new ATOM 0 HD22 LEU A 37 15.625 29.621 2.598 1.00 25.00 H new ATOM 0 HD23 LEU A 37 16.079 31.332 2.786 1.00 25.00 H new ATOM 544 N LEU A 38 20.333 29.700 5.261 1.00 25.00 N ATOM 545 CA LEU A 38 21.524 28.921 5.081 1.00 25.00 C ATOM 546 C LEU A 38 22.220 28.614 6.397 1.00 25.00 C ATOM 547 O LEU A 38 22.612 27.485 6.626 1.00 25.00 O ATOM 548 CB LEU A 38 22.427 29.670 4.134 1.00 25.00 C ATOM 549 CG LEU A 38 23.690 28.919 3.704 1.00 25.00 C ATOM 550 CD1 LEU A 38 23.334 27.737 2.840 1.00 25.00 C ATOM 551 CD2 LEU A 38 24.643 29.841 2.969 1.00 25.00 C ATOM 0 H LEU A 38 20.377 30.643 4.874 1.00 25.00 H new ATOM 0 HA LEU A 38 21.262 27.950 4.660 1.00 25.00 H new ATOM 0 HB2 LEU A 38 21.856 29.929 3.242 1.00 25.00 H new ATOM 0 HB3 LEU A 38 22.724 30.607 4.605 1.00 25.00 H new ATOM 0 HG LEU A 38 24.190 28.556 4.602 1.00 25.00 H new ATOM 0 HD11 LEU A 38 24.244 27.215 2.544 1.00 25.00 H new ATOM 0 HD12 LEU A 38 22.692 27.057 3.400 1.00 25.00 H new ATOM 0 HD13 LEU A 38 22.808 28.082 1.950 1.00 25.00 H new ATOM 0 HD21 LEU A 38 25.533 29.285 2.674 1.00 25.00 H new ATOM 0 HD22 LEU A 38 24.152 30.238 2.081 1.00 25.00 H new ATOM 0 HD23 LEU A 38 24.930 30.664 3.623 1.00 25.00 H new ATOM 563 N LYS A 39 22.332 29.586 7.287 1.00 25.00 N ATOM 564 CA LYS A 39 22.925 29.317 8.609 1.00 25.00 C ATOM 565 C LYS A 39 22.024 28.429 9.460 1.00 25.00 C ATOM 566 O LYS A 39 22.522 27.679 10.286 1.00 25.00 O ATOM 567 CB LYS A 39 23.319 30.600 9.363 1.00 25.00 C ATOM 568 CG LYS A 39 22.245 31.677 9.412 1.00 25.00 C ATOM 569 CD LYS A 39 22.506 32.747 10.449 1.00 25.00 C ATOM 570 CE LYS A 39 23.594 33.709 9.995 1.00 25.00 C ATOM 571 NZ LYS A 39 23.751 34.841 10.973 1.00 25.00 N ATOM 0 H LYS A 39 22.032 30.549 7.136 1.00 25.00 H new ATOM 0 HA LYS A 39 23.850 28.773 8.420 1.00 25.00 H new ATOM 0 HB2 LYS A 39 23.591 30.333 10.384 1.00 25.00 H new ATOM 0 HB3 LYS A 39 24.210 31.019 8.895 1.00 25.00 H new ATOM 0 HG2 LYS A 39 22.167 32.145 8.431 1.00 25.00 H new ATOM 0 HG3 LYS A 39 21.283 31.209 9.619 1.00 25.00 H new ATOM 0 HD2 LYS A 39 21.587 33.300 10.642 1.00 25.00 H new ATOM 0 HD3 LYS A 39 22.800 32.280 11.389 1.00 25.00 H new ATOM 0 HE2 LYS A 39 24.539 33.175 9.896 1.00 25.00 H new ATOM 0 HE3 LYS A 39 23.347 34.105 9.010 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 24.498 35.484 10.642 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 22.854 35.362 11.048 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 24.009 34.461 11.906 1.00 25.00 H new ATOM 585 N GLU A 40 20.722 28.464 9.219 1.00 25.00 N ATOM 586 CA GLU A 40 19.806 27.568 9.931 1.00 25.00 C ATOM 587 C GLU A 40 19.886 26.147 9.397 1.00 25.00 C ATOM 588 O GLU A 40 20.004 25.188 10.156 1.00 25.00 O ATOM 589 CB GLU A 40 18.363 28.027 9.735 1.00 25.00 C ATOM 590 CG GLU A 40 17.916 29.127 10.668 1.00 25.00 C ATOM 591 CD GLU A 40 16.444 29.431 10.488 1.00 25.00 C ATOM 592 OE1 GLU A 40 16.092 30.608 10.267 1.00 25.00 O ATOM 593 OE2 GLU A 40 15.631 28.478 10.521 1.00 25.00 O ATOM 0 H GLU A 40 20.276 29.090 8.549 1.00 25.00 H new ATOM 0 HA GLU A 40 20.097 27.593 10.981 1.00 25.00 H new ATOM 0 HB2 GLU A 40 18.242 28.370 8.707 1.00 25.00 H new ATOM 0 HB3 GLU A 40 17.703 27.169 9.865 1.00 25.00 H new ATOM 0 HG2 GLU A 40 18.106 28.832 11.700 1.00 25.00 H new ATOM 0 HG3 GLU A 40 18.502 30.027 10.481 1.00 25.00 H new ATOM 600 N ARG A 41 19.730 26.007 8.089 1.00 25.00 N ATOM 601 CA ARG A 41 19.578 24.691 7.476 1.00 25.00 C ATOM 602 C ARG A 41 20.865 24.013 7.040 1.00 25.00 C ATOM 603 O ARG A 41 20.915 22.791 6.919 1.00 25.00 O ATOM 604 CB ARG A 41 18.638 24.804 6.286 1.00 25.00 C ATOM 605 CG ARG A 41 17.285 25.433 6.667 1.00 25.00 C ATOM 606 CD ARG A 41 16.168 25.032 5.715 1.00 25.00 C ATOM 607 NE ARG A 41 15.712 23.657 5.987 1.00 25.00 N ATOM 608 CZ ARG A 41 14.874 23.307 6.963 1.00 25.00 C ATOM 609 NH1 ARG A 41 14.352 24.173 7.792 1.00 25.00 N ATOM 610 NH2 ARG A 41 14.564 22.047 7.110 1.00 25.00 N ATOM 0 H ARG A 41 19.705 26.786 7.431 1.00 25.00 H new ATOM 0 HA ARG A 41 19.175 24.051 8.261 1.00 25.00 H new ATOM 0 HB2 ARG A 41 19.110 25.406 5.509 1.00 25.00 H new ATOM 0 HB3 ARG A 41 18.469 23.813 5.864 1.00 25.00 H new ATOM 0 HG2 ARG A 41 17.020 25.131 7.680 1.00 25.00 H new ATOM 0 HG3 ARG A 41 17.381 26.519 6.672 1.00 25.00 H new ATOM 0 HD2 ARG A 41 15.332 25.724 5.818 1.00 25.00 H new ATOM 0 HD3 ARG A 41 16.518 25.106 4.685 1.00 25.00 H new ATOM 0 HE ARG A 41 16.065 22.916 5.382 1.00 25.00 H new ATOM 0 HH11 ARG A 41 14.582 25.163 7.707 1.00 25.00 H new ATOM 0 HH12 ARG A 41 13.715 23.858 8.524 1.00 25.00 H new ATOM 0 HH21 ARG A 41 14.962 21.347 6.483 1.00 25.00 H new ATOM 0 HH22 ARG A 41 13.924 21.762 7.852 1.00 25.00 H new ATOM 624 N ASN A 42 21.895 24.799 6.777 1.00 25.00 N ATOM 625 CA ASN A 42 23.193 24.267 6.353 1.00 25.00 C ATOM 626 C ASN A 42 24.375 24.988 7.013 1.00 25.00 C ATOM 627 O ASN A 42 25.159 25.670 6.335 1.00 25.00 O ATOM 628 CB ASN A 42 23.340 24.391 4.837 1.00 25.00 C ATOM 629 CG ASN A 42 24.392 23.469 4.287 1.00 25.00 C ATOM 630 OD1 ASN A 42 25.044 22.743 5.017 1.00 25.00 O ATOM 631 ND2 ASN A 42 24.553 23.482 3.003 1.00 25.00 N ATOM 0 H ASN A 42 21.863 25.816 6.848 1.00 25.00 H new ATOM 0 HA ASN A 42 23.215 23.223 6.664 1.00 25.00 H new ATOM 0 HB2 ASN A 42 22.384 24.171 4.363 1.00 25.00 H new ATOM 0 HB3 ASN A 42 23.593 25.420 4.582 1.00 25.00 H new ATOM 0 HD21 ASN A 42 25.245 22.870 2.570 1.00 25.00 H new ATOM 0 HD22 ASN A 42 23.988 24.104 2.424 1.00 25.00 H new ATOM 638 N PRO A 43 24.543 24.838 8.340 1.00 25.00 N ATOM 639 CA PRO A 43 25.653 25.583 8.952 1.00 25.00 C ATOM 640 C PRO A 43 27.080 25.364 8.396 1.00 25.00 C ATOM 641 O PRO A 43 27.841 26.332 8.352 1.00 25.00 O ATOM 642 CB PRO A 43 25.552 25.213 10.437 1.00 25.00 C ATOM 643 CG PRO A 43 24.761 23.947 10.478 1.00 25.00 C ATOM 644 CD PRO A 43 23.786 24.063 9.344 1.00 25.00 C ATOM 0 HA PRO A 43 25.532 26.642 8.723 1.00 25.00 H new ATOM 0 HB2 PRO A 43 26.540 25.073 10.875 1.00 25.00 H new ATOM 0 HB3 PRO A 43 25.060 26.002 11.006 1.00 25.00 H new ATOM 0 HG2 PRO A 43 25.404 23.075 10.358 1.00 25.00 H new ATOM 0 HG3 PRO A 43 24.246 23.834 11.432 1.00 25.00 H new ATOM 0 HD2 PRO A 43 23.491 23.085 8.962 1.00 25.00 H new ATOM 0 HD3 PRO A 43 22.873 24.576 9.646 1.00 25.00 H new ATOM 652 N PRO A 44 27.453 24.142 7.921 1.00 25.00 N ATOM 653 CA PRO A 44 28.827 24.150 7.394 1.00 25.00 C ATOM 654 C PRO A 44 29.030 24.967 6.108 1.00 25.00 C ATOM 655 O PRO A 44 30.117 25.494 5.878 1.00 25.00 O ATOM 656 CB PRO A 44 29.112 22.667 7.144 1.00 25.00 C ATOM 657 CG PRO A 44 27.802 22.093 6.840 1.00 25.00 C ATOM 658 CD PRO A 44 26.869 22.788 7.804 1.00 25.00 C ATOM 0 HA PRO A 44 29.502 24.636 8.098 1.00 25.00 H new ATOM 0 HB2 PRO A 44 29.808 22.530 6.316 1.00 25.00 H new ATOM 0 HB3 PRO A 44 29.560 22.195 8.019 1.00 25.00 H new ATOM 0 HG2 PRO A 44 27.516 22.277 5.804 1.00 25.00 H new ATOM 0 HG3 PRO A 44 27.795 21.013 6.986 1.00 25.00 H new ATOM 0 HD2 PRO A 44 25.848 22.821 7.423 1.00 25.00 H new ATOM 0 HD3 PRO A 44 26.834 22.280 8.768 1.00 25.00 H new ATOM 666 N LEU A 45 28.014 25.093 5.257 1.00 25.00 N ATOM 667 CA LEU A 45 28.160 25.941 4.073 1.00 25.00 C ATOM 668 C LEU A 45 28.037 27.394 4.501 1.00 25.00 C ATOM 669 O LEU A 45 28.718 28.276 3.983 