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= -0.116 K(o=-0.15,f=-4.2!) USER MOD Set 1.2: A 64 GLN : amide:sc= -0.0365 X(o=-0.15,f=-0.46) USER MOD Set 2.1: A 51 SER OG : rot 70:sc= 1.75 USER MOD Set 2.2: A 56 LYS NZ :NH3+ -170:sc= 0.59 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -114:sc= 0.019 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 3 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.14) USER MOD Single : A 4 SER OG : rot 180:sc= 0.029 USER MOD Single : A 5 HIS : no HD1:sc=-0.00826 X(o=-0.0083,f=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot -70:sc= 0.263 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.00474 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -0.0918 X(o=-0.092,f=0) USER MOD Single : A 20 ASN : amide:sc= -0.0533 X(o=-0.053,f=-0.36) USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -0.76 K(o=-0.76,f=-6.2!) USER MOD Single : A 33 HIS : no HD1:sc= -0.0113 X(o=-0.011,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0534 USER MOD Single : A 65 GLN : amide:sc= 0.243 K(o=0.24,f=-0.98) USER MOD Single : A 66 GLN : amide:sc= -0.0535 X(o=-0.053,f=0) USER MOD Single : A 73 GLN : amide:sc= 0.449 X(o=0.45,f=0) USER MOD Single : A 80 SER OG : rot 133:sc= 0.902 USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 91 LYS NZ :NH3+ -179:sc= 0.0823 (180deg=0.0823) USER MOD Single : A 98 GLN : amide:sc= -0.09 X(o=-0.09,f=-0.09) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 6.172 48.709 0.270 1.00 25.00 N ATOM 2 CA SER A 1 5.026 47.695 0.295 1.00 25.00 C ATOM 3 C SER A 1 5.521 46.244 0.307 1.00 25.00 C ATOM 4 O SER A 1 6.655 45.936 -0.002 1.00 25.00 O ATOM 5 CB SER A 1 4.142 47.929 -0.953 1.00 25.00 C ATOM 6 OG SER A 1 4.802 47.799 -2.106 1.00 25.00 O ATOM 0 H1 SER A 1 6.178 49.248 1.159 1.00 25.00 H new ATOM 0 H2 SER A 1 7.077 48.208 0.163 1.00 25.00 H new ATOM 0 H3 SER A 1 6.041 49.361 -0.530 1.00 25.00 H new ATOM 0 HA SER A 1 4.461 47.845 1.215 1.00 25.00 H new ATOM 0 HB2 SER A 1 3.312 47.223 -0.938 1.00 25.00 H new ATOM 0 HB3 SER A 1 3.711 48.929 -0.901 1.00 25.00 H new ATOM 0 HG SER A 1 4.189 47.957 -2.854 1.00 25.00 H new ATOM 14 N GLN A 2 4.636 45.331 0.707 1.00 25.00 N ATOM 15 CA GLN A 2 4.948 43.909 0.759 1.00 25.00 C ATOM 16 C GLN A 2 3.700 43.136 0.348 1.00 25.00 C ATOM 17 O GLN A 2 2.591 43.580 0.632 1.00 25.00 O ATOM 18 CB GLN A 2 5.392 43.500 2.174 1.00 25.00 C ATOM 19 CG GLN A 2 4.356 43.805 3.269 1.00 25.00 C ATOM 20 CD GLN A 2 4.826 43.398 4.644 1.00 25.00 C ATOM 21 OE1 GLN A 2 5.926 43.717 5.056 1.00 25.00 O ATOM 22 NE2 GLN A 2 3.986 42.706 5.367 1.00 25.00 N ATOM 0 H GLN A 2 3.687 45.559 1.002 1.00 25.00 H new ATOM 0 HA GLN A 2 5.770 43.684 0.080 1.00 25.00 H new ATOM 0 HB2 GLN A 2 5.608 42.432 2.181 1.00 25.00 H new ATOM 0 HB3 GLN A 2 6.322 44.015 2.415 1.00 25.00 H new ATOM 0 HG2 GLN A 2 4.134 44.872 3.266 1.00 25.00 H new ATOM 0 HG3 GLN A 2 3.426 43.285 3.039 1.00 25.00 H new ATOM 0 HE21 GLN A 2 3.072 42.457 4.988 1.00 25.00 H new ATOM 0 HE22 GLN A 2 4.244 42.415 6.310 1.00 25.00 H new ATOM 31 N GLN A 3 3.888 42.002 -0.318 1.00 25.00 N ATOM 32 CA GLN A 3 2.774 41.137 -0.730 1.00 25.00 C ATOM 33 C GLN A 3 3.273 39.776 -1.210 1.00 25.00 C ATOM 34 O GLN A 3 2.847 38.745 -0.708 1.00 25.00 O ATOM 35 CB GLN A 3 1.978 41.769 -1.888 1.00 25.00 C ATOM 36 CG GLN A 3 0.522 42.086 -1.553 1.00 25.00 C ATOM 37 CD GLN A 3 -0.233 40.897 -0.977 1.00 25.00 C ATOM 38 OE1 GLN A 3 -0.797 40.983 0.100 1.00 25.00 O ATOM 39 NE2 GLN A 3 -0.252 39.799 -1.686 1.00 25.00 N ATOM 0 H GLN A 3 4.807 41.653 -0.589 1.00 25.00 H new ATOM 0 HA GLN A 3 2.139 41.017 0.148 1.00 25.00 H new ATOM 0 HB2 GLN A 3 2.476 42.689 -2.196 1.00 25.00 H new ATOM 0 HB3 GLN A 3 2.003 41.092 -2.742 1.00 25.00 H new ATOM 0 HG2 GLN A 3 0.491 42.909 -0.838 1.00 25.00 H new ATOM 0 HG3 GLN A 3 0.015 42.428 -2.455 1.00 25.00 H new ATOM 0 HE21 GLN A 3 0.231 39.763 -2.583 1.00 25.00 H new ATOM 0 HE22 GLN A 3 -0.750 38.978 -1.342 1.00 25.00 H new ATOM 48 N SER A 4 4.155 39.812 -2.210 1.00 25.00 N ATOM 49 CA SER A 4 4.653 38.616 -2.917 1.00 25.00 C ATOM 50 C SER A 4 3.510 37.902 -3.666 1.00 25.00 C ATOM 51 O SER A 4 2.349 38.336 -3.622 1.00 25.00 O ATOM 52 CB SER A 4 5.376 37.654 -1.961 1.00 25.00 C ATOM 53 OG SER A 4 6.200 36.752 -2.682 1.00 25.00 O ATOM 0 H SER A 4 4.553 40.683 -2.562 1.00 25.00 H new ATOM 0 HA SER A 4 5.382 38.950 -3.655 1.00 25.00 H new ATOM 0 HB2 SER A 4 5.982 38.222 -1.255 1.00 25.00 H new ATOM 0 HB3 SER A 4 4.644 37.097 -1.376 1.00 25.00 H new ATOM 0 HG SER A 4 6.652 36.150 -2.055 1.00 25.00 H new ATOM 59 N HIS A 5 3.850 36.849 -4.396 1.00 25.00 N ATOM 60 CA HIS A 5 2.878 36.087 -5.175 1.00 25.00 C ATOM 61 C HIS A 5 3.504 34.737 -5.502 1.00 25.00 C ATOM 62 O HIS A 5 4.709 34.663 -5.702 1.00 25.00 O ATOM 63 CB HIS A 5 2.551 36.829 -6.478 1.00 25.00 C ATOM 