1.00 25.00 O ATOM 670 CB LEU A 45 27.133 25.609 2.995 1.00 25.00 C ATOM 671 CG LEU A 45 27.301 26.379 1.659 1.00 25.00 C ATOM 672 CD1 LEU A 45 28.713 26.260 1.053 1.00 25.00 C ATOM 673 CD2 LEU A 45 26.279 25.856 0.654 1.00 25.00 C ATOM 0 H LEU A 45 27.108 24.636 5.357 1.00 25.00 H new ATOM 0 HA LEU A 45 29.140 25.758 3.632 1.00 25.00 H new ATOM 0 HB2 LEU A 45 27.181 24.540 2.788 1.00 25.00 H new ATOM 0 HB3 LEU A 45 26.138 25.813 3.390 1.00 25.00 H new ATOM 0 HG LEU A 45 27.142 27.435 1.879 1.00 25.00 H new ATOM 0 HD11 LEU A 45 28.757 26.823 0.121 1.00 25.00 H new ATOM 0 HD12 LEU A 45 29.445 26.661 1.754 1.00 25.00 H new ATOM 0 HD13 LEU A 45 28.937 25.212 0.855 1.00 25.00 H new ATOM 0 HD21 LEU A 45 26.389 26.391 -0.289 1.00 25.00 H new ATOM 0 HD22 LEU A 45 26.444 24.791 0.488 1.00 25.00 H new ATOM 0 HD23 LEU A 45 25.273 26.011 1.044 1.00 25.00 H new ATOM 685 N ALA A 46 27.172 27.644 5.472 1.00 25.00 N ATOM 686 CA ALA A 46 27.010 28.997 5.972 1.00 25.00 C ATOM 687 C ALA A 46 28.303 29.553 6.563 1.00 25.00 C ATOM 688 O ALA A 46 28.697 30.640 6.204 1.00 25.00 O ATOM 689 CB ALA A 46 25.926 29.047 6.995 1.00 25.00 C ATOM 0 H ALA A 46 26.583 26.943 5.921 1.00 25.00 H new ATOM 0 HA ALA A 46 26.739 29.621 5.121 1.00 25.00 H new ATOM 0 HB1 ALA A 46 25.817 30.068 7.360 1.00 25.00 H new ATOM 0 HB2 ALA A 46 24.988 28.720 6.547 1.00 25.00 H new ATOM 0 HB3 ALA A 46 26.180 28.390 7.827 1.00 25.00 H new ATOM 695 N GLU A 47 28.963 28.823 7.455 1.00 25.00 N ATOM 696 CA GLU A 47 30.181 29.339 8.100 1.00 25.00 C ATOM 697 C GLU A 47 31.249 29.682 7.067 1.00 25.00 C ATOM 698 O GLU A 47 32.039 30.607 7.255 1.00 25.00 O ATOM 699 CB GLU A 47 30.730 28.342 9.142 1.00 25.00 C ATOM 700 CG GLU A 47 31.287 27.058 8.537 1.00 25.00 C ATOM 701 CD GLU A 47 31.890 26.128 9.566 1.00 25.00 C ATOM 702 OE1 GLU A 47 31.129 25.526 10.359 1.00 25.00 O ATOM 703 OE2 GLU A 47 33.139 25.985 9.569 1.00 25.00 O ATOM 0 H GLU A 47 28.687 27.886 7.750 1.00 25.00 H new ATOM 0 HA GLU A 47 29.910 30.256 8.623 1.00 25.00 H new ATOM 0 HB2 GLU A 47 31.515 28.830 9.719 1.00 25.00 H new ATOM 0 HB3 GLU A 47 29.933 28.087 9.841 1.00 25.00 H new ATOM 0 HG2 GLU A 47 30.489 26.537 8.009 1.00 25.00 H new ATOM 0 HG3 GLU A 47 32.046 27.312 7.797 1.00 25.00 H new ATOM 710 N ALA A 48 31.247 28.953 5.964 1.00 25.00 N ATOM 711 CA ALA A 48 32.159 29.179 4.877 1.00 25.00 C ATOM 712 C ALA A 48 31.897 30.541 4.226 1.00 25.00 C ATOM 713 O ALA A 48 32.827 31.281 3.902 1.00 25.00 O ATOM 714 CB ALA A 48 31.996 28.046 3.863 1.00 25.00 C ATOM 0 H ALA A 48 30.601 28.180 5.805 1.00 25.00 H new ATOM 0 HA ALA A 48 33.183 29.189 5.249 1.00 25.00 H new ATOM 0 HB1 ALA A 48 32.682 28.202 3.030 1.00 25.00 H new ATOM 0 HB2 ALA A 48 32.219 27.093 4.343 1.00 25.00 H new ATOM 0 HB3 ALA A 48 30.971 28.034 3.492 1.00 25.00 H new ATOM 720 N LEU A 49 30.627 30.881 4.093 1.00 25.00 N ATOM 721 CA LEU A 49 30.208 32.164 3.535 1.00 25.00 C ATOM 722 C LEU A 49 30.537 33.292 4.506 1.00 25.00 C ATOM 723 O LEU A 49 31.068 34.322 4.115 1.00 25.00 O ATOM 724 CB LEU A 49 28.688 32.146 3.304 1.00 25.00 C ATOM 725 CG LEU A 49 28.097 33.419 2.691 1.00 25.00 C ATOM 726 CD1 LEU A 49 28.300 33.419 1.193 1.00 25.00 C ATOM 727 CD2 LEU A 49 26.613 33.514 3.029 1.00 25.00 C ATOM 0 H LEU A 49 29.852 30.277 4.368 1.00 25.00 H new ATOM 0 HA LEU A 49 30.734 32.327 2.594 1.00 25.00 H new ATOM 0 HB2 LEU A 49 28.447 31.305 2.653 1.00 25.00 H new ATOM 0 HB3 LEU A 49 28.196 31.961 4.259 1.00 25.00 H new ATOM 0 HG LEU A 49 28.608 34.287 3.108 1.00 25.00 H new ATOM 0 HD11 LEU A 49 27.876 34.329 0.768 1.00 25.00 H new ATOM 0 HD12 LEU A 49 29.366 33.377 0.970 1.00 25.00 H new ATOM 0 HD13 LEU A 49 27.805 32.551 0.759 1.00 25.00 H new ATOM 0 HD21 LEU A 49 26.197 34.421 2.591 1.00 25.00 H new ATOM 0 HD22 LEU A 49 26.092 32.645 2.627 1.00 25.00 H new ATOM 0 HD23 LEU A 49 26.488 33.544 4.111 1.00 25.00 H new ATOM 739 N LEU A 50 30.212 33.080 5.779 1.00 25.00 N ATOM 740 CA LEU A 50 30.371 34.124 6.799 1.00 25.00 C ATOM 741 C LEU A 50 31.841 34.479 6.965 1.00 25.00 C ATOM 742 O LEU A 50 32.200 35.592 7.305 1.00 25.00 O ATOM 743 CB LEU A 50 29.836 33.664 8.162 1.00 25.00 C ATOM 744 CG LEU A 50 28.412 33.082 8.264 1.00 25.00 C ATOM 745 CD1 LEU A 50 27.998 32.997 9.716 1.00 25.00 C ATOM 746 CD2 LEU A 50 27.378 33.829 7.447 1.00 25.00 C ATOM 0 H LEU A 50 29.838 32.199 6.132 1.00 25.00 H new ATOM 0 HA LEU A 50 29.803 34.991 6.462 1.00 25.00 H new ATOM 0 HB2 LEU A 50 30.524 32.911 8.545 1.00 25.00 H new ATOM 0 HB3 LEU A 50 29.889 34.517 8.838 1.00 25.00 H new ATOM 0 HG LEU A 50 28.452 32.083 7.829 1.00 25.00 H new ATOM 0 HD11 LEU A 50 26.991 32.585 9.784 1.00 25.00 H new ATOM 0 HD12 LEU A 50 28.691 32.351 10.255 1.00 25.00 H new ATOM 0 HD13 LEU A 50 28.013 33.993 10.158 1.00 25.00 H new ATOM 0 HD21 LEU A 50 26.404 33.357 7.573 1.00 25.00 H new ATOM 0 HD22 LEU A 50 27.326 34.864 7.785 1.00 25.00 H new ATOM 0 HD23 LEU A 50 27.659 33.805 6.394 1.00 25.00 H new ATOM 758 N SER A 51 32.686 33.488 6.731 1.00 25.00 N ATOM 759 CA SER A 51 34.129 33.638 6.866 1.00 25.00 C ATOM 760 C SER A 51 34.736 34.457 5.729 1.00 25.00 C ATOM 761 O SER A 51 35.865 34.924 5.846 1.00 25.00 O ATOM 762 CB SER A 51 34.745 32.261 6.852 1.00 25.00 C ATOM 763 OG SER A 51 36.129 32.287 7.174 1.00 25.00 O ATOM 0 H SER A 51 32.392 32.555 6.442 1.00 25.00 H new ATOM 0 HA SER A 51 34.332 34.166 7.798 1.00 25.00 H new ATOM 0 HB2 SER A 51 34.220 31.623 7.564 1.00 25.00 H new ATOM 0 HB3 SER A 51 34.612 31.816 5.866 1.00 25.00 H new ATOM 0 HG SER A 51 36.490 33.180 6.995 1.00 25.00 H new ATOM 769 N GLY A 52 34.021 34.585 4.622 1.00 25.00 N ATOM 770 CA GLY A 52 34.482 35.394 3.501 1.00 25.00 C ATOM 771 C GLY A 52 35.404 34.658 2.547 1.00 25.00 C ATOM 772 O GLY A 52 35.571 35.068 1.394 1.00 25.00 O ATOM 0 H GLY A 52 33.116 34.138 4.474 1.00 25.00 H new ATOM 0 HA2 GLY A 52 33.616 35.755 2.947 1.00 25.00 H new ATOM 0 HA3 GLY A 52 35.001 36.271 3.888 1.00 25.00 H new ATOM 776 N ASP A 53 36.014 33.580 3.018 1.00 25.00 N ATOM 777 CA ASP A 53 36.957 32.832 2.198 1.00 25.00 C ATOM 778 C ASP A 53 36.254 32.080 1.075 1.00 25.00 C ATOM 779 O ASP A 53 35.522 31.118 1.313 1.00 25.00 O ATOM 780 CB ASP A 53 37.763 31.839 3.033 1.00 25.00 C ATOM 781 CG ASP A 53 39.092 31.523 2.400 1.00 25.00 C ATOM 782 OD1 ASP A 53 39.974 30.989 3.097 1.00 25.00 O ATOM 783 OD2 ASP A 53 39.237 31.776 1.181 1.00 25.00 O ATOM 0 H ASP A 53 35.875 33.205 3.956 1.00 25.00 H new ATOM 0 HA ASP A 53 37.635 33.567 1.764 1.00 25.00 H new ATOM 0 HB2 ASP A 53 37.924 32.249 4.030 1.00 25.00 H new ATOM 0 HB3 ASP A 53 37.191 30.919 3.155 1.00 25.00 H new ATOM 788 N LEU A 54 36.489 32.495 -0.157 1.00 25.00 N ATOM 789 CA LEU A 54 35.905 31.801 -1.298 1.00 25.00 C ATOM 790 C LEU A 54 36.437 30.376 -1.342 1.00 25.00 C ATOM 791 O LEU A 54 35.724 29.458 -1.703 1.00 25.00 O ATOM 792 CB LEU A 54 36.247 32.521 -2.602 1.00 25.00 C ATOM 793 CG LEU A 54 35.570 32.032 -3.901 1.00 25.00 C ATOM 794 CD1 LEU A 54 36.360 30.922 -4.605 1.00 25.00 C ATOM 795 CD2 LEU A 54 34.103 31.592 -3.712 1.00 25.00 C ATOM 0 H LEU A 54 37.072 33.298 -0.395 1.00 25.00 H new ATOM 0 HA LEU A 54 34.821 31.789 -1.187 1.00 25.00 H new ATOM 0 HB2 LEU A 54 36.002 33.576 -2.475 1.00 25.00 H new ATOM 0 HB3 LEU A 54 37.326 32.459 -2.744 1.00 25.00 H new ATOM 0 HG LEU A 54 35.566 32.913 -4.543 1.00 25.00 H new ATOM 0 HD11 LEU A 54 35.835 30.620 -5.511 1.00 25.00 H new ATOM 0 HD12 LEU A 54 37.352 31.291 -4.867 1.00 25.00 H new ATOM 0 HD13 LEU A 54 36.456 30.065 -3.938 1.00 25.00 H new ATOM 0 HD21 LEU A 54 33.696 31.262 -4.668 1.00 25.00 H new ATOM 0 HD22 LEU A 54 34.059 30.771 -2.996 1.00 25.00 H new ATOM 0 HD23 LEU A 54 33.517 32.431 -3.338 1.00 25.00 H new ATOM 807 N GLU A 55 37.688 30.194 -0.943 1.00 25.00 N ATOM 808 CA GLU A 55 38.307 28.863 -0.964 1.00 25.00 C ATOM 809 C GLU A 55 37.474 27.883 -0.147 1.00 25.00 C ATOM 810 O GLU A 55 37.086 26.806 -0.624 1.00 25.00 O ATOM 811 CB GLU A 55 39.720 28.899 -0.367 1.00 25.00 C ATOM 812 CG GLU A 55 40.710 29.767 -1.118 1.00 25.00 C ATOM 813 CD GLU A 55 41.263 29.078 -2.352 1.00 25.00 C ATOM 814 OE1 GLU A 55 42.312 28.407 -2.242 1.00 25.00 O ATOM 815 OE2 GLU A 55 40.626 29.171 -3.426 1.00 25.00 O ATOM 0 H GLU A 55 38.295 30.940 -0.603 1.00 25.00 H new ATOM 0 HA GLU A 55 38.360 28.545 -2.005 1.00 25.00 H new ATOM 0 HB2 GLU A 55 39.655 29.254 0.661 1.00 25.00 H new ATOM 0 HB3 GLU A 55 40.108 27.881 -0.328 1.00 25.00 H new ATOM 0 HG2 GLU A 55 40.224 30.697 -1.412 1.00 25.00 H new ATOM 0 HG3 GLU A 55 41.533 30.033 -0.454 1.00 25.00 H new ATOM 822 N LYS A 56 37.172 28.260 1.092 1.00 25.00 N ATOM 823 CA LYS A 56 36.374 27.379 1.947 1.00 25.00 C ATOM 824 C LYS A 56 34.938 27.305 1.450 1.00 25.00 C ATOM 825 O LYS A 56 34.335 26.245 1.507 1.00 25.00 O ATOM 826 CB LYS A 56 36.479 27.765 3.438 1.00 25.00 C ATOM 827 CG LYS A 56 35.654 28.877 3.914 1.00 25.00 C ATOM 828 CD LYS A 56 36.178 29.368 5.261 1.00 25.00 C ATOM 829 CE LYS A 56 35.656 28.537 6.441 1.00 25.00 C ATOM 830 NZ LYS A 56 36.075 29.139 7.760 1.00 25.00 N ATOM 0 H LYS A 56 37.456 29.142 1.519 1.00 25.00 H new ATOM 0 HA LYS A 56 36.788 26.373 1.878 1.00 25.00 H new ATOM 0 HB2 LYS A 56 36.229 26.885 4.030 1.00 25.00 H new ATOM 0 HB3 LYS A 56 37.521 28.006 3.649 1.00 25.00 H new ATOM 0 HG2 LYS A 56 35.670 29.690 3.189 1.00 25.00 H new ATOM 0 HG3 LYS A 56 34.617 28.557 4.011 1.00 25.00 H new ATOM 0 HD2 LYS A 56 37.268 29.337 5.255 1.00 25.00 H new ATOM 0 HD3 LYS A 56 35.889 30.410 5.400 1.00 25.00 H new ATOM 0 HE2 LYS A 56 34.569 28.477 6.394 1.00 25.00 H new ATOM 0 HE3 LYS A 56 36.034 27.518 6.367 1.00 25.00 H new ATOM 0 HZ1 LYS A 56 35.344 28.951 8.475 1.00 25.00 H new ATOM 0 HZ2 LYS A 56 36.975 28.716 8.065 1.00 25.00 H new ATOM 0 HZ3 LYS A 56 36.195 30.166 7.650 1.00 25.00 H new ATOM 844 N PHE A 57 34.404 28.394 0.916 1.00 25.00 N ATOM 845 CA PHE A 57 33.040 28.375 0.386 1.00 25.00 C ATOM 846 C PHE A 57 32.911 27.389 -0.766 1.00 25.00 C ATOM 847 O PHE A 57 32.044 26.522 -0.747 1.00 25.00 O ATOM 848 CB PHE A 57 32.589 29.772 -0.043 1.00 25.00 C ATOM 849 CG PHE A 57 31.169 29.812 -0.547 1.00 25.00 C ATOM 850 CD1 PHE A 57 30.903 29.762 -1.927 1.00 25.00 C ATOM 851 CD2 PHE A 57 30.097 29.879 0.359 1.00 25.00 C ATOM 852 CE1 PHE A 57 29.571 29.782 -2.411 1.00 25.00 C ATOM 853 CE2 PHE A 57 28.758 29.900 -0.114 1.00 25.00 C ATOM 854 CZ PHE A 57 28.504 29.845 -1.509 1.00 25.00 C ATOM 0 H PHE A 57 34.882 29.291 0.837 1.00 25.00 H new ATOM 0 HA PHE A 57 32.383 28.044 1.190 1.00 25.00 H new ATOM 0 HB2 PHE A 57 32.686 30.453 0.802 1.00 25.00 H new ATOM 0 HB3 PHE A 57 33.255 30.137 -0.825 1.00 25.00 H new ATOM 0 HD1 PHE A 57 31.724 29.708 -2.627 1.00 25.00 H new ATOM 0 HD2 PHE A 57 30.292 29.915 1.421 1.00 25.00 H new ATOM 0 HE1 PHE A 57 29.380 29.749 -3.474 1.00 25.00 H new ATOM 0 HE2 PHE A 57 27.937 29.958 0.585 1.00 25.00 H new ATOM 0 HZ PHE A 57 27.488 29.852 -1.874 1.00 25.00 H new ATOM 864 N SER A 58 33.802 27.477 -1.744 1.00 25.00 N ATOM 865 CA SER A 58 33.816 26.570 -2.881 1.00 25.00 C ATOM 866 C SER A 58 34.048 25.125 -2.444 1.00 25.00 C ATOM 867 O SER A 58 33.373 24.218 -2.915 1.00 25.00 O ATOM 868 CB SER A 58 34.929 26.994 -3.844 1.00 25.00 C ATOM 869 OG SER A 58 34.927 26.194 -5.015 1.00 25.00 O ATOM 0 H SER A 58 34.538 28.183 -1.770 1.00 25.00 H new ATOM 0 HA SER A 58 32.844 26.621 -3.372 1.00 25.00 H new ATOM 0 HB2 SER A 58 34.799 28.041 -4.116 1.00 25.00 H new ATOM 0 HB3 SER A 58 35.895 26.912 -3.346 1.00 25.00 H new ATOM 0 HG SER A 58 35.646 26.487 -5.613 1.00 25.00 H new ATOM 875 N ARG A 59 34.970 24.898 -1.515 1.00 25.00 N ATOM 876 CA ARG A 59 35.256 23.534 -1.053 1.00 25.00 C ATOM 877 C ARG A 59 34.008 22.919 -0.440 1.00 25.00 C ATOM 878 O ARG A 59 33.636 21.801 -0.776 1.00 25.00 O ATOM 879 CB ARG A 59 36.399 23.534 -0.031 1.00 25.00 C ATOM 880 CG ARG A 59 36.636 22.163 0.650 1.00 25.00 C ATOM 881 CD ARG A 59 36.145 22.179 2.096 1.00 25.00 C ATOM 882 NE ARG A 59 35.967 20.824 2.657 1.00 25.00 N ATOM 883 CZ ARG A 59 35.833 20.543 3.949 1.00 25.00 C ATOM 884 NH1 ARG A 59 35.883 21.473 4.876 1.00 25.00 N ATOM 885 NH2 ARG A 59 35.641 19.312 4.317 1.00 25.00 N ATOM 0 H ARG A 59 35.528 25.626 -1.069 1.00 25.00 H new ATOM 0 HA ARG A 59 35.563 22.937 -1.912 1.00 25.00 H new ATOM 0 HB2 ARG A 59 37.318 23.844 -0.529 1.00 25.00 H new ATOM 0 HB3 ARG A 59 36.186 24.278 0.737 1.00 25.00 H new ATOM 0 HG2 ARG A 59 36.117 21.382 0.094 1.00 25.00 H new ATOM 0 HG3 ARG A 59 37.698 21.919 0.625 1.00 25.00 H new ATOM 0 HD2 ARG A 59 36.857 22.731 2.710 1.00 25.00 H new ATOM 0 HD3 ARG A 59 35.197 22.715 2.147 1.00 25.00 H new ATOM 0 HE ARG A 59 35.945 20.043 2.001 1.00 25.00 H new ATOM 0 HH11 ARG A 59 36.029 22.448 4.613 1.00 25.00 H new ATOM 0 HH12 ARG A 59 35.776 21.220 5.858 1.00 25.00 H new ATOM 0 HH21 ARG A 59 35.594 18.572 3.617 1.00 25.00 H new ATOM 0 HH22 ARG A 59 35.537 19.086 5.306 1.00 25.00 H new ATOM 899 N VAL A 60 33.362 23.645 0.451 1.00 25.00 N ATOM 900 CA VAL A 60 32.187 23.111 1.118 1.00 25.00 C ATOM 901 C VAL A 60 31.062 22.971 0.102 1.00 25.00 C ATOM 902 O VAL A 60 30.278 22.046 0.190 1.00 25.00 O ATOM 903 CB VAL A 60 31.759 23.977 2.335 1.00 25.00 C ATOM 904 CG1 VAL A 60 30.526 23.377 3.008 1.00 25.00 C ATOM 905 CG2 VAL A 60 32.897 24.052 3.375 1.00 25.00 C ATOM 0 H VAL A 60 33.624 24.591 0.728 1.00 25.00 H new ATOM 0 HA VAL A 60 32.430 22.128 1.523 1.00 25.00 H new ATOM 0 HB VAL A 60 31.531 24.978 1.968 1.00 25.00 H new ATOM 0 HG11 VAL A 60 30.239 23.995 3.859 1.00 25.00 H new ATOM 0 HG12 VAL A 60 29.704 23.339 2.293 1.00 25.00 H new ATOM 0 HG13 VAL A 60 30.754 22.369 3.353 1.00 25.00 H new ATOM 0 HG21 VAL A 60 32.578 24.663 4.220 1.00 25.00 H new ATOM 0 HG22 VAL A 60 33.138 23.048 3.724 1.00 25.00 H new ATOM 0 HG23 VAL A 60 33.780 24.499 2.917 1.00 25.00 H new ATOM 915 N LEU A 61 31.011 23.847 -0.888 1.00 25.00 N ATOM 916 CA LEU A 61 29.983 23.748 -1.919 1.00 25.00 C ATOM 917 C LEU A 61 30.039 22.396 -2.627 1.00 25.00 C ATOM 918 O LEU A 61 29.006 21.765 -2.821 1.00 25.00 O ATOM 919 CB LEU A 61 30.146 24.870 -2.951 1.00 25.00 C ATOM 920 CG LEU A 61 28.862 25.188 -3.708 1.00 25.00 C ATOM 921 CD1 LEU A 61 28.133 26.307 -2.988 1.00 25.00 C ATOM 922 CD2 LEU A 61 29.143 25.620 -5.121 1.00 25.00 C ATOM 0 H LEU A 61 31.659 24.626 -1.002 1.00 25.00 H new ATOM 0 HA LEU A 61 29.015 23.846 -1.428 1.00 25.00 H new ATOM 0 HB2 LEU A 61 30.493 25.771 -2.445 1.00 25.00 H new ATOM 0 HB3 LEU A 61 30.919 24.587 -3.665 