64 CG HIS A 5 1.215 36.471 -7.054 1.00 25.00 C ATOM 65 ND1 HIS A 5 0.026 37.004 -6.625 1.00 25.00 N ATOM 66 CD2 HIS A 5 0.879 35.618 -8.060 1.00 25.00 C ATOM 67 CE1 HIS A 5 -0.953 36.481 -7.356 1.00 25.00 C ATOM 68 NE2 HIS A 5 -0.492 35.628 -8.248 1.00 25.00 N ATOM 0 H HIS A 5 4.805 36.498 -4.466 1.00 25.00 H new ATOM 0 HA HIS A 5 1.955 35.960 -4.609 1.00 25.00 H new ATOM 0 HB2 HIS A 5 2.581 37.903 -6.292 1.00 25.00 H new ATOM 0 HB3 HIS A 5 3.325 36.611 -7.214 1.00 25.00 H new ATOM 0 HD2 HIS A 5 1.578 35.022 -8.627 1.00 25.00 H new ATOM 0 HE1 HIS A 5 -1.998 36.725 -7.234 1.00 25.00 H new ATOM 0 HE2 HIS A 5 -1.029 35.091 -8.929 1.00 25.00 H new ATOM 76 N SER A 6 2.703 33.686 -5.574 1.00 25.00 N ATOM 77 CA SER A 6 3.205 32.379 -5.991 1.00 25.00 C ATOM 78 C SER A 6 3.217 32.379 -7.511 1.00 25.00 C ATOM 79 O SER A 6 2.240 32.799 -8.126 1.00 25.00 O ATOM 80 CB SER A 6 2.287 31.273 -5.484 1.00 25.00 C ATOM 81 OG SER A 6 2.204 31.307 -4.070 1.00 25.00 O ATOM 0 H SER A 6 1.708 33.708 -5.351 1.00 25.00 H new ATOM 0 HA SER A 6 4.201 32.200 -5.586 1.00 25.00 H new ATOM 0 HB2 SER A 6 1.293 31.391 -5.916 1.00 25.00 H new ATOM 0 HB3 SER A 6 2.663 30.303 -5.809 1.00 25.00 H new ATOM 0 HG SER A 6 1.610 30.592 -3.760 1.00 25.00 H new ATOM 87 N SER A 7 4.307 31.944 -8.123 1.00 25.00 N ATOM 88 CA SER A 7 4.413 31.964 -9.581 1.00 25.00 C ATOM 89 C SER A 7 5.261 30.806 -10.095 1.00 25.00 C ATOM 90 O SER A 7 6.332 30.541 -9.556 1.00 25.00 O ATOM 91 CB SER A 7 5.060 33.278 -10.038 1.00 25.00 C ATOM 92 OG SER A 7 5.157 33.340 -11.453 1.00 25.00 O ATOM 0 H SER A 7 5.127 31.575 -7.641 1.00 25.00 H new ATOM 0 HA SER A 7 3.405 31.871 -9.984 1.00 25.00 H new ATOM 0 HB2 SER A 7 4.472 34.121 -9.674 1.00 25.00 H new ATOM 0 HB3 SER A 7 6.053 33.369 -9.599 1.00 25.00 H new ATOM 0 HG SER A 7 5.829 32.698 -11.763 1.00 25.00 H new ATOM 98 N PRO A 8 4.825 30.143 -11.183 1.00 25.00 N ATOM 99 CA PRO A 8 5.735 29.166 -11.784 1.00 25.00 C ATOM 100 C PRO A 8 6.877 29.891 -12.493 1.00 25.00 C ATOM 101 O PRO A 8 6.866 31.119 -12.617 1.00 25.00 O ATOM 102 CB PRO A 8 4.837 28.438 -12.784 1.00 25.00 C ATOM 103 CG PRO A 8 3.887 29.487 -13.223 1.00 25.00 C ATOM 104 CD PRO A 8 3.581 30.267 -11.969 1.00 25.00 C ATOM 0 HA PRO A 8 6.202 28.491 -11.067 1.00 25.00 H new ATOM 0 HB2 PRO A 8 5.410 28.039 -13.621 1.00 25.00 H new ATOM 0 HB3 PRO A 8 4.321 27.597 -12.322 1.00 25.00 H new ATOM 0 HG2 PRO A 8 4.326 30.125 -13.990 1.00 25.00 H new ATOM 0 HG3 PRO A 8 2.984 29.051 -13.650 1.00 25.00 H new ATOM 0 HD2 PRO A 8 3.346 31.308 -12.190 1.00 25.00 H new ATOM 0 HD3 PRO A 8 2.725 29.853 -11.436 1.00 25.00 H new ATOM 112 N GLY A 9 7.848 29.137 -12.989 1.00 25.00 N ATOM 113 CA GLY A 9 8.965 29.755 -13.691 1.00 25.00 C ATOM 114 C GLY A 9 10.057 28.793 -14.106 1.00 25.00 C ATOM 115 O GLY A 9 10.793 29.056 -15.044 1.00 25.00 O ATOM 0 H GLY A 9 7.887 28.120 -12.922 1.00 25.00 H new ATOM 0 HA2 GLY A 9 8.585 30.258 -14.580 1.00 25.00 H new ATOM 0 HA3 GLY A 9 9.399 30.523 -13.051 1.00 25.00 H new ATOM 119 N GLU A 10 10.159 27.690 -13.374 1.00 25.00 N ATOM 120 CA GLU A 10 11.159 26.641 -13.616 1.00 25.00 C ATOM 121 C GLU A 10 12.608 27.122 -13.525 1.00 25.00 C ATOM 122 O GLU A 10 13.547 26.463 -13.966 1.00 25.00 O ATOM 123 CB GLU A 10 10.874 25.928 -14.947 1.00 25.00 C ATOM 124 CG GLU A 10 10.835 24.406 -14.825 1.00 25.00 C ATOM 125 CD GLU A 10 9.628 23.901 -14.031 1.00 25.00 C ATOM 126 OE1 GLU A 10 8.695 24.693 -13.754 1.00 25.00 O ATOM 127 OE2 GLU A 10 9.628 22.708 -13.664 1.00 25.00 O ATOM 0 H GLU A 10 9.545 27.491 -12.584 1.00 25.00 H new ATOM 0 HA GLU A 10 11.056 25.925 -12.801 1.00 25.00 H new ATOM 0 HB2 GLU A 10 9.920 26.278 -15.341 1.00 25.00 H new ATOM 0 HB3 GLU A 10 11.639 26.207 -15.671 1.00 25.00 H new ATOM 0 HG2 GLU A 10 10.816 23.967 -15.823 1.00 25.00 H new ATOM 0 HG3 GLU A 10 11.750 24.062 -14.343 1.00 25.00 H new ATOM 134 N ILE A 11 12.774 28.230 -12.819 1.00 25.00 N ATOM 135 CA ILE A 11 14.056 28.808 -12.484 1.00 25.00 C ATOM 136 C ILE A 11 14.710 28.034 -11.335 1.00 25.00 C ATOM 137 O ILE A 11 15.636 28.495 -10.686 1.00 25.00 O ATOM 138 CB ILE A 11 13.869 30.292 -12.072 1.00 25.00 C ATOM 139 CG1 ILE A 11 12.512 30.855 -12.579 1.00 25.00 C ATOM 140 CG2 ILE A 11 14.986 31.084 -12.657 1.00 25.00 C ATOM 141 CD1 ILE A 11 12.267 32.312 -12.249 1.00 25.00 C ATOM 0 H ILE A 11 11.988 28.767 -12.453 1.00 25.00 H new ATOM 0 HA ILE A 11 14.704 28.751 -13.359 1.00 25.00 H new ATOM 0 HB ILE A 11 13.872 30.361 -10.984 1.00 25.00 H new ATOM 0 HG12 ILE A 11 12.463 30.729 -13.661 1.00 25.00 H new ATOM 0 HG13 ILE A 11 11.705 30.259 -12.152 1.00 25.00 H new ATOM 0 HG21 ILE A 11 14.874 32.132 -12.379 1.00 25.00 H new ATOM 0 HG22 ILE A 11 15.936 30.708 -12.278 1.00 25.00 H new ATOM 0 HG23 ILE A 11 14.967 30.993 -13.743 1.00 25.00 H new ATOM 0 HD11 ILE A 11 11.297 32.616 -12.642 1.00 25.00 H new ATOM 0 HD12 ILE A 11 12.279 32.447 -11.167 1.00 25.00 H new ATOM 0 HD13 ILE A 11 13.049 32.924 -12.699 1.00 25.00 H new ATOM 153 N THR A 12 14.214 26.826 -11.123 1.00 25.00 N ATOM 154 CA THR A 12 14.729 25.916 -10.110 1.00 25.00 C ATOM 155 C THR A 12 16.125 25.434 -10.495 1.00 25.00 C ATOM 156 O THR A 12 16.887 24.953 -9.659 1.00 25.00 O ATOM 157 CB THR A 12 13.799 24.695 -10.006 1.00 25.00 C ATOM 158 OG1 THR A 12 13.625 24.135 -11.310 1.00 25.00 O ATOM 159 CG2 THR A 12 12.421 25.095 -9.492 1.00 25.00 C ATOM 0 H THR A 12 13.433 26.444 -11.656 1.00 25.00 H new ATOM 0 HA THR A 12 14.776 26.441 -9.156 1.00 25.00 H new ATOM 0 HB THR A 12 14.251 23.982 -9.317 1.00 25.00 H new ATOM 0 HG1 THR A 12 13.035 23.355 -11.255 1.00 25.00 H new ATOM 0 HG21 THR A 12 11.786 24.212 -9.429 1.00 25.00 H new ATOM 0 HG22 THR A 12 12.518 25.544 -8.503 1.00 25.00 H new ATOM 0 HG23 THR A 12 11.973 25.816 -10.176 1.00 25.00 H new ATOM 167 N SER A 13 16.467 25.584 -11.768 1.00 25.00 N ATOM 168 CA SER A 13 17.804 25.255 -12.247 1.00 25.00 C ATOM 169 C SER A 13 18.696 26.486 -12.197 1.00 25.00 C ATOM 170 O SER A 13 18.562 27.396 -13.012 1.00 25.00 O ATOM 171 CB SER A 13 17.750 24.744 -13.672 1.00 25.00 C ATOM 172 OG SER A 13 16.982 23.557 -13.749 1.00 25.00 O ATOM 0 H SER A 13 15.836 25.932 -12.489 1.00 25.00 H new ATOM 0 HA SER A 13 18.212 24.477 -11.601 1.00 25.00 H new ATOM 0 HB2 SER A 13 17.317 25.506 -14.321 1.00 25.00 H new ATOM 0 HB3 SER A 13 18.760 24.554 -14.034 1.00 25.00 H new ATOM 0 HG SER A 13 16.957 23.243 -14.677 1.00 25.00 H new ATOM 178 N SER A 14 19.626 26.486 -11.258 1.00 25.00 N ATOM 179 CA SER A 14 20.563 27.604 -11.073 1.00 25.00 C ATOM 180 C SER A 14 22.019 27.196 -11.346 1.00 25.00 C ATOM 181 O SER A 14 22.834 27.120 -10.424 1.00 25.00 O ATOM 182 CB SER A 14 20.431 28.142 -9.645 1.00 25.00 C ATOM 183 OG SER A 14 19.066 28.283 -9.297 1.00 25.00 O ATOM 0 H SER A 14 19.761 25.719 -10.600 1.00 25.00 H new ATOM 0 HA SER A 14 20.306 28.379 -11.795 1.00 25.00 H new ATOM 0 HB2 SER A 14 20.923 27.465 -8.947 1.00 25.00 H new ATOM 0 HB3 SER A 14 20.935 29.105 -9.564 1.00 25.00 H new ATOM 0 HG SER A 14 18.996 28.626 -8.382 1.00 25.00 H new ATOM 189 N PRO A 15 22.378 26.937 -12.620 1.00 25.00 N ATOM 190 CA PRO A 15 23.754 26.469 -12.838 1.00 25.00 C ATOM 191 C PRO A 15 24.814 27.518 -12.556 1.00 25.00 C ATOM 192 O PRO A 15 25.946 27.188 -12.231 1.00 25.00 O ATOM 193 CB PRO A 15 23.749 26.083 -14.318 1.00 25.00 C ATOM 194 CG PRO A 15 22.723 26.962 -14.926 1.00 25.00 C ATOM 195 CD PRO A 15 21.633 27.009 -13.891 1.00 25.00 C ATOM 0 HA PRO A 15 24.013 25.657 -12.159 1.00 25.00 H new ATOM 0 HB2 PRO A 15 24.727 26.241 -14.773 1.00 25.00 H new ATOM 0 HB3 PRO A 15 23.501 25.030 -14.453 1.00 25.00 H new ATOM 0 HG2 PRO A 15 23.120 27.956 -15.135 1.00 25.00 H new ATOM 0 HG3 PRO A 15 22.360 26.559 -15.871 1.00 25.00 H new ATOM 0 HD2 PRO A 15 21.047 27.925 -13.964 1.00 25.00 H new ATOM 0 HD3 PRO A 15 20.938 26.176 -13.999 1.00 25.00 H new ATOM 203 N GLN A 16 24.425 28.782 -12.621 1.00 25.00 N ATOM 204 CA GLN A 16 25.340 29.889 -12.341 1.00 25.00 C ATOM 205 C GLN A 16 25.885 29.799 -10.922 1.00 25.00 C ATOM 206 O GLN A 16 27.015 30.178 -10.668 1.00 25.00 O ATOM 207 CB GLN A 16 24.630 31.236 -12.509 1.00 25.00 C ATOM 208 CG GLN A 16 24.046 31.452 -13.893 1.00 25.00 C ATOM 209 CD GLN A 16 23.550 32.876 -14.097 1.00 25.00 C ATOM 210 OE1 GLN A 16 24.009 33.577 -14.981 1.00 25.00 O ATOM 211 NE2 GLN A 16 22.615 33.300 -13.284 1.00 25.00 N ATOM 0 H GLN A 16 23.478 29.072 -12.866 1.00 25.00 H new ATOM 0 HA GLN A 16 26.163 29.817 -13.052 1.00 25.00 H new ATOM 0 HB2 GLN A 16 23.830 31.309 -11.772 1.00 25.00 H new ATOM 0 HB3 GLN A 16 25.336 32.038 -12.294 1.00 25.00 H new ATOM 0 HG2 GLN A 16 24.802 31.223 -14.644 1.00 25.00 H new ATOM 0 HG3 GLN A 16 23.221 30.757 -14.049 1.00 25.00 H new ATOM 0 HE21 GLN A 16 22.255 32.684 -12.555 1.00 25.00 H new ATOM 0 HE22 GLN A 16 22.247 34.246 -13.380 1.00 25.00 H new ATOM 220 N GLY A 17 25.084 29.283 -10.000 1.00 25.00 N ATOM 221 CA GLY A 17 25.528 29.174 -8.626 1.00 25.00 C ATOM 222 C GLY A 17 26.266 27.882 -8.340 1.00 25.00 C ATOM 223 O GLY A 17 27.097 27.818 -7.439 1.00 25.00 O ATOM 0 H GLY A 17 24.140 28.940 -10.178 1.00 25.00 H new ATOM 0 HA2 GLY A 17 26.179 30.016 -8.393 1.00 25.00 H new ATOM 0 HA3 GLY A 17 24.665 29.246 -7.965 1.00 25.00 H new ATOM 227 N LEU A 18 25.952 26.843 -9.099 1.00 25.00 N ATOM 228 CA LEU A 18 26.579 25.537 -8.882 1.00 25.00 C ATOM 229 C LEU A 18 27.996 25.503 -9.433 1.00 25.00 C ATOM 230 O LEU A 18 28.894 24.923 -8.839 1.00 25.00 O ATOM 231 CB LEU A 18 25.777 24.433 -9.582 1.00 25.00 C ATOM 232 CG LEU A 18 24.336 24.224 -9.111 1.00 25.00 C ATOM 233 CD1 LEU A 18 23.642 23.220 -10.028 1.00 25.00 C ATOM 234 CD2 LEU A 18 24.289 23.721 -7.664 1.00 25.00 C ATOM 0 H LEU A 18 25.276 26.871 -9.863 1.00 25.00 H new ATOM 0 HA LEU A 18 26.600 25.371 -7.805 1.00 25.00 H new ATOM 0 HB2 LEU A 18 25.757 24.652 -10.650 1.00 25.00 H new ATOM 0 HB3 LEU A 18 26.314 23.493 -9.459 1.00 25.00 H new ATOM 0 HG LEU A 18 23.820 25.184 -9.151 1.00 25.00 H new ATOM 0 HD11 LEU A 18 22.616 23.071 -9.693 1.00 25.00 H new ATOM 0 HD12 LEU A 18 23.639 23.602 -11.049 1.00 25.00 H new ATOM 0 HD13 LEU A 18 24.176 22.270 -9.997 1.00 25.00 H new ATOM 0 HD21 LEU A 18 23.251 23.583 -7.360 1.00 25.00 H new ATOM 0 HD22 LEU A 18 24.818 22.771 -7.592 1.00 25.00 H new ATOM 0 HD23 LEU A 18 24.764 24.451 -7.009 1.00 25.00 H new ATOM 246 N ASP A 19 28.150 26.075 -10.614 1.00 25.00 N ATOM 247 CA ASP A 19 29.404 26.007 -11.362 1.00 25.00 C ATOM 248 C ASP A 19 30.326 27.140 -10.959 1.00 25.00 C ATOM 249 O ASP A 19 31.546 27.023 -10.980 1.00 25.00 O ATOM 250 CB ASP A 19 29.097 26.128 -12.851 1.00 25.00 C ATOM 251 CG ASP A 19 30.276 25.738 -13.728 1.00 25.00 C ATOM 252 OD1 ASP A 19 30.517 26.437 -14.740 1.00 25.00 O ATOM 253 OD2 ASP A 19 30.916 24.699 -13.450 1.00 25.00 O ATOM 0 H ASP A 19 27.414 26.600 -11.086 1.00 25.00 H new ATOM 0 HA ASP A 19 29.894 25.058 -11.146 1.00 25.00 H new ATOM 0 HB2 ASP A 19 28.244 25.495 -13.094 1.00 25.00 H new ATOM 0 HB3 ASP A 19 28.807 27.154 -13.075 1.00 25.00 H new ATOM 258 N ASN A 20 29.721 28.250 -10.570 1.00 25.00 N ATOM 259 CA ASN A 20 30.463 29.425 -10.146 1.00 25.00 C ATOM 260 C ASN A 20 30.146 29.740 -8.679 1.00 25.00 C ATOM 261 O ASN A 20 29.281 30.572 -8.373 1.00 25.00 O ATOM 262 CB ASN A 20 30.132 30.607 -11.061 1.00 25.00 C ATOM 263 CG ASN A 20 31.294 31.022 -11.910 1.00 25.00 C ATOM 264 OD1 ASN A 20 32.412 31.158 -11.435 1.00 25.00 O ATOM 265 ND2 ASN A 20 31.030 31.270 -13.158 1.00 25.00 N ATOM 0 H ASN A 20 28.708 28.362 -10.539 1.00 25.00 H new ATOM 0 HA ASN A 20 31.533 29.232 -10.223 1.00 25.00 H new ATOM 0 HB2 ASN A 20 29.294 30.340 -11.705 1.00 25.00 H new ATOM 0 HB3 ASN A 20 29.810 31.453 -10.453 1.00 25.00 H new ATOM 0 HD21 ASN A 20 31.770 31.591 -13.782 1.00 25.00 H new ATOM 0 HD22 ASN A 20 30.083 31.143 -13.514 1.00 25.00 H new ATOM 272 N PRO A 21 30.878 29.112 -7.737 1.00 25.00 N ATOM 273 CA PRO A 21 30.652 29.431 -6.322 1.00 25.00 C ATOM 274 C PRO A 21 30.917 30.893 -6.007 1.00 25.00 C ATOM 275 O PRO A 21 30.389 31.423 -5.043 1.00 25.00 O ATOM 276 CB PRO A 21 31.676 28.540 -5.599 1.00 25.00 C ATOM 277 CG PRO A 21 32.695 28.258 -6.591 1.00 25.00 C ATOM 278 CD PRO A 21 31.949 28.112 -7.878 1.00 25.00 C ATOM 0 HA PRO A 21 29.618 29.258 -6.024 1.00 25.00 H new ATOM 0 HB2 PRO A 21 32.099 29.048 -4.732 1.00 25.00 H new ATOM 0 HB3 PRO A 21 31.214 27.622 -5.236 1.00 25.00 H new ATOM 0 HG2 PRO A 21 33.426 29.065 -6.647 1.00 25.00 H new ATOM 0 HG3 PRO A 21 33.243 27.348 -6.347 1.00 25.00 H new ATOM 0 HD2 PRO A 21 32.583 28.315 -8.741 1.00 25.00 H new ATOM 0 HD3 PRO A 21 31.551 27.105 -8.005 1.00 25.00 H new ATOM 286 N ALA A 22 31.718 31.555 -6.832 1.00 25.00 N ATOM 287 CA ALA A 22 32.015 32.966 -6.643 1.00 25.00 C ATOM 288 C ALA A 22 30.732 33.793 -6.730 1.00 25.00 C ATOM 289 O ALA A 22 30.508 34.690 -5.917 1.00 25.00 O ATOM 290 CB ALA A 22 33.025 33.425 -7.696 1.00 25.00 C ATOM 0 H ALA A 22 32.174 31.134 -7.641 1.00 25.00 H new ATOM 0 HA ALA A 22 32.448 33.112 -5.653 1.00 25.00 H new ATOM 0 HB1 ALA A 22 33.246 34.483 -7.552 1.00 25.00 H new ATOM 0 HB2 ALA A 22 33.943 32.846 -7.596 1.00 25.00 H new ATOM 0 HB3 ALA A 22 32.607 33.274 -8.691 1.00 25.00 H new ATOM 296 N LEU A 23 29.896 33.473 -7.708 1.00 25.00 N ATOM 297 CA LEU A 23 28.649 34.197 -7.928 1.00 25.00 C ATOM 298 C LEU A 23 27.638 33.867 -6.841 1.00 25.00 C ATOM 299 O LEU A 23 26.946 34.744 -6.347 1.00 25.00 O ATOM 300 CB LEU A 23 28.056 33.842 -9.298 1.00 25.00 C ATOM 301 CG LEU A 23 28.901 34.194 -10.533 1.00 25.00 C ATOM 302 CD1 LEU A 23 28.157 33.737 -11.788 1.00 25.00 C ATOM 303 CD2 LEU A 23 29.203 35.684 -10.622 1.00 25.00 C ATOM 0 H LEU A 23 30.059 32.711 -8.367 1.00 25.00 H new ATOM 0 HA LEU A 23 28.871 35.264 -7.897 1.00 25.00 H new ATOM 0 HB2 LEU A 23 27.860 32.770 -9.315 1.00 25.00 H new ATOM 0 HB3 LEU A 23 27.093 34.344 -9.391 1.00 25.00 H new ATOM 0 HG LEU A 23 29.858 33.680 -10.446 1.00 25.00 H new ATOM 0 HD11 LEU A 23 28.748 33.982 -12.671 1.00 25.00 H new ATOM 0 HD12 LEU A 23 27.999 32.659 -11.745 1.00 25.00 H new ATOM 0 HD13 LEU A 23 27.193 34.243 -11.844 1.00 25.00 H new ATOM 0 HD21 LEU A 23 29.802 35.881 -11.511 1.00 25.00 H new ATOM 0 HD22 LEU A 23 28.268 36.242 -10.683 1.00 25.00 H new ATOM 0 HD23 LEU A 23 29.755 35.997 -9.736 1.00 25.00 H new ATOM 315 N LEU A 24 27.562 32.601 -6.455 1.00 25.00 N ATOM 316 CA LEU A 24 26.615 32.201 -5.416 1.00 25.00 C ATOM 317 C LEU A 24 26.988 32.825 -4.081 1.00 25.00 C ATOM 318 O LEU A 24 26.128 33.302 -3.363 1.00 25.00 O ATOM 319 CB LEU