1.00 25.00 H new ATOM 0 HG LEU A 61 28.254 24.284 -3.743 1.00 25.00 H new ATOM 0 HD11 LEU A 61 27.212 26.543 -3.521 1.00 25.00 H new ATOM 0 HD12 LEU A 61 27.894 25.991 -1.973 1.00 25.00 H new ATOM 0 HD13 LEU A 61 28.769 27.192 -2.952 1.00 25.00 H new ATOM 0 HD21 LEU A 61 28.203 25.838 -5.629 1.00 25.00 H new ATOM 0 HD22 LEU A 61 29.766 26.514 -5.111 1.00 25.00 H new ATOM 0 HD23 LEU A 61 29.664 24.821 -5.649 1.00 25.00 H new ATOM 934 N VAL A 62 31.228 21.928 -2.966 1.00 25.00 N ATOM 935 CA VAL A 62 31.378 20.630 -3.635 1.00 25.00 C ATOM 936 C VAL A 62 30.998 19.495 -2.686 1.00 25.00 C ATOM 937 O VAL A 62 30.295 18.565 -3.064 1.00 25.00 O ATOM 938 CB VAL A 62 32.834 20.402 -4.142 1.00 25.00 C ATOM 939 CG1 VAL A 62 32.962 19.029 -4.830 1.00 25.00 C ATOM 940 CG2 VAL A 62 33.229 21.505 -5.131 1.00 25.00 C ATOM 0 H VAL A 62 32.105 22.419 -2.793 1.00 25.00 H new ATOM 0 HA VAL A 62 30.710 20.636 -4.496 1.00 25.00 H new ATOM 0 HB VAL A 62 33.501 20.430 -3.281 1.00 25.00 H new ATOM 0 HG11 VAL A 62 33.986 18.890 -5.177 1.00 25.00 H new ATOM 0 HG12 VAL A 62 32.709 18.241 -4.120 1.00 25.00 H new ATOM 0 HG13 VAL A 62 32.282 18.983 -5.680 1.00 25.00 H new ATOM 0 HG21 VAL A 62 34.248 21.335 -5.478 1.00 25.00 H new ATOM 0 HG22 VAL A 62 32.549 21.491 -5.982 1.00 25.00 H new ATOM 0 HG23 VAL A 62 33.171 22.475 -4.637 1.00 25.00 H new ATOM 950 N GLU A 63 31.429 19.596 -1.439 1.00 25.00 N ATOM 951 CA GLU A 63 31.128 18.573 -0.428 1.00 25.00 C ATOM 952 C GLU A 63 29.609 18.475 -0.244 1.00 25.00 C ATOM 953 O GLU A 63 29.044 17.393 -0.132 1.00 25.00 O ATOM 954 CB GLU A 63 31.786 18.940 0.905 1.00 25.00 C ATOM 955 CG GLU A 63 33.312 19.049 0.847 1.00 25.00 C ATOM 956 CD GLU A 63 34.021 17.786 1.262 1.00 25.00 C ATOM 957 OE1 GLU A 63 35.008 17.903 2.024 1.00 25.00 O ATOM 958 OE2 GLU A 63 33.621 16.687 0.838 1.00 25.00 O ATOM 0 H GLU A 63 31.990 20.375 -1.094 1.00 25.00 H new ATOM 0 HA GLU A 63 31.520 17.612 -0.761 1.00 25.00 H new ATOM 0 HB2 GLU A 63 31.379 19.891 1.248 1.00 25.00 H new ATOM 0 HB3 GLU A 63 31.515 18.191 1.649 1.00 25.00 H new ATOM 0 HG2 GLU A 63 33.612 19.307 -0.169 1.00 25.00 H new ATOM 0 HG3 GLU A 63 33.635 19.866 1.492 1.00 25.00 H new ATOM 965 N GLN A 64 28.940 19.621 -0.260 1.00 25.00 N ATOM 966 CA GLN A 64 27.493 19.663 -0.124 1.00 25.00 C ATOM 967 C GLN A 64 26.817 19.163 -1.387 1.00 25.00 C ATOM 968 O GLN A 64 25.794 18.508 -1.301 1.00 25.00 O ATOM 969 CB GLN A 64 27.025 21.081 0.194 1.00 25.00 C ATOM 970 CG GLN A 64 27.380 21.531 1.609 1.00 25.00 C ATOM 971 CD GLN A 64 26.671 20.711 2.660 1.00 25.00 C ATOM 972 OE1 GLN A 64 25.463 20.563 2.624 1.00 25.00 O ATOM 973 NE2 GLN A 64 27.413 20.180 3.597 1.00 25.00 N ATOM 0 H GLN A 64 29.380 20.535 -0.366 1.00 25.00 H new ATOM 0 HA GLN A 64 27.214 19.007 0.701 1.00 25.00 H new ATOM 0 HB2 GLN A 64 27.470 21.772 -0.522 1.00 25.00 H new ATOM 0 HB3 GLN A 64 25.944 21.138 0.063 1.00 25.00 H new ATOM 0 HG2 GLN A 64 28.457 21.453 1.754 1.00 25.00 H new ATOM 0 HG3 GLN A 64 27.117 22.582 1.731 1.00 25.00 H new ATOM 0 HE21 GLN A 64 28.422 20.327 3.593 1.00 25.00 H new ATOM 0 HE22 GLN A 64 26.982 19.619 4.332 1.00 25.00 H new ATOM 982 N GLN A 65 27.385 19.429 -2.553 1.00 25.00 N ATOM 983 CA GLN A 65 26.805 18.917 -3.796 1.00 25.00 C ATOM 984 C GLN A 65 26.860 17.392 -3.806 1.00 25.00 C ATOM 985 O GLN A 65 25.924 16.746 -4.267 1.00 25.00 O ATOM 986 CB GLN A 65 27.535 19.463 -5.027 1.00 25.00 C ATOM 987 CG GLN A 65 27.126 20.892 -5.402 1.00 25.00 C ATOM 988 CD GLN A 65 27.821 21.373 -6.664 1.00 25.00 C ATOM 989 OE1 GLN A 65 27.730 20.741 -7.702 1.00 25.00 O ATOM 990 NE2 GLN A 65 28.500 22.488 -6.581 1.00 25.00 N ATOM 0 H GLN A 65 28.232 19.986 -2.670 1.00 25.00 H new ATOM 0 HA GLN A 65 25.769 19.251 -3.840 1.00 25.00 H new ATOM 0 HB2 GLN A 65 28.609 19.438 -4.842 1.00 25.00 H new ATOM 0 HB3 GLN A 65 27.342 18.805 -5.874 1.00 25.00 H new ATOM 0 HG2 GLN A 65 26.046 20.934 -5.545 1.00 25.00 H new ATOM 0 HG3 GLN A 65 27.365 21.565 -4.578 1.00 25.00 H new ATOM 0 HE21 GLN A 65 28.553 22.988 -5.694 1.00 25.00 H new ATOM 0 HE22 GLN A 65 28.977 22.857 -7.404 1.00 25.00 H new ATOM 999 N GLN A 66 27.915 16.813 -3.247 1.00 25.00 N ATOM 1000 CA GLN A 66 28.016 15.355 -3.162 1.00 25.00 C ATOM 1001 C GLN A 66 26.886 14.784 -2.294 1.00 25.00 C ATOM 1002 O GLN A 66 26.269 13.775 -2.648 1.00 25.00 O ATOM 1003 CB GLN A 66 29.379 14.919 -2.614 1.00 25.00 C ATOM 1004 CG GLN A 66 30.531 15.150 -3.592 1.00 25.00 C ATOM 1005 CD GLN A 66 31.862 14.689 -3.034 1.00 25.00 C ATOM 1006 OE1 GLN A 66 31.974 13.606 -2.483 1.00 25.00 O ATOM 1007 NE2 GLN A 66 32.869 15.513 -3.169 1.00 25.00 N ATOM 0 H GLN A 66 28.706 17.320 -2.849 1.00 25.00 H new ATOM 0 HA GLN A 66 27.917 14.958 -4.173 1.00 25.00 H new ATOM 0 HB2 GLN A 66 29.582 15.463 -1.691 1.00 25.00 H new ATOM 0 HB3 GLN A 66 29.337 13.860 -2.358 1.00 25.00 H new ATOM 0 HG2 GLN A 66 30.327 14.620 -4.522 1.00 25.00 H new ATOM 0 HG3 GLN A 66 30.590 16.211 -3.836 1.00 25.00 H new ATOM 0 HE21 GLN A 66 32.735 16.410 -3.636 1.00 25.00 H new ATOM 0 HE22 GLN A 66 33.788 15.259 -2.807 1.00 25.00 H new ATOM 1016 N ASP A 67 26.568 15.442 -1.183 1.00 25.00 N ATOM 1017 CA ASP A 67 25.450 14.981 -0.344 1.00 25.00 C ATOM 1018 C ASP A 67 24.122 15.215 -1.043 1.00 25.00 C ATOM 1019 O ASP A 67 23.210 14.391 -0.991 1.00 25.00 O ATOM 1020 CB ASP A 67 25.392 15.692 1.008 1.00 25.00 C ATOM 1021 CG ASP A 67 24.339 15.071 1.934 1.00 25.00 C ATOM 1022 OD1 ASP A 67 24.562 13.927 2.390 1.00 25.00 O ATOM 1023 OD2 ASP A 67 23.254 15.682 2.145 1.00 25.00 O ATOM 0 H ASP A 67 27.049 16.275 -0.843 1.00 25.00 H new ATOM 0 HA ASP A 67 25.624 13.918 -0.178 1.00 25.00 H new ATOM 0 HB2 ASP A 67 26.370 15.644 1.486 1.00 25.00 H new ATOM 0 HB3 ASP A 67 25.164 16.747 0.854 1.00 25.00 H new ATOM 1028 N ARG A 68 24.019 16.351 -1.723 1.00 25.00 N ATOM 1029 CA ARG A 68 22.794 16.703 -2.437 1.00 25.00 C ATOM 1030 C ARG A 68 22.494 15.682 -3.509 1.00 25.00 C ATOM 1031 O ARG A 68 21.347 15.345 -3.681 1.00 25.00 O ATOM 1032 CB ARG A 68 22.892 18.094 -3.070 1.00 25.00 C ATOM 1033 CG ARG A 68 22.730 19.260 -2.094 1.00 25.00 C ATOM 1034 CD ARG A 68 21.300 19.371 -1.576 1.00 25.00 C ATOM 1035 NE ARG A 68 21.124 20.554 -0.718 1.00 25.00 N ATOM 1036 CZ ARG A 68 20.757 21.766 -1.132 1.00 25.00 C ATOM 1037 NH1 ARG A 68 20.522 22.045 -2.385 1.00 25.00 N ATOM 1038 NH2 ARG A 68 20.617 22.718 -0.250 1.00 25.00 N ATOM 0 H ARG A 68 24.765 17.043 -1.796 1.00 25.00 H new ATOM 0 HA ARG A 68 21.984 16.713 -1.707 1.00 25.00 H new ATOM 0 HB2 ARG A 68 23.859 18.185 -3.564 1.00 25.00 H new ATOM 0 HB3 ARG A 68 22.130 18.179 -3.844 1.00 25.00 H new ATOM 0 HG2 ARG A 68 23.412 19.128 -1.254 1.00 25.00 H new ATOM 0 HG3 ARG A 68 23.010 20.190 -2.589 1.00 25.00 H new ATOM 0 HD2 ARG A 68 20.611 19.426 -2.419 1.00 25.00 H new ATOM 0 HD3 ARG A 68 21.045 18.472 -1.014 1.00 25.00 H new ATOM 0 HE ARG A 68 21.298 20.436 0.280 1.00 25.00 H new ATOM 0 HH11 ARG A 68 20.617 21.319 -3.096 1.00 25.00 H new ATOM 0 HH12 ARG A 68 20.243 22.989 -2.654 1.00 25.00 H new ATOM 0 HH21 ARG A 68 20.788 22.528 0.737 1.00 25.00 H new ATOM 0 HH22 ARG A 68 20.337 23.652 -0.548 1.00 25.00 H new ATOM 1052 N ALA A 69 23.510 15.146 -4.165 1.00 25.00 N ATOM 1053 CA ALA A 69 