A 24 26.552 30.678 -5.289 1.00 25.00 C ATOM 320 CG LEU A 24 25.499 30.104 -4.318 1.00 25.00 C ATOM 321 CD1 LEU A 24 24.127 30.783 -4.419 1.00 25.00 C ATOM 322 CD2 LEU A 24 25.335 28.621 -4.599 1.00 25.00 C ATOM 0 H LEU A 24 28.131 31.844 -6.835 1.00 25.00 H new ATOM 0 HA LEU A 24 25.628 32.562 -5.706 1.00 25.00 H new ATOM 0 HB2 LEU A 24 26.364 30.262 -6.279 1.00 25.00 H new ATOM 0 HB3 LEU A 24 27.533 30.322 -4.975 1.00 25.00 H new ATOM 0 HG LEU A 24 25.866 30.290 -3.309 1.00 25.00 H new ATOM 0 HD11 LEU A 24 23.441 30.325 -3.706 1.00 25.00 H new ATOM 0 HD12 LEU A 24 24.229 31.845 -4.194 1.00 25.00 H new ATOM 0 HD13 LEU A 24 23.735 30.662 -5.429 1.00 25.00 H new ATOM 0 HD21 LEU A 24 24.593 28.202 -3.919 1.00 25.00 H new ATOM 0 HD22 LEU A 24 25.005 28.480 -5.628 1.00 25.00 H new ATOM 0 HD23 LEU A 24 26.289 28.115 -4.451 1.00 25.00 H new ATOM 334 N ARG A 25 28.278 32.870 -3.774 1.00 25.00 N ATOM 335 CA ARG A 25 28.760 33.518 -2.557 1.00 25.00 C ATOM 336 C ARG A 25 28.334 34.977 -2.572 1.00 25.00 C ATOM 337 O ARG A 25 27.880 35.498 -1.570 1.00 25.00 O ATOM 338 CB ARG A 25 30.290 33.415 -2.511 1.00 25.00 C ATOM 339 CG ARG A 25 30.955 34.061 -1.293 1.00 25.00 C ATOM 340 CD ARG A 25 32.350 34.556 -1.634 1.00 25.00 C ATOM 341 NE ARG A 25 32.280 35.593 -2.676 1.00 25.00 N ATOM 342 CZ ARG A 25 33.184 36.538 -2.901 1.00 25.00 C ATOM 343 NH1 ARG A 25 34.288 36.639 -2.196 1.00 25.00 N ATOM 344 NH2 ARG A 25 32.964 37.404 -3.852 1.00 25.00 N ATOM 0 H ARG A 25 29.014 32.464 -4.353 1.00 25.00 H new ATOM 0 HA ARG A 25 28.341 33.032 -1.676 1.00 25.00 H new ATOM 0 HB2 ARG A 25 30.567 32.361 -2.539 1.00 25.00 H new ATOM 0 HB3 ARG A 25 30.696 33.875 -3.412 1.00 25.00 H new ATOM 0 HG2 ARG A 25 30.346 34.893 -0.940 1.00 25.00 H new ATOM 0 HG3 ARG A 25 31.010 33.339 -0.478 1.00 25.00 H new ATOM 0 HD2 ARG A 25 32.829 34.958 -0.742 1.00 25.00 H new ATOM 0 HD3 ARG A 25 32.965 33.725 -1.979 1.00 25.00 H new ATOM 0 HE ARG A 25 31.460 35.585 -3.282 1.00 25.00 H new ATOM 0 HH11 ARG A 25 34.475 35.976 -1.444 1.00 25.00 H new ATOM 0 HH12 ARG A 25 34.958 37.380 -2.401 1.00 25.00 H new ATOM 0 HH21 ARG A 25 32.110 37.347 -4.406 1.00 25.00 H new ATOM 0 HH22 ARG A 25 33.646 38.138 -4.041 1.00 25.00 H new ATOM 358 N ASP A 26 28.487 35.630 -3.711 1.00 25.00 N ATOM 359 CA ASP A 26 28.157 37.049 -3.824 1.00 25.00 C ATOM 360 C ASP A 26 26.657 37.289 -3.644 1.00 25.00 C ATOM 361 O ASP A 26 26.242 38.156 -2.878 1.00 25.00 O ATOM 362 CB ASP A 26 28.617 37.580 -5.179 1.00 25.00 C ATOM 363 CG ASP A 26 28.856 39.068 -5.163 1.00 25.00 C ATOM 364 OD1 ASP A 26 29.649 39.520 -4.307 1.00 25.00 O ATOM 365 OD2 ASP A 26 28.340 39.772 -6.051 1.00 25.00 O ATOM 0 H ASP A 26 28.836 35.206 -4.571 1.00 25.00 H new ATOM 0 HA ASP A 26 28.677 37.584 -3.029 1.00 25.00 H new ATOM 0 HB2 ASP A 26 29.535 37.071 -5.473 1.00 25.00 H new ATOM 0 HB3 ASP A 26 27.866 37.344 -5.933 1.00 25.00 H new ATOM 370 N MET A 27 25.842 36.472 -4.303 1.00 25.00 N ATOM 371 CA MET A 27 24.384 36.575 -4.187 1.00 25.00 C ATOM 372 C MET A 27 23.944 36.322 -2.758 1.00 25.00 C ATOM 373 O MET A 27 23.080 37.007 -2.236 1.00 25.00 O ATOM 374 CB MET A 27 23.707 35.560 -5.110 1.00 25.00 C ATOM 375 CG MET A 27 22.201 35.746 -5.205 1.00 25.00 C ATOM 376 SD MET A 27 21.423 34.552 -6.314 1.00 25.00 S ATOM 377 CE MET A 27 21.169 33.141 -5.206 1.00 25.00 C ATOM 0 H MET A 27 26.163 35.729 -4.924 1.00 25.00 H new ATOM 0 HA MET A 27 24.091 37.584 -4.478 1.00 25.00 H new ATOM 0 HB2 MET A 27 24.140 35.641 -6.107 1.00 25.00 H new ATOM 0 HB3 MET A 27 23.920 34.553 -4.750 1.00 25.00 H new ATOM 0 HG2 MET A 27 21.764 35.652 -4.211 1.00 25.00 H new ATOM 0 HG3 MET A 27 21.985 36.756 -5.554 1.00 25.00 H new ATOM 0 HE1 MET A 27 20.696 32.327 -5.756 1.00 25.00 H new ATOM 0 HE2 MET A 27 22.131 32.805 -4.818 1.00 25.00 H new ATOM 0 HE3 MET A 27 20.528 33.440 -4.377 1.00 25.00 H new ATOM 387 N LEU A 28 24.566 35.346 -2.120 1.00 25.00 N ATOM 388 CA LEU A 28 24.257 35.007 -0.740 1.00 25.00 C ATOM 389 C LEU A 28 24.585 36.143 0.210 1.00 25.00 C ATOM 390 O LEU A 28 23.805 36.456 1.093 1.00 25.00 O ATOM 391 CB LEU A 28 25.056 33.788 -0.328 1.00 25.00 C ATOM 392 CG LEU A 28 24.315 32.476 -0.552 1.00 25.00 C ATOM 393 CD1 LEU A 28 25.291 31.340 -0.512 1.00 25.00 C ATOM 394 CD2 LEU A 28 23.269 32.309 0.526 1.00 25.00 C ATOM 0 H LEU A 28 25.295 34.769 -2.540 1.00 25.00 H new ATOM 0 HA LEU A 28 23.187 34.809 -0.683 1.00 25.00 H new ATOM 0 HB2 LEU A 28 25.991 33.769 -0.888 1.00 25.00 H new ATOM 0 HB3 LEU A 28 25.318 33.874 0.727 1.00 25.00 H new ATOM 0 HG LEU A 28 23.826 32.484 -1.526 1.00 25.00 H new ATOM 0 HD11 LEU A 28 24.762 30.400 -0.672 1.00 25.00 H new ATOM 0 HD12 LEU A 28 26.038 31.474 -1.295 1.00 25.00 H new ATOM 0 HD13 LEU A 28 25.784 31.318 0.460 1.00 25.00 H new ATOM 0 HD21 LEU A 28 22.734 31.372 0.372 1.00 25.00 H new ATOM 0 HD22 LEU A 28 23.752 32.295 1.503 1.00 25.00 H new ATOM 0 HD23 LEU A 28 22.565 33.140 0.482 1.00 25.00 H new ATOM 406 N LEU A 29 25.738 36.764 0.019 1.00 25.00 N ATOM 407 CA LEU A 29 26.161 37.866 0.885 1.00 25.00 C ATOM 408 C LEU A 29 25.205 39.042 0.731 1.00 25.00 C ATOM 409 O LEU A 29 24.894 39.739 1.695 1.00 25.00 O ATOM 410 CB LEU A 29 27.586 38.314 0.525 1.00 25.00 C ATOM 411 CG LEU A 29 28.713 37.365 0.961 1.00 25.00 C ATOM 412 CD1 LEU A 29 30.002 37.711 0.213 1.00 25.00 C ATOM 413 CD2 LEU A 29 28.954 37.434 2.472 1.00 25.00 C ATOM 0 H LEU A 29 26.398 36.530 -0.722 1.00 25.00 H new ATOM 0 HA LEU A 29 26.149 37.519 1.918 1.00 25.00 H new ATOM 0 HB2 LEU A 29 27.644 38.445 -0.556 1.00 25.00 H new ATOM 0 HB3 LEU A 29 27.764 39.291 0.974 1.00 25.00 H new ATOM 0 HG LEU A 29 28.408 36.348 0.716 1.00 25.00 H new ATOM 0 HD11 LEU A 29 30.797 37.035 0.526 1.00 25.00 H new ATOM 0 HD12 LEU A 29 29.839 37.607 -0.860 1.00 25.00 H new ATOM 0 HD13 LEU A 29 30.289 38.738 0.439 1.00 25.00 H new ATOM 0 HD21 LEU A 29 29.758 36.750 2.744 1.00 25.00 H new ATOM 0 HD22 LEU A 29 29.233 38.450 2.750 1.00 25.00 H new ATOM 0 HD23 LEU A 29 28.043 37.151 2.999 1.00 25.00 H new ATOM 425 N ALA A 30 24.724 39.238 -0.486 1.00 25.00 N ATOM 426 CA ALA A 30 23.785 40.310 -0.789 1.00 25.00 C ATOM 427 C ALA A 30 22.345 39.981 -0.361 1.00 25.00 C ATOM 428 O ALA A 30 21.490 40.866 -0.338 1.00 25.00 O ATOM 429 CB ALA A 30 23.826 40.605 -2.297 1.00 25.00 C ATOM 0 H ALA A 30 24.971 38.662 -1.290 1.00 25.00 H new ATOM 0 HA ALA A 30 24.092 41.186 -0.217 1.00 25.00 H new ATOM 0 HB1 ALA A 30 23.125 41.407 -2.530 1.00 25.00 H new ATOM 0 HB2 ALA A 30 24.833 40.910 -2.581 1.00 25.00 H new ATOM 0 HB3 ALA A 30 23.549 39.708 -2.851 1.00 25.00 H new ATOM 435 N ASN A 31 22.061 38.718 -0.064 1.00 25.00 N ATOM 436 CA ASN A 31 20.693 38.291 0.237 1.00 25.00 C ATOM 437 C ASN A 31 20.519 37.921 1.710 1.00 25.00 C ATOM 438 O ASN A 31 20.838 36.805 2.125 1.00 25.00 O ATOM 439 CB ASN A 31 20.314 37.103 -0.646 1.00 25.00 C ATOM 440 CG ASN A 31 18.839 36.865 -0.681 1.00 25.00 C ATOM 441 OD1 ASN A 31 18.156 36.889 0.344 1.00 25.00 O ATOM 442 ND2 ASN A 31 18.326 36.647 -1.857 1.00 25.00 N ATOM 0 H ASN A 31 22.755 37.971 -0.024 1.00 25.00 H new ATOM 0 HA ASN A 31 20.032 39.132 0.029 1.00 25.00 H new ATOM 0 HB2 ASN A 31 20.675 37.278 -1.660 1.00 25.00 H new ATOM 0 HB3 ASN A 31 20.815 36.207 -0.279 1.00 25.00 H new ATOM 0 HD21 ASN A 31 17.323 36.488 -1.954 1.00 25.00 H new ATOM 0 HD22 ASN A 31 18.927 36.635 -2.681 1.00 25.00 H new ATOM 449 N PRO A 32 19.974 38.845 2.524 1.00 25.00 N ATOM 450 CA PRO A 32 19.878 38.543 3.956 1.00 25.00 C ATOM 451 C PRO A 32 18.933 37.393 4.315 1.00 25.00 C ATOM 452 O PRO A 32 19.092 36.770 5.361 1.00 25.00 O ATOM 453 CB PRO A 32 19.398 39.869 4.551 1.00 25.00 C ATOM 454 CG PRO A 32 18.656 40.520 3.439 1.00 25.00 C ATOM 455 CD PRO A 32 19.469 40.200 2.229 1.00 25.00 C ATOM 0 HA PRO A 32 20.832 38.189 4.346 1.00 25.00 H new ATOM 0 HB2 PRO A 32 18.756 39.708 5.417 1.00 25.00 H new ATOM 0 HB3 PRO A 32 20.235 40.482 4.884 1.00 25.00 H new ATOM 0 HG2 PRO A 32 17.642 40.130 3.353 1.00 25.00 H new ATOM 0 HG3 PRO A 32 18.572 41.596 3.591 1.00 25.00 H new ATOM 0 HD2 PRO A 32 18.867 40.218 1.321 1.00 25.00 H new ATOM 0 HD3 PRO A 32 20.282 40.913 2.087 1.00 25.00 H new ATOM 463 N HIS A 33 17.958 37.101 3.467 1.00 25.00 N ATOM 464 CA HIS A 33 17.030 36.005 3.737 1.00 25.00 C ATOM 465 C HIS A 33 17.675 34.653 3.449 1.00 25.00 C ATOM 466 O HIS A 33 17.542 33.706 4.220 1.00 25.00 O ATOM 467 CB HIS A 33 15.779 36.160 2.867 1.00 25.00 C ATOM 468 CG HIS A 33 14.657 35.255 3.268 1.00 25.00 C ATOM 469 ND1 HIS A 33 13.603 35.635 4.060 1.00 25.00 N ATOM 470 CD2 HIS A 33 14.420 33.946 2.968 1.00 25.00 C ATOM 471 CE1 HIS A 33 12.798 34.587 4.214 1.00 25.00 C ATOM 472 NE2 HIS A 33 13.250 33.530 3.573 1.00 25.00 N ATOM 0 H HIS A 33 17.787 37.600 2.594 1.00 25.00 H new ATOM 0 HA HIS A 33 16.760 36.044 4.792 1.00 25.00 H new ATOM 0 HB2 HIS A 33 15.437 37.194 2.917 1.00 25.00 H new ATOM 0 HB3 HIS A 33 16.042 35.961 1.828 1.00 25.00 H new ATOM 0 HD2 HIS A 33 15.053 33.327 2.350 1.00 25.00 H new ATOM 0 HE1 HIS A 33 11.887 34.602 4.793 1.00 25.00 H new ATOM 0 HE2 HIS A 33 12.827 32.603 3.532 1.00 25.00 H new ATOM 480 N GLU A 34 18.366 34.563 2.325 1.00 25.00 N ATOM 481 CA GLU A 34 18.949 33.300 1.888 1.00 25.00 C ATOM 482 C GLU A 34 20.105 32.950 2.800 1.00 25.00 C ATOM 483 O GLU A 34 20.242 31.827 3.246 1.00 25.00 O ATOM 484 CB GLU A 34 19.437 33.425 0.449 1.00 25.00 C ATOM 485 CG GLU A 34 18.803 32.443 -0.508 1.00 25.00 C ATOM 486 CD GLU A 34 19.244 30.993 -0.267 1.00 25.00 C ATOM 487 OE1 GLU A 34 20.453 30.751 -0.075 1.00 25.00 O ATOM 488 OE2 GLU A 34 18.374 30.099 -0.259 1.00 25.00 O ATOM 0 H GLU A 34 18.538 35.348 1.697 1.00 25.00 H new ATOM 0 HA GLU A 34 18.197 