23.320 14.129 -5.202 1.00 25.00 C ATOM 1054 C ALA A 69 22.624 12.874 -4.648 1.00 25.00 C ATOM 1055 O ALA A 69 21.855 12.215 -5.343 1.00 25.00 O ATOM 1056 CB ALA A 69 24.673 13.759 -5.816 1.00 25.00 C ATOM 0 H ALA A 69 24.485 15.397 -4.000 1.00 25.00 H new ATOM 0 HA ALA A 69 22.672 14.548 -5.972 1.00 25.00 H new ATOM 0 HB1 ALA A 69 24.528 13.002 -6.587 1.00 25.00 H new ATOM 0 HB2 ALA A 69 25.126 14.646 -6.259 1.00 25.00 H new ATOM 0 HB3 ALA A 69 25.329 13.365 -5.040 1.00 25.00 H new ATOM 1062 N ARG A 70 22.864 12.560 -3.380 1.00 25.00 N ATOM 1063 CA ARG A 70 22.228 11.396 -2.737 1.00 25.00 C ATOM 1064 C ARG A 70 20.743 11.652 -2.566 1.00 25.00 C ATOM 1065 O ARG A 70 19.917 10.761 -2.689 1.00 25.00 O ATOM 1066 CB ARG A 70 22.840 11.152 -1.352 1.00 25.00 C ATOM 1067 CG ARG A 70 24.359 11.004 -1.348 1.00 25.00 C ATOM 1068 CD ARG A 70 24.898 11.135 0.075 1.00 25.00 C ATOM 1069 NE ARG A 70 24.510 9.990 0.913 1.00 25.00 N ATOM 1070 CZ ARG A 70 24.379 10.014 2.234 1.00 25.00 C ATOM 1071 NH1 ARG A 70 24.558 11.102 2.950 1.00 25.00 N ATOM 1072 NH2 ARG A 70 24.056 8.913 2.858 1.00 25.00 N ATOM 0 H ARG A 70 23.490 13.087 -2.772 1.00 25.00 H new ATOM 0 HA ARG A 70 22.390 10.523 -3.370 1.00 25.00 H new ATOM 0 HB2 ARG A 70 22.567 11.979 -0.697 1.00 25.00 H new ATOM 0 HB3 ARG A 70 22.399 10.250 -0.928 1.00 25.00 H new ATOM 0 HG2 ARG A 70 24.638 10.035 -1.763 1.00 25.00 H new ATOM 0 HG3 ARG A 70 24.808 11.765 -1.986 1.00 25.00 H new ATOM 0 HD2 ARG A 70 25.985 11.213 0.046 1.00 25.00 H new ATOM 0 HD3 ARG A 70 24.524 12.056 0.522 1.00 25.00 H new ATOM 0 HE ARG A 70 24.327 9.105 0.440 1.00 25.00 H new ATOM 0 HH11 ARG A 70 24.809 11.978 2.492 1.00 25.00 H new ATOM 0 HH12 ARG A 70 24.446 11.070 3.963 1.00 25.00 H new ATOM 0 HH21 ARG A 70 23.909 8.052 2.331 1.00 25.00 H new ATOM 0 HH22 ARG A 70 23.951 8.914 3.873 1.00 25.00 H new ATOM 1086 N ARG A 71 20.418 12.894 -2.240 1.00 25.00 N ATOM 1087 CA ARG A 71 19.038 13.318 -1.970 1.00 25.00 C ATOM 1088 C ARG A 71 18.288 13.582 -3.273 1.00 25.00 C ATOM 1089 O ARG A 71 17.073 13.468 -3.345 1.00 25.00 O ATOM 1090 CB ARG A 71 19.059 14.609 -1.156 1.00 25.00 C ATOM 1091 CG ARG A 71 19.933 14.539 0.096 1.00 25.00 C ATOM 1092 CD ARG A 71 20.101 15.915 0.687 1.00 25.00 C ATOM 1093 NE ARG A 71 19.056 16.184 1.690 1.00 25.00 N ATOM 1094 CZ ARG A 71 19.236 16.134 3.004 1.00 25.00 C ATOM 1095 NH1 ARG A 71 20.396 15.874 3.554 1.00 25.00 N ATOM 1096 NH2 ARG A 71 18.209 16.346 3.783 1.00 25.00 N ATOM 0 H ARG A 71 21.102 13.645 -2.153 1.00 25.00 H new ATOM 0 HA ARG A 71 18.535 12.522 -1.421 1.00 25.00 H new ATOM 0 HB2 ARG A 71 19.415 15.421 -1.790 1.00 25.00 H new ATOM 0 HB3 ARG A 71 18.039 14.858 -0.862 1.00 25.00 H new ATOM 0 HG2 ARG A 71 19.479 13.873 0.829 1.00 25.00 H new ATOM 0 HG3 ARG A 71 20.908 14.121 -0.154 1.00 25.00 H new ATOM 0 HD2 ARG A 71 21.085 16.000 1.148 1.00 25.00 H new ATOM 0 HD3 ARG A 71 20.054 16.664 -0.104 1.00 25.00 H new ATOM 0 HE ARG A 71 18.126 16.427 1.350 1.00 25.00 H new ATOM 0 HH11 ARG A 71 21.211 15.699 2.966 1.00 25.00 H new ATOM 0 HH12 ARG A 71 20.484 15.847 4.570 1.00 25.00 H new ATOM 0 HH21 ARG A 71 17.294 16.545 3.378 1.00 25.00 H new ATOM 0 HH22 ARG A 71 18.322 16.313 4.796 1.00 25.00 H new ATOM 1110 N GLU A 72 19.049 13.943 -4.285 1.00 25.00 N ATOM 1111 CA GLU A 72 18.539 14.259 -5.615 1.00 25.00 C ATOM 1112 C GLU A 72 17.821 13.065 -6.212 1.00 25.00 C ATOM 1113 O GLU A 72 16.872 13.226 -6.959 1.00 25.00 O ATOM 1114 CB GLU A 72 19.715 14.668 -6.504 1.00 25.00 C ATOM 1115 CG GLU A 72 19.351 15.170 -7.866 1.00 25.00 C ATOM 1116 CD GLU A 72 20.585 15.578 -8.634 1.00 25.00 C ATOM 1117 OE1 GLU A 72 21.166 16.631 -8.290 1.00 25.00 O ATOM 1118 OE2 GLU A 72 21.030 14.816 -9.513 1.00 25.00 O ATOM 0 H GLU A 72 20.063 14.029 -4.210 1.00 25.00 H new ATOM 0 HA GLU A 72 17.823 15.078 -5.545 1.00 25.00 H new ATOM 0 HB2 GLU A 72 20.283 15.443 -5.990 1.00 25.00 H new ATOM 0 HB3 GLU A 72 20.377 13.810 -6.618 1.00 25.00 H new ATOM 0 HG2 GLU A 72 18.816 14.394 -8.414 1.00 25.00 H new ATOM 0 HG3 GLU A 72 18.675 16.020 -7.777 1.00 25.00 H new ATOM 1125 N GLN A 73 18.240 11.867 -5.823 1.00 25.00 N ATOM 1126 CA GLN A 73 17.615 10.632 -6.300 1.00 25.00 C ATOM 1127 C GLN A 73 16.113 10.607 -5.995 1.00 25.00 C ATOM 1128 O GLN A 73 15.316 10.097 -6.780 1.00 25.00 O ATOM 1129 CB GLN A 73 18.305 9.420 -5.657 1.00 25.00 C ATOM 1130 CG GLN A 73 19.823 9.384 -5.895 1.00 25.00 C ATOM 1131 CD GLN A 73 20.194 9.474 -7.367 1.00 25.00 C ATOM 1132 OE1 GLN A 73 19.810 8.638 -8.165 1.00 25.00 O ATOM 1133 NE2 GLN A 73 20.956 10.480 -7.720 1.00 25.00 N ATOM 0 H GLN A 73 19.014 11.721 -5.175 1.00 25.00 H new ATOM 0 HA GLN A 73 17.734 10.588 -7.383 1.00 25.00 H new ATOM 0 HB2 GLN A 73 18.113 9.429 -4.584 1.00 25.00 H new ATOM 0 HB3 GLN A 73 17.861 8.506 -6.052 1.00 25.00 H new ATOM 0 HG2 GLN A 73 20.290 10.209 -5.357 1.00 25.00 H new ATOM 0 HG3 GLN A 73 20.229 8.462 -5.479 1.00 25.00 H new ATOM 0 HE21 GLN A 73 21.258 11.161 -7.023 1.00 25.00 H new ATOM 0 HE22 GLN A 73 21.247 10.583 -8.692 1.00 25.00 H new ATOM 1142 N GLU A 74 15.713 11.196 -4.875 1.00 25.00 N ATOM 1143 CA GLU A 74 14.291 11.293 -4.543 1.00 25.00 C ATOM 1144 C GLU A 74 13.587 12.364 -5.383 1.00 25.00 C ATOM 1145 O GLU A 74 12.432 12.216 -5.730 1.00 25.00 O ATOM 1146 CB GLU A 74 14.099 11.619 -3.060 1.00 25.00 C ATOM 1147 CG GLU A 74 14.552 10.503 -2.115 1.00 25.00 C ATOM 1148 CD GLU A 74 13.774 9.198 -2.322 1.00 25.00 C ATOM 1149 OE1 GLU A 74 14.297 8.129 -1.950 1.00 25.00 O ATOM 1150 OE2 GLU A 74 12.658 9.226 -2.883 1.00 25.00 O ATOM 0 H GLU A 74 16.342 11.610 -4.187 1.00 25.00 H new ATOM 0 HA GLU A 74 13.847 10.323 -4.766 1.00 25.00 H new ATOM 0 HB2 GLU A 74 14.652 12.528 -2.824 1.00 25.00 H new ATOM 0 HB3 GLU A 74 13.045 11.830 -2.878 1.00 25.00 H new ATOM 0 HG2 GLU A 74 15.615 10.315 -2.265 1.00 25.00 H new ATOM 0 HG3 GLU A 74 14.430 10.834 -1.084 1.00 25.00 H new ATOM 1157 N ARG A 75 14.283 13.442 -5.703 1.00 25.00 N ATOM 1158 CA ARG A 75 13.678 14.524 -6.490 1.00 25.00 C ATOM 1159 C ARG A 75 13.449 14.121 -7.940 1.00 25.00 C ATOM 1160 O ARG A 75 12.409 14.437 -8.510 1.00 25.00 O ATOM 1161 CB ARG A 75 14.552 15.778 -6.450 1.00 25.00 C ATOM 1162 CG ARG A 75 14.495 16.506 -5.124 1.00 25.00 C ATOM 1163 CD ARG A 75 15.232 17.839 -5.218 1.00 25.00 C ATOM 1164 NE ARG A 75 14.976 18.705 -4.047 1.00 25.00 N ATOM 1165 CZ ARG A 75 13.965 19.571 -3.930 1.00 25.00 C ATOM 1166 NH1 ARG A 75 13.069 19.741 -4.863 1.00 25.00 N ATOM 1167 NH2 ARG A 75 13.861 20.280 -2.841 1.00 25.00 N ATOM 0 H ARG A 75 15.255 13.599 -5.438 1.00 25.00 H new ATOM 0 HA ARG A 75 12.710 14.735 -6.036 1.00 25.00 H new ATOM 0 HB2 ARG A 75 15.585 15.499 -6.659 1.00 25.00 H new ATOM 0 HB3 ARG A 75 14.238 16.457 -7.243 1.00 25.00 H new ATOM 0 HG2 ARG A 75 13.457 16.676 -4.840 1.00 25.00 H new ATOM 0 HG3 ARG A 75 14.942 15.890 -4.344 1.00 25.00 H new ATOM 0 HD2 ARG A 75 16.303 17.654 -5.304 1.00 25.00 H new ATOM 0 HD3 ARG A 75 14.925 18.359 -6.126 1.00 25.00 H new ATOM 0 HE ARG A 75 15.625 18.636 -3.263 1.00 25.00 H new ATOM 0 HH11 ARG A 75 13.123 19.201 -5.726 1.00 25.00 H new ATOM 0 HH12 ARG A 75 12.315 20.414 -4.729 1.00 25.00 H new ATOM 0 HH21 ARG A 75 14.546 20.170 -2.093 1.00 25.00 H