32.512 1.934 1.00 25.00 H new ATOM 0 HB2 GLU A 34 19.239 34.437 0.097 1.00 25.00 H new ATOM 0 HB3 GLU A 34 20.518 33.287 0.431 1.00 25.00 H new ATOM 0 HG2 GLU A 34 17.719 32.506 -0.417 1.00 25.00 H new ATOM 0 HG3 GLU A 34 19.055 32.727 -1.530 1.00 25.00 H new ATOM 495 N LEU A 35 20.899 33.948 3.146 1.00 25.00 N ATOM 496 CA LEU A 35 22.028 33.733 4.033 1.00 25.00 C ATOM 497 C LEU A 35 21.551 33.260 5.408 1.00 25.00 C ATOM 498 O LEU A 35 22.259 32.540 6.104 1.00 25.00 O ATOM 499 CB LEU A 35 22.887 34.992 4.072 1.00 25.00 C ATOM 500 CG LEU A 35 22.636 36.166 5.019 1.00 25.00 C ATOM 501 CD1 LEU A 35 22.903 35.883 6.491 1.00 25.00 C ATOM 502 CD2 LEU A 35 23.559 37.263 4.538 1.00 25.00 C ATOM 0 H LEU A 35 20.784 34.910 2.828 1.00 25.00 H new ATOM 0 HA LEU A 35 22.662 32.931 3.655 1.00 25.00 H new ATOM 0 HB2 LEU A 35 23.907 34.659 4.262 1.00 25.00 H new ATOM 0 HB3 LEU A 35 22.869 35.405 3.063 1.00 25.00 H new ATOM 0 HG LEU A 35 21.577 36.421 4.986 1.00 25.00 H new ATOM 0 HD11 LEU A 35 22.695 36.778 7.077 1.00 25.00 H new ATOM 0 HD12 LEU A 35 22.259 35.071 6.828 1.00 25.00 H new ATOM 0 HD13 LEU A 35 23.947 35.597 6.623 1.00 25.00 H new ATOM 0 HD21 LEU A 35 23.438 38.143 5.169 1.00 25.00 H new ATOM 0 HD22 LEU A 35 24.592 36.919 4.590 1.00 25.00 H new ATOM 0 HD23 LEU A 35 23.314 37.519 3.507 1.00 25.00 H new ATOM 514 N SER A 36 20.343 33.663 5.790 1.00 25.00 N ATOM 515 CA SER A 36 19.743 33.279 7.065 1.00 25.00 C ATOM 516 C SER A 36 19.258 31.833 7.028 1.00 25.00 C ATOM 517 O SER A 36 19.502 31.071 7.952 1.00 25.00 O ATOM 518 CB SER A 36 18.575 34.197 7.429 1.00 25.00 C ATOM 519 OG SER A 36 18.170 33.982 8.774 1.00 25.00 O ATOM 0 H SER A 36 19.750 34.268 5.222 1.00 25.00 H new ATOM 0 HA SER A 36 20.517 33.377 7.826 1.00 25.00 H new ATOM 0 HB2 SER A 36 18.868 35.238 7.294 1.00 25.00 H new ATOM 0 HB3 SER A 36 17.737 34.012 6.757 1.00 25.00 H new ATOM 0 HG SER A 36 17.423 34.579 8.990 1.00 25.00 H new ATOM 525 N LEU A 37 18.603 31.429 5.953 1.00 25.00 N ATOM 526 CA LEU A 37 18.125 30.053 5.860 1.00 25.00 C ATOM 527 C LEU A 37 19.291 29.138 5.732 1.00 25.00 C ATOM 528 O LEU A 37 19.268 28.004 6.171 1.00 25.00 O ATOM 529 CB LEU A 37 17.165 29.886 4.701 1.00 25.00 C ATOM 530 CG LEU A 37 17.532 29.819 3.211 1.00 25.00 C ATOM 531 CD1 LEU A 37 18.114 28.482 2.803 1.00 25.00 C ATOM 532 CD2 LEU A 37 16.252 30.091 2.415 1.00 25.00 C ATOM 0 H LEU A 37 18.391 32.017 5.146 1.00 25.00 H new ATOM 0 HA LEU A 37 17.575 29.803 6.767 1.00 25.00 H new ATOM 0 HB2 LEU A 37 16.616 28.967 4.907 1.00 25.00 H new ATOM 0 HB3 LEU A 37 16.455 30.708 4.790 1.00 25.00 H new ATOM 0 HG LEU A 37 18.305 30.560 3.008 1.00 25.00 H new ATOM 0 HD11 LEU A 37 18.353 28.498 1.740 1.00 25.00 H new ATOM 0 HD12 LEU A 37 19.021 28.290 3.376 1.00 25.00 H new ATOM 0 HD13 LEU A 37 17.387 27.694 3.000 1.00 25.00 H new ATOM 0 HD21 LEU A 37 16.472 30.052 1.348 1.00 25.00 H new ATOM 0 HD22 LEU A 37 15.504 29.336 2.659 1.00 25.00 H new ATOM 0 HD23 LEU A 37 15.868 31.079 2.670 1.00 25.00 H new ATOM 544 N LEU A 38 20.331 29.658 5.131 1.00 25.00 N ATOM 545 CA LEU A 38 21.544 28.918 4.955 1.00 25.00 C ATOM 546 C LEU A 38 22.203 28.603 6.286 1.00 25.00 C ATOM 547 O LEU A 38 22.594 27.477 6.514 1.00 25.00 O ATOM 548 CB LEU A 38 22.465 29.722 4.074 1.00 25.00 C ATOM 549 CG LEU A 38 23.729 28.967 3.648 1.00 25.00 C ATOM 550 CD1 LEU A 38 23.362 27.862 2.685 1.00 25.00 C ATOM 551 CD2 LEU A 38 24.751 29.886 3.025 1.00 25.00 C ATOM 0 H LEU A 38 20.356 30.605 4.752 1.00 25.00 H new ATOM 0 HA LEU A 38 21.319 27.961 4.484 1.00 25.00 H new ATOM 0 HB2 LEU A 38 21.920 30.032 3.182 1.00 25.00 H new ATOM 0 HB3 LEU A 38 22.756 30.630 4.602 1.00 25.00 H new ATOM 0 HG LEU A 38 24.181 28.538 4.542 1.00 25.00 H new ATOM 0 HD11 LEU A 38 24.263 27.327 2.384 1.00 25.00 H new ATOM 0 HD12 LEU A 38 22.674 27.170 3.171 1.00 25.00 H new ATOM 0 HD13 LEU A 38 22.884 28.291 1.804 1.00 25.00 H new ATOM 0 HD21 LEU A 38 25.631 29.310 2.738 1.00 25.00 H new ATOM 0 HD22 LEU A 38 24.323 30.360 2.142 1.00 25.00 H new ATOM 0 HD23 LEU A 38 25.038 30.652 3.745 1.00 25.00 H new ATOM 563 N LYS A 39 22.295 29.567 7.184 1.00 25.00 N ATOM 564 CA LYS A 39 22.860 29.279 8.514 1.00 25.00 C ATOM 565 C LYS A 39 21.935 28.406 9.352 1.00 25.00 C ATOM 566 O LYS A 39 22.408 27.659 10.197 1.00 25.00 O ATOM 567 CB LYS A 39 23.261 30.553 9.274 1.00 25.00 C ATOM 568 CG LYS A 39 22.201 31.648 9.327 1.00 25.00 C ATOM 569 CD LYS A 39 22.561 32.778 10.275 1.00 25.00 C ATOM 570 CE LYS A 39 23.674 33.648 9.698 1.00 25.00 C ATOM 571 NZ LYS A 39 23.962 34.818 10.593 1.00 25.00 N ATOM 0 H LYS A 39 21.999 30.532 7.036 1.00 25.00 H new ATOM 0 HA LYS A 39 23.775 28.713 8.336 1.00 25.00 H new ATOM 0 HB2 LYS A 39 23.525 30.278 10.295 1.00 25.00 H new ATOM 0 HB3 LYS A 39 24.159 30.963 8.812 1.00 25.00 H new ATOM 0 HG2 LYS A 39 22.056 32.054 