new ATOM 0 HH22 ARG A 75 13.095 20.945 -2.737 1.00 25.00 H new ATOM 1181 N ILE A 76 14.404 13.416 -8.534 1.00 25.00 N ATOM 1182 CA ILE A 76 14.288 12.990 -9.940 1.00 25.00 C ATOM 1183 C ILE A 76 13.190 11.937 -10.117 1.00 25.00 C ATOM 1184 O ILE A 76 12.753 11.670 -11.230 1.00 25.00 O ATOM 1185 CB ILE A 76 15.636 12.469 -10.516 1.00 25.00 C ATOM 1186 CG1 ILE A 76 16.100 11.203 -9.772 1.00 25.00 C ATOM 1187 CG2 ILE A 76 16.698 13.596 -10.452 1.00 25.00 C ATOM 1188 CD1 ILE A 76 17.349 10.538 -10.351 1.00 25.00 C ATOM 0 H ILE A 76 15.267 13.124 -8.074 1.00 25.00 H new ATOM 0 HA ILE A 76 14.011 13.879 -10.507 1.00 25.00 H new ATOM 0 HB ILE A 76 15.496 12.189 -11.560 1.00 25.00 H new ATOM 0 HG12 ILE A 76 16.293 11.461 -8.731 1.00 25.00 H new ATOM 0 HG13 ILE A 76 15.286 10.478 -9.775 1.00 25.00 H new ATOM 0 HG21 ILE A 76 17.642 13.230 -10.856 1.00 25.00 H new ATOM 0 HG22 ILE A 76 16.359 14.449 -11.039 1.00 25.00 H new ATOM 0 HG23 ILE A 76 16.841 13.903 -9.416 1.00 25.00 H new ATOM 0 HD11 ILE A 76 17.598 9.656 -9.761 1.00 25.00 H new ATOM 0 HD12 ILE A 76 17.159 10.243 -11.383 1.00 25.00 H new ATOM 0 HD13 ILE A 76 18.182 11.241 -10.322 1.00 25.00 H new ATOM 1200 N ARG A 77 12.741 11.354 -9.010 1.00 25.00 N ATOM 1201 CA ARG A 77 11.620 10.412 -9.023 1.00 25.00 C ATOM 1202 C ARG A 77 10.386 11.109 -9.598 1.00 25.00 C ATOM 1203 O ARG A 77 9.633 10.507 -10.367 1.00 25.00 O ATOM 1204 CB ARG A 77 11.332 9.935 -7.598 1.00 25.00 C ATOM 1205 CG ARG A 77 10.362 8.774 -7.515 1.00 25.00 C ATOM 1206 CD ARG A 77 9.995 8.465 -6.055 1.00 25.00 C ATOM 1207 NE ARG A 77 11.157 8.116 -5.203 1.00 25.00 N ATOM 1208 CZ ARG A 77 11.790 6.951 -5.192 1.00 25.00 C ATOM 1209 NH1 ARG A 77 11.475 5.968 -5.996 1.00 25.00 N ATOM 1210 NH2 ARG A 77 12.764 6.773 -4.354 1.00 25.00 N ATOM 0 H ARG A 77 13.138 11.517 -8.085 1.00 25.00 H new ATOM 0 HA ARG A 77 11.871 9.550 -9.641 1.00 25.00 H new ATOM 0 HB2 ARG A 77 12.271 9.643 -7.128 1.00 25.00 H new ATOM 0 HB3 ARG A 77 10.933 10.769 -7.021 1.00 25.00 H new ATOM 0 HG2 ARG A 77 9.459 9.009 -8.079 1.00 25.00 H new ATOM 0 HG3 ARG A 77 10.805 7.892 -7.977 1.00 25.00 H new ATOM 0 HD2 ARG A 77 9.490 9.331 -5.627 1.00 25.00 H new ATOM 0 HD3 ARG A 77 9.283 7.640 -6.037 1.00 25.00 H new ATOM 0 HE ARG A 77 11.500 8.837 -4.568 1.00 25.00 H new ATOM 0 HH11 ARG A 77 10.715 6.081 -6.666 1.00 25.00 H new ATOM 0 HH12 ARG A 77 11.990 5.089 -5.952 1.00 25.00 H new ATOM 0 HH21 ARG A 77 13.032 7.523 -3.717 1.00 25.00 H new ATOM 0 HH22 ARG A 77 13.262 5.883 -4.332 1.00 25.00 H new ATOM 1224 N LEU A 78 10.245 12.388 -9.248 1.00 25.00 N ATOM 1225 CA LEU A 78 9.184 13.286 -9.723 1.00 25.00 C ATOM 1226 C LEU A 78 7.762 12.740 -9.492 1.00 25.00 C ATOM 1227 O LEU A 78 7.590 11.698 -8.847 1.00 25.00 O ATOM 1228 CB LEU A 78 9.481 13.599 -11.203 1.00 25.00 C ATOM 1229 CG LEU A 78 8.855 14.812 -11.920 1.00 25.00 C ATOM 1230 CD1 LEU A 78 9.173 16.115 -11.185 1.00 25.00 C ATOM 1231 CD2 LEU A 78 9.372 14.879 -13.348 1.00 25.00 C ATOM 0 H LEU A 78 10.888 12.847 -8.603 1.00 25.00 H new ATOM 0 HA LEU A 78 9.194 14.205 -9.137 1.00 25.00 H new ATOM 0 HB2 LEU A 78 10.562 13.704 -11.292 1.00 25.00 H new ATOM 0 HB3 LEU A 78 9.199 12.715 -11.775 1.00 25.00 H new ATOM 0 HG LEU A 78 7.772 14.688 -11.927 1.00 25.00 H new ATOM 0 HD11 LEU A 78 8.718 16.952 -11.715 1.00 25.00 H new ATOM 0 HD12 LEU A 78 8.775 16.068 -10.171 1.00 25.00 H new ATOM 0 HD13 LEU A 78 10.253 16.255 -11.144 1.00 25.00 H new ATOM 0 HD21 LEU A 78 8.930 15.736 -13.855 1.00 25.00 H new ATOM 0 HD22 LEU A 78 10.457 14.984 -13.338 1.00 25.00 H new ATOM 0 HD23 LEU A 78 9.101 13.965 -13.876 1.00 25.00 H new ATOM 1243 N PHE A 79 6.758 13.479 -9.967 1.00 25.00 N ATOM 1244 CA PHE A 79 5.322 13.162 -9.917 1.00 25.00 C ATOM 1245 C PHE A 79 4.666 13.013 -8.530 1.00 25.00 C ATOM 1246 O PHE A 79 3.447 13.114 -8.389 1.00 25.00 O ATOM 1247 CB PHE A 79 5.054 11.924 -10.757 1.00 25.00 C ATOM 1248 CG PHE A 79 5.758 11.938 -12.095 1.00 25.00 C ATOM 1249 CD1 PHE A 79 5.292 12.761 -13.138 1.00 25.00 C ATOM 1250 CD2 PHE A 79 6.890 11.138 -12.312 1.00 25.00 C ATOM 1251 CE1 PHE A 79 5.959 12.792 -14.383 1.00 25.00 C ATOM 1252 CE2 PHE A 79 7.563 11.154 -13.556 1.00 25.00 C ATOM 1253 CZ PHE A 79 7.095 11.978 -14.594 1.00 25.00 C ATOM 0 H PHE A 79 6.933 14.372 -10.427 1.00 25.00 H new ATOM 0 HA PHE A 79 4.842 14.054 -10.319 1.00 25.00 H new ATOM 0 HB2 PHE A 79 5.368 11.042 -10.200 1.00 25.00 H new ATOM 0 HB3 PHE A 79 3.980 11.832 -10.921 1.00 25.00 H new ATOM 0 HD1 PHE A 79 4.416 13.374 -12.985 1.00 25.00 H new ATOM 0 HD2 PHE A 79 7.252 10.501 -11.518 1.00 25.00 H new ATOM 0 HE1 PHE A 79 5.601 13.437 -15.172 1.00 25.00 H new ATOM 0 HE2 PHE A 79 8.434 10.534 -13.708 1.00 25.00 H new ATOM 0 HZ PHE A 79 7.601 11.989 -15.548 1.00 25.00 H new ATOM 1263 N SER A 80 5.480 12.783 -7.520 1.00 25.00 N ATOM 1264 CA SER A 80 5.034 12.668 -6.137 1.00 25.00 C ATOM 1265 C SER A 80 6.192 13.086 -5.233 1.00 25.00 C ATOM 1266 O SER A 80 6.331 12.615 -4.108 1.00 25.00 O ATOM 1267 CB SER A 80 4.599 11.233 -5.832 1.00 25.00 C ATOM 1268 OG SER A 80 3.550 10.843 -6.705 1.00 25.00 O ATOM 0 H SER A 80 6.487 12.668 -7.634 1.00 25.00 H new ATOM 0 HA SER A 80 4.173 13.314 -5.963 1.00 25.00 H new ATOM 0 HB2 SER A 80 5.446 10.557 -5.945 1.00 25.00 H new ATOM 0 HB3 SER A 80 4.267 11.158 -4.796 1.00 25.00 H new ATOM 0 HG SER A 80 3.281 9.923 -6.502 1.00 25.00 H new ATOM 1274 N ALA A 81 7.046 13.951 -5.770 1.00 25.00 N ATOM 1275 CA ALA A 81 8.249 14.416 -5.070 1.00 25.00 C ATOM 1276 C ALA A 81 8.412 15.900 -5.389 1.00 25.00 C ATOM 1277 O ALA A 81 9.503 16.472 -5.353 1.00 25.00 O ATOM 1278 CB ALA A 81 9.469 13.618 -5.538 1.00 25.00 C ATOM 0 H ALA A 81 6.929 14.352 -6.701 1.00 25.00 H new ATOM 0 HA ALA A 81 8.158 14.271 -3.994 1.00 25.00 H new ATOM 0 HB1 ALA A 81 10.357 13.970 -5.013 1.00 25.00 H new ATOM 0 HB2 ALA A 81 9.316 12.560 -5.324 1.00 25.00 H new ATOM 0 HB3 ALA A 81 9.604 13.755 -6.611 1.00 25.00 H new ATOM 1284 N ASP A 82 7.301 16.459 -5.829 1.00 25.00 N ATOM 1285 CA ASP A 82 7.237 17.802 -6.384 1.00 25.00 C ATOM 1286 C ASP A 82 7.490 18.859 -5.296 1.00 25.00 C ATOM 1287 O ASP A 82 7.281 18.609 -4.106 1.00 25.00 O ATOM 1288 CB ASP A 82 5.854 17.994 -7.034 1.00 25.00 C ATOM 1289 CG ASP A 82 5.661 17.121 -8.288 1.00 25.00 C ATOM 1290 OD1 ASP A 82 6.172 15.968 -8.330 1.00 25.00 O ATOM 1291 OD2 ASP A 82 4.977 17.579 -9.220 1.00 25.00 O ATOM 0 H ASP A 82 6.398 15.985 -5.811 1.00 25.00 H new ATOM 0 HA ASP A 82 8.015 17.928 -7.137 1.00 25.00 H new ATOM 0 HB2 ASP A 82 5.079 17.754 -6.306 1.00 25.00 H new ATOM 0 HB3 ASP A 82 5.726 19.043 -7.303 1.00 25.00 H new ATOM 1296 N PRO A 83 7.993 20.045 -5.690 1.00 25.00 N ATOM 1297 CA PRO A 83 8.302 21.052 -4.669 1.00 25.00 C ATOM 1298 C PRO A 83 7.077 21.711 -4.035 1.00 25.00 C ATOM 1299 O PRO A 83 5.983 21.711 -4.586 1.00 25.00 O ATOM 1300 CB PRO A 83 9.114 22.083 -5.454 1.00 25.00 C ATOM 1301 CG PRO A 83 8.554 22.010 -6.819 1.00 25.00 C ATOM 1302 CD PRO A 83 8.328 20.537 -7.041 1.00 25.00 C ATOM 0 HA PRO A 83 8.817 20.604 -3.819 1.00 25.00 H new ATOM 0 HB2 PRO A 83 9.007 23.082 -5.031 1.00 25.00 H new ATOM 0 HB3 PRO A 83 10.178 21.845 -5.445 1.00 25.00 H new ATOM 0 HG2 PRO A 83 7.624 22.573 -6.900 1.00 25.00 H new ATOM 0 HG3 PRO A 83 9.243 22.424 -7.556 1.00 25.00 H new ATOM 0 HD2 PRO A 83 7.519 20.355 -7.749 1.00 25.00 H new ATOM 0 HD3 PRO A 83 9.217 20.048 -7.440 1.00 25.00 H new ATOM 1310 N PHE A 84 7.304 22.317 -2.881 1.00 25.00 N ATOM 1311 CA PHE A 84 6.264 23.020 -2.125 1.00 25.00 C ATOM 1312 C PHE A 84 6.591 24.508 -2.122 1.00 25.00 C ATOM 1313 O PHE A 84 6.128 25.270 -1.275 1.00 25.00 O ATOM 1314 CB PHE A 84 6.209 22.495 -0.691 1.00 25.00 C ATOM 1315 CG PHE A 84 5.816 21.050 -0.589 1.00 25.00 C ATOM 1316 CD1 PHE A 84 6.789 20.031 -0.689 1.00 25.00 C ATOM 1317 CD2 PHE A 84 4.471 20.692 -0.402 1.00 25.00 C ATOM 1318 CE1 PHE A 84 6.422 18.668 -0.601 1.00 25.00 C ATOM 1319 CE2 PHE A 84 4.089 19.334 -0.310 1.00 25.00 C ATOM 1320 CZ PHE A 84 5.073 18.321 -0.409 1.00 25.00 C ATOM 0 H PHE A 84 8.220 22.339 -2.434 1.00 25.00 H new ATOM 0 HA PHE A 84 5.292 22.852 -2.589 1.00 25.00 H new ATOM 0 HB2 PHE A 84 7.186 22.630 -0.227 1.00 25.00 H new ATOM 0 HB3 PHE A 84 5.500 23.096 -0.121 1.00 25.00 H new ATOM 0 HD1 PHE A 84 7.826 20.296 -0.834 1.00 25.00 H new ATOM 0 HD2 PHE A 84 3.719 21.464 -0.328 1.00 25.00 H new ATOM 0 HE1 PHE A 84 7.174 17.897 -0.681 1.00 25.00 H new ATOM 0 HE2 PHE A 84 3.052 19.071 -0.165 1.00 25.00 H new ATOM 0 HZ PHE A 84 4.788 17.282 -0.337 1.00 25.00 H new ATOM 1330 N ASP A 85 7.406 24.906 -3.087 1.00 25.00 N ATOM 1331 CA ASP A 85 7.868 26.288 -3.231 1.00 25.00 C ATOM 1332 C ASP A 85 6.816 27.075 -4.000 1.00 25.00 C ATOM 1333 O ASP A 85 7.047 27.588 -5.092 1.00 25.00 O ATOM 1334 CB ASP A 85 9.215 26.303 -3.951 1.00 25.00 C ATOM 1335 CG ASP A 85 10.282 25.514 -3.187 1.00 25.00 C ATOM 1336 OD1 ASP A 85 10.652 25.942 -2.074 1.00 25.00 O ATOM 1337 OD2 ASP A 85 10.674 24.412 -3.653 1.00 25.00 O ATOM 0 H ASP A 85 7.772 24.277 -3.802 1.00 25.00 H new ATOM 0 HA ASP A 85 8.007 26.752 -2.254 1.00 25.00 H new ATOM 0 HB2 ASP A 85 9.097 25.881 -4.949 1.00 25.00 H new ATOM 0 HB3 ASP A 85 9.547 27.333 -4.078 1.00 25.00 H new ATOM 1342 N LEU A 86 5.622 27.097 -3.436 1.00 25.00 N ATOM 1343 CA LEU A 86 4.451 27.704 -4.064 1.00 25.00 C ATOM 1344 C LEU A 86 4.557 29.223 -4.126 1.00 25.00 C ATOM 1345 O LEU A 86 3.956 29.867 -4.987 1.00 25.00 O ATOM 1346 CB LEU A 86 3.201 27.303 -3.280 1.00 25.00 C ATOM 1347 CG LEU A 86 2.906 25.791 -3.182 1.00 25.00 C ATOM 1348 CD1 LEU A 86 1.703 25.560 -2.272 1.00 25.00 C ATOM 1349 CD2 LEU A 86 2.633 25.176 -4.555 1.00 25.00 C ATOM 0 H LEU A 86 5.431 26.691 -2.520 1.00 25.00 H new ATOM 0 HA LEU A 86 4.390 27.341 -5.090 1.00 25.00 H new ATOM 0 HB2 LEU A 86 3.291 27.700 -2.269 1.00 25.00 H new ATOM 0 HB3 LEU A 86 2.340 27.790 -3.738 1.00 25.00 H new ATOM 0 HG LEU A 86 3.789 25.306 -2.766 1.00 25.00 H new ATOM 0 HD11 LEU A 86 1.497 24.492 -2.205 1.00 25.00 H new ATOM 0 HD12 LEU A 86 1.918 25.951 -1.278 1.00 25.00 H new ATOM 0 HD13 LEU A 86 0.833 26.072 -2.682 1.00 25.00 H new ATOM 0 HD21 LEU A 86 2.430 24.111 -4.443 1.00 25.00 H new ATOM 0 HD22 LEU A 86 1.770 25.664 -5.007 1.00 25.00 H new ATOM 0 HD23 LEU A 86 3.504 25.314 -5.195 1.00 25.00 H new ATOM 1361 N GLU A 87 5.360 29.781 -3.242 1.00 25.00 N ATOM 1362 CA GLU A 87 5.613 31.218 -3.226 1.00 25.00 C ATOM 1363 C GLU A 87 6.509 31.611 -4.407 1.00 25.00 C ATOM 1364 O GLU A 87 6.507 32.754 -4.851 1.00 25.00 O ATOM 1365 CB GLU A 87 6.324 31.603 -1.922 1.00 25.00 C ATOM 1366 CG GLU A 87 5.549 31.254 -0.656 1.00 25.00 C ATOM 1367 CD GLU A 87 4.179 31.923 -0.594 1.00 25.00 C ATOM 1368 OE1 GLU A 87 4.112 33.170 -0.670 1.00 25.00 O ATOM 1369 OE2 GLU A 87 3.167 31.196 -0.458 1.00 25.00 O ATOM 0 H GLU A 87 5.855 29.261 -2.518 1.00 25.00 H new ATOM 0 HA GLU A 87 4.659 31.739 -3.301 1.00 25.00 H new ATOM 0 HB2 GLU A 87 7.293 31.104 -1.890 1.00 25.00 H new ATOM 0 HB3 GLU A 87 6.518 32.676 -1.931 1.00 25.00 H new ATOM 0 HG2 GLU A 87 5.422 30.173 -0.600 1.00 25.00 H new ATOM 0 HG3 GLU A 87 6.133 31.552 0.215 1.00 25.00 H new ATOM 1376 N ALA A 88 7.289 30.656 -4.882 1.00 25.00 N ATOM 1377 CA ALA A 88 8.246 30.865 -5.964 1.00 25.00 C ATOM 1378 C ALA A 88 7.618 30.645 -7.354 1.00 25.00 C ATOM 1379 O ALA A 88 8.286 30.176 -8.278 1.00 25.00 O ATOM 1380 CB ALA A 88 9.453 29.927 -5.774 1.00 25.00 C ATOM 0 H ALA A 88 7.279 29.700 -4.525 1.00 25.00 H new ATOM 0 HA ALA A 88 8.571 31.905 -5.921 1.00 25.00 H new ATOM 0 HB1 ALA A 88 10.167 30.084 -6.583 1.00 25.00 H new ATOM 0 HB2 ALA A 88 9.933 30.141 -4.819 1.00 25.00 H new ATOM 0 HB3 ALA A 88 9.114 28.891 -5.785 1.00 25.00 H new ATOM 1386 N GLN A 89 6.330 30.920 -7.488 1.00 25.00 N ATOM 1387 CA GLN A 89 5.610 30.686 -8.738 1.00 25.00 C ATOM 1388 C GLN A 89 5.196 31.982 -9.430 1.00 25.00 C ATOM 1389 O GLN A 89 5.005 33.013 -8.793 1.00 25.00 O ATOM 1390 CB GLN A 89 4.369 29.817 -8.472 1.00 25.00 C ATOM 1391 CG GLN A 89 4.690 28.453 -7.860 1.00 25.00 C ATOM 1392 CD GLN A 89 5.618 27.622 -8.720 1.00 25.00 C ATOM 1393 OE1 GLN A 89 5.366 27.409 -9.899 1.00 25.00 O ATOM 1394 NE2 GLN A 89 6.679 27.139 -8.137 1.00 25.00 N ATOM 0 H GLN A 89 5.754 31.309 -6.741 1.00 25.00 H new ATOM 0 HA GLN A 89 6.294 30.167 -9.410 1.00 25.00 H new ATOM 0 HB2 GLN A 89 3.697 30.355 -7.804 1.00 25.00 H new ATOM 0 HB3 GLN A 89 3.834 29.667 -9.410 1.00 25.00 H new ATOM 0 HG2 GLN A 89 5.145 28.599 -6.880 1.00 25.00 H new ATOM 0 HG3 GLN A 89 3.762 27.904 -7.702 1.00 25.00 H new ATOM 0 HE21 GLN A 89 6.855 27.338 -7.152 1.00 25.00 H new ATOM 0 HE22 GLN A 89 7.333 26.562 -8.665 1.00 25.00 H new ATOM 1403 N ALA A 90 4.999 31.863 -10.741 1.00 25.00 N ATOM 1404 CA ALA A 90 4.550 32.934 -11.635 1.00 25.00 C ATOM 1405 C ALA A 90 5.553 34.083 -11.824 1.00 25.00 C ATOM 1406 O ALA A 90 6.617 34.111 -11.223 1.00 25.00 O ATOM 1407 CB ALA A 90 3.167 33.458 -11.193 1.00 25.00 C ATOM 0 H ALA A 90 5.154 30.982 -11.232 1.00 25.00 H new ATOM 0 HA ALA A 90 4.470 32.479 -12.622 1.00 25.00 H new ATOM 0 HB1 ALA A 90 2.847 34.253 -11.867 1.00 25.00 H new ATOM 0 HB2 ALA A 90 2.443 32.644 -11.223 1.00 25.00 H new ATOM 0 HB3 ALA A 90 3.233 33.848 -10.177 1.00 25.00 H new ATOM 1413 N LYS A 91 5.164 34.987 -12.727 1.00 25.00 N ATOM 1414 CA LYS A 91 5.965 36.128 -13.203 1.00 25.00 C ATOM 1415 C LYS A 91 7.192 35.694 -14.014 1.00 25.00 C ATOM 1416 O LYS A 91 7.676 34.577 -13.911 1.00 25.00 O ATOM 1417 CB LYS A 91 6.386 37.028 -12.033 1.00 25.00 C ATOM 1418 CG LYS A 91 6.740 38.457 -12.424 1.00 25.00 C ATOM 1419 CD LYS A 91 7.169 39.243 -11.214 1.00 25.00 C ATOM 1420 CE LYS A 91 7.616 40.646 -11.619 1.00 25.00 C ATOM 1421 NZ LYS A 91 8.142 41.425 -10.454 1.00 25.00 N ATOM 0 H LYS A 91 4.245 34.946 -13.167 1.00 25.00 H new ATOM 0 HA LYS A 91 5.324 36.698 -13.876 1.00 25.00 H new ATOM 0 HB2 LYS A 91 5.576 37.055 -11.304 1.00 25.00 H new ATOM 0 HB3 LYS A 91 7.246 36.578 -11.537 1.00 25.00 H new ATOM 0 HG2 LYS A 91 7.541 38.450 -13.163 1.00 25.00 H new ATOM 0 HG3 LYS A 91 5.879 38.937 -12.890 1.00 25.00 H new ATOM 0 HD2 LYS A 91 6.344 39.308 -10.504 1.00 25.00 H new ATOM 0 HD3 LYS A 91 7.985 38.727 -10.708 1.00 25.00 H new ATOM 0 HE2 LYS A 91 8.388 40.574 -12.385 1.00 25.00 H new ATOM 0 HE3 LYS A 91 6.776 41.180 -12.063 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 8.434 42.371 -10.772 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 7.398 41.517 -9.733 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 8.960 40.929 -10.046 1.00 25.00 H new ATOM 1435 N ILE A 92 7.654 36.606 -14.848 1.00 25.00 N ATOM 1436 CA ILE A 92 8.831 36.422 -15.678 1.00 25.00 C ATOM 1437 C ILE A 92 9.524 37.769 -15.573 1.00 25.00 C ATOM 1438 O ILE A 92 8.862 38.806 -15.662 1.00 25.00 O ATOM 1439 CB ILE A 92 8.465 36.097 -17.172 1.00 25.00 C ATOM 1440 CG1 ILE A 92 7.639 34.795 -17.245 1.00 25.00 C ATOM 1441 CG2 ILE A 92 9.756 35.948 -18.032 1.00 25.00 C ATOM 1442 CD1 ILE A 92 7.063 34.464 -18.640 1.00 25.00 C ATOM 0 H ILE A 92 7.212 37.517 -14.971 1.00 25.00 H new ATOM 0 HA ILE A 92 9.443 35.580 -15.355 1.00 25.00 H new ATOM 0 HB ILE A 92 7.872 36.922 -17.568 1.00 25.00 H new ATOM 0 HG12 ILE A 92 8.268 33.965 -16.922 1.00 25.00 H new ATOM 0 HG13 ILE A 92 6.815 34.865 -16.536 1.00 25.00 H new ATOM 0 HG21 ILE A 92 9.483 35.723 -19.063 1.00 25.00 H new ATOM 0 HG22 ILE A 92 10.323 36.879 -18.002 1.00 25.00 H new ATOM 0 HG23 ILE A 92 10.367 35.138 -17.634 1.00 25.00 H new ATOM 0 HD11 ILE A 92 6.499 33.532 -18.589 1.00 25.00 H new ATOM 0 HD12 ILE A 92 6.404 35.270 -18.962 1.00 25.00 H new ATOM 0 HD13 ILE A 92 7.879 34.356 -19.354 1.00 25.00 H new ATOM 1454 N GLU A 93 10.819 37.763 -15.323 1.00 25.00 N ATOM 1455 CA GLU A 93 11.602 38.994 -15.216 1.00 25.00 C ATOM 1456 C GLU A 93 12.115 39.396 -16.600 1.00 25.00 C ATOM 1457 O GLU A 93 12.105 38.583 -17.524 1.00 25.00 O ATOM 1458 CB GLU A 93 12.770 38.784 -14.246 1.00 25.00 C ATOM 1459 CG GLU A 93 13.782 37.726 -14.691 1.00 25.00 C ATOM 1460 CD GLU A 93 14.820 37.438 -13.619 1.00 25.00 C ATOM 1461 OE1 GLU A 93 16.006 37.263 -13.964 1.00 25.00 O ATOM 1462 OE2 GLU A 93 14.447 37.401 -12.423 1.00 25.00 O ATOM 0 H GLU A 93 11.363 36.911 -15.188 1.00 25.00 H new ATOM 0 HA GLU A 93 10.972 39.796 -14.830 1.00 25.00 H new ATOM 0 HB2 GLU A 93 13.290 39.733 -14.113 1.00 25.00 H new ATOM 0 HB3 GLU A 93 12.371 38.500 -13.272 1.00 25.00 H new ATOM 0 HG2 GLU A 93 13.256 36.805 -14.942 1.00 25.00 H new ATOM 0 HG3 GLU A 93 14.283 38.064 -15.598 1.00 25.00 H new ATOM 1469 N GLU A 94 12.531 40.644 -16.754 1.00 25.00 N ATOM 1470 CA GLU A 94 13.051 41.106 -18.039 1.00 25.00 C ATOM 1471 C GLU A 94 14.580 41.071 -18.033 1.00 25.00 C ATOM 1472 O GLU A 94 15.229 41.623 -17.149 1.00 25.00 O ATOM 1473 CB GLU A 94 12.514 42.513 -18.380 1.00 25.00 C ATOM 1474 CG GLU A 94 12.906 43.638 -17.408 1.00 25.00 C ATOM 1475 CD GLU A 94 12.279 44.973 -17.781 1.00 25.00 C ATOM 1476 OE1 GLU A 94 11.125 45.231 -17.365 1.00 25.00 O ATOM 1477 OE2 GLU A 94 12.928 45.765 -18.503 1.00 25.00 O ATOM 0 H GLU A 94 12.521 41.350 -16.018 1.00 25.00 H new ATOM 0 HA GLU A 94 12.702 40.431 -18.820 1.00 25.00 H new ATOM 0 HB2 GLU A 94 12.864 42.782 -19.376 1.00 25.00 H new ATOM 0 HB3 GLU A 94 11.426 42.463 -18.427 1.00 25.00 H new ATOM 0 HG2 GLU A 94 12.599 43.365 -16.398 1.00 25.00 H new ATOM 0 HG3 GLU A 94 13.991 43.741 -17.394 1.00 25.00 H new ATOM 1484 N ASP A 95 15.157 40.428 -19.041 1.00 25.00 N ATOM 1485 CA ASP A 95 16.604 40.405 -19.214 1.00 25.00 C ATOM 1486 C ASP A 95 16.957 41.064 -20.541 1.00 25.00 C ATOM 1487 O ASP A 95 17.106 40.418 -21.575 1.00 25.00 O ATOM 1488 CB ASP A 95 17.185 38.997 -19.162 1.00 25.00 C ATOM 1489 CG ASP A 95 18.695 39.008 -19.295 1.00 25.00 C ATOM 1490 OD1 ASP A 95 19.302 37.964 -19.613 1.00 25.00 O ATOM 1491 OD2 ASP A 95 19.285 40.102 -19.113 1.00 25.00 O ATOM 0 H ASP A 95 14.641 39.913 -19.755 1.00 25.00 H new ATOM 0 HA ASP A 95 17.044 40.955 -18.382 1.00 25.00 H new ATOM 0 HB2 ASP A 95 16.906 38.523 -18.221 1.00 25.00 H new ATOM 0 HB3 ASP A 95 16.754 38.396 -19.962 1.00 25.00 H new ATOM 1496 N ILE A 96 17.072 42.377 -20.499 1.00 25.00 N ATOM 1497 CA ILE A 96 17.403 43.178 -21.677 1.00 25.00 C ATOM 1498 C ILE A 96 18.909 43.459 -21.734 1.00 25.00 C ATOM 1499 O ILE A 96 19.367 44.380 -22.419 1.00 25.00 O ATOM 1500 CB ILE A 96 16.587 44.505 -21.684 1.00 25.00 C ATOM 1501 CG1 ILE A 96 16.906 45.341 -20.423 1.00 25.00 C ATOM 1502 CG2 ILE A 96 15.069 44.186 -21.743 1.00 25.00 C ATOM 1503 CD1 ILE A 96 16.337 46.758 -20.448 1.00 25.00 C ATOM 0 H ILE A 96 16.940 42.926 -19.649 1.00 25.00 H new ATOM 0 HA ILE A 96 17.132 42.610 -22.567 1.00 25.00 H new ATOM 0 HB ILE A 96 16.866 45.086 -22.563 1.00 25.00 H new ATOM 0 HG12 ILE A 96 16.516 44.821 -19.548 1.00 25.00 H new ATOM 0 HG13 ILE A 96 17.988 45.398 -20.304 1.00 25.00 H new ATOM 0 HG21 ILE A 96 14.502 45.117 -21.748 1.00 25.00 H new ATOM 0 HG22 ILE A 96 14.850 43.623 -22.650 1.00 25.00 H new ATOM 0 HG23 ILE A 96 14.788 43.594 -20.872 1.00 25.00 H new ATOM 0 HD11 ILE A 96 16.607 47.275 -19.527 1.00 25.00 H new ATOM 0 HD12 ILE A 96 16.746 47.299 -21.301 1.00 25.00 H new ATOM 0 HD13 ILE A 96 15.251 46.713 -20.534 1.00 25.00 H new ATOM 1515 N ARG A 97 19.678 42.656 -21.008 1.00 25.00 N ATOM 1516 CA ARG A 97 21.129 42.850 -20.857 1.00 25.00 C ATOM 1517 C ARG A 97 21.920 42.310 -22.059 1.00 25.00 C ATOM 1518 O ARG A 97 22.889 41.561 -21.931 1.00 25.00 O ATOM 1519 CB ARG A 97 21.562 42.164 -19.553 1.00 25.00 C ATOM 1520 CG ARG A 97 22.877 42.613 -18.959 1.00 25.00 C ATOM 1521 CD ARG A 97 23.056 41.932 -17.606 1.00 25.00 C ATOM 1522 NE ARG A 97 24.341 42.271 -16.973 1.00 25.00 N ATOM 1523 CZ ARG A 97 25.478 41.604 -17.141 1.00 25.00 C ATOM 1524 NH1 ARG A 97 25.571 40.553 -17.920 1.00 25.00 N ATOM 1525 NH2 ARG A 97 26.544 42.000 -16.502 1.00 25.00 N ATOM 0 H ARG A 97 19.318 41.846 -20.502 1.00 25.00 H new ATOM 0 HA ARG A 97 21.346 43.917 -20.816 1.00 25.00 H new ATOM 0 HB2 ARG A 97 20.781 42.321 -18.809 1.00 25.00 H new ATOM 0 HB3 ARG A 97 21.619 41.091 -19.735 1.00 25.00 H new ATOM 0 HG2 ARG A 97 23.701 42.355 -19.625 1.00 25.00 H new ATOM 0 HG3 ARG A 97 22.889 43.697 -18.842 1.00 25.00 H new ATOM 0 HD2 ARG A 97 22.240 42.224 -16.945 1.00 25.00 H new ATOM 0 HD3 ARG A 97 22.991 40.852 -17.735 1.00 25.00 H new ATOM 0 HE ARG A 97 24.360 43.083 -16.356 1.00 25.00 H new ATOM 0 HH11 ARG A 97 24.751 40.219 -18.425 1.00 25.00 H new ATOM 0 HH12 ARG A 97 26.464 40.070 -18.021 1.00 25.00 H new ATOM 0 HH21 ARG A 97 26.497 42.810 -15.885 1.00 25.00 H new ATOM 0 HH22 ARG A 97 27.425 41.499 -16.620 1.00 25.00 H new ATOM 1539 N GLN A 98 21.500 42.746 -23.244 1.00 25.00 N ATOM 1540 CA GLN A 98 22.157 42.434 -24.527 1.00 25.00 C ATOM 1541 C GLN A 98 22.641 43.696 -25.235 1.00 25.00 C ATOM 1542 O GLN A 98 23.776 43.843 -25.632 1.00 25.00 O ATOM 1543 CB GLN A 98 21.244 41.594 -25.450 1.00 25.00 C ATOM 1544 CG GLN A 98 20.923 40.228 -24.815 1.00 25.00 C ATOM 1545 CD GLN A 98 20.140 39.356 -25.765 1.00 25.00 C ATOM 1546 OE1 GLN A 98 20.212 39.433 -26.971 1.00 25.00 O ATOM 1547 NE2 GLN A 98 19.318 38.481 -25.204 1.00 25.00 N ATOM 1548 OXT GLN A 98 21.727 44.619 -25.372 1.00 25.00 O ATOM 0 H GLN A 98 20.677 43.339 -23.350 1.00 25.00 H new ATOM 0 HA GLN A 98 23.034 41.830 -24.294 1.00 25.00 H new ATOM 0 HB2 GLN A 98 20.318 42.136 -25.642 1.00 25.00 H new ATOM 0 HB3 GLN A 98 21.732 41.445 -26.413 1.00 25.00 H new ATOM 0 HG2 GLN A 98 21.850 39.726 -24.537 1.00 25.00 H new ATOM 0 HG3 GLN A 98 20.352 40.375 -23.898 1.00 25.00 H new ATOM 0 HE21 GLN A 98 19.258 38.417 -24.188 1.00 25.00 H new ATOM 0 HE22 GLN A 98 18.745 37.872 -25.788 1.00 25.00 H new TER 1558 GLN A 98