8.326 1.00 25.00 H new ATOM 0 HG3 LYS A 39 21.251 31.212 9.635 1.00 25.00 H new ATOM 0 HD2 LYS A 39 21.680 33.390 10.467 1.00 25.00 H new ATOM 0 HD3 LYS A 39 22.878 32.366 11.233 1.00 25.00 H new ATOM 0 HE2 LYS A 39 24.578 33.052 9.571 1.00 25.00 H new ATOM 0 HE3 LYS A 39 23.386 34.005 8.709 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 24.722 35.394 10.178 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 23.104 35.398 10.693 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 24.259 34.475 11.529 1.00 25.00 H new ATOM 585 N GLU A 40 20.642 28.455 9.086 1.00 25.00 N ATOM 586 CA GLU A 40 19.701 27.585 9.790 1.00 25.00 C ATOM 587 C GLU A 40 19.790 26.147 9.282 1.00 25.00 C ATOM 588 O GLU A 40 19.875 25.202 10.060 1.00 25.00 O ATOM 589 CB GLU A 40 18.266 28.064 9.566 1.00 25.00 C ATOM 590 CG GLU A 40 17.875 29.286 10.373 1.00 25.00 C ATOM 591 CD GLU A 40 16.473 29.764 10.021 1.00 25.00 C ATOM 592 OE1 GLU A 40 15.653 28.932 9.553 1.00 25.00 O ATOM 593 OE2 GLU A 40 16.195 30.969 10.184 1.00 25.00 O ATOM 0 H GLU A 40 20.218 29.077 8.398 1.00 25.00 H new ATOM 0 HA GLU A 40 19.961 27.621 10.848 1.00 25.00 H new ATOM 0 HB2 GLU A 40 18.132 28.286 8.507 1.00 25.00 H new ATOM 0 HB3 GLU A 40 17.583 27.250 9.810 1.00 25.00 H new ATOM 0 HG2 GLU A 40 17.924 29.052 11.436 1.00 25.00 H new ATOM 0 HG3 GLU A 40 18.590 30.088 10.190 1.00 25.00 H new ATOM 600 N ARG A 41 19.689 25.978 7.970 1.00 25.00 N ATOM 601 CA ARG A 41 19.579 24.639 7.374 1.00 25.00 C ATOM 602 C ARG A 41 20.876 24.009 6.898 1.00 25.00 C ATOM 603 O ARG A 41 20.958 22.796 6.743 1.00 25.00 O ATOM 604 CB ARG A 41 18.594 24.703 6.214 1.00 25.00 C ATOM 605 CG ARG A 41 17.228 25.194 6.674 1.00 25.00 C ATOM 606 CD ARG A 41 16.121 24.867 5.699 1.00 25.00 C ATOM 607 NE ARG A 41 14.835 25.371 6.213 1.00 25.00 N ATOM 608 CZ ARG A 41 13.635 25.030 5.760 1.00 25.00 C ATOM 609 NH1 ARG A 41 13.473 24.182 4.772 1.00 25.00 N ATOM 610 NH2 ARG A 41 12.576 25.555 6.310 1.00 25.00 N ATOM 0 H ARG A 41 19.680 26.743 7.295 1.00 25.00 H new ATOM 0 HA ARG A 41 19.239 23.990 8.181 1.00 25.00 H new ATOM 0 HB2 ARG A 41 18.981 25.368 5.442 1.00 25.00 H new ATOM 0 HB3 ARG A 41 18.495 23.715 5.763 1.00 25.00 H new ATOM 0 HG2 ARG A 41 16.995 24.749 7.641 1.00 25.00 H new ATOM 0 HG3 ARG A 41 17.267 26.273 6.821 1.00 25.00 H new ATOM 0 HD2 ARG A 41 16.335 25.315 4.729 1.00 25.00 H new ATOM 0 HD3 ARG A 41 16.065 23.789 5.547 1.00 25.00 H new ATOM 0 HE ARG A 41 14.870 26.039 6.983 1.00 25.00 H new ATOM 0 HH11 ARG A 41 14.286 23.760 4.324 1.00 25.00 H new ATOM 0 HH12 ARG A 41 12.534 23.945 4.452 1.00 25.00 H new ATOM 0 HH21 ARG A 41 12.676 26.219 7.078 1.00 25.00 H new ATOM 0 HH22 ARG A 41 11.647 25.302 5.972 1.00 25.00 H new ATOM 624 N ASN A 42 21.881 24.827 6.651 1.00 25.00 N ATOM 625 CA ASN A 42 23.200 24.348 6.211 1.00 25.00 C ATOM 626 C ASN A 42 24.364 25.038 6.937 1.00 25.00 C ATOM 627 O ASN A 42 25.161 25.748 6.306 1.00 25.00 O ATOM 628 CB ASN A 42 23.369 24.580 4.711 1.00 25.00 C ATOM 629 CG ASN A 42 24.483 23.759 4.126 1.00 25.00 C ATOM 630 OD1 ASN A 42 25.167 23.031 4.816 1.00 25.00 O ATOM 631 ND2 ASN A 42 24.659 23.864 2.845 1.00 25.00 N ATOM 0 H ASN A 42 21.818 25.841 6.746 1.00 25.00 H new ATOM 0 HA ASN A 42 23.232 23.285 6.452 1.00 25.00 H new ATOM 0 HB2 ASN A 42 22.436 24.338 4.201 1.00 25.00 H new ATOM 0 HB3 ASN A 42 23.566 25.637 4.530 1.00 25.00 H new ATOM 0 HD21 ASN A 42 25.392 23.324 2.385 1.00 25.00 H new ATOM 0 HD22 ASN A 42 24.064 24.486 2.298 1.00 25.00 H new ATOM 638 N PRO A 43 24.501 24.825 8.259 1.00 25.00 N ATOM 639 CA PRO A 43 25.611 25.533 8.917 1.00 25.00 C ATOM 640 C PRO A 43 27.048 25.333 8.366 1.00 25.00 C ATOM 641 O PRO A 43 27.806 26.302 8.356 1.00 25.00 O ATOM 642 CB PRO A 43 25.487 25.090 10.385 1.00 25.00 C ATOM 643 CG PRO A 43 24.677 23.839 10.356 1.00 25.00 C ATOM 644 CD PRO A 43 23.719 24.028 9.223 1.00 25.00 C ATOM 0 HA PRO A 43 25.502 26.602 8.736 1.00 25.00 H new ATOM 0 HB2 PRO A 43 26.468 24.912 10.826 1.00 25.00 H new ATOM 0 HB3 PRO A 43 25.002 25.858 10.987 1.00 25.00 H new ATOM 0 HG2 PRO A 43 25.307 22.964 10.199 1.00 25.00 H new ATOM 0 HG3 PRO A 43 24.150 23.687 11.298 1.00 25.00 H new ATOM 0 HD2 PRO A 43 23.404 23.075 8.798 1.00 25.00 H new ATOM 0 HD3 PRO A 43 22.816 24.550 9.540 1.00 25.00 H new ATOM 652 N PRO A 44 27.433 24.129 7.858 1.00 25.00 N ATOM 653 CA PRO A 44 28.818 24.139 7.359 1.00 25.00 C ATOM 654 C PRO A 44 29.064 24.999 6.107 1.00 25.00 C ATOM 655 O PRO A 44 30.146 25.561 5.947 1.00 25.00 O ATOM 656 CB PRO A 44 29.088 22.657 7.062 1.00 25.00 C ATOM 657 CG PRO A 44 27.777 22.105 6.745 1.00 25.00 C ATOM 658 CD PRO A 44 26.840 22.783 7.700 1.00 25.00 C ATOM 0 HA PRO A 44 29.483 24.593 8.093 1.00 25.00 H new ATOM 0 HB2 PRO A 44 29.781 22.539 6.229 1.00 25.00 H new ATOM 0 HB3 PRO A 44 29.533 22.155 7.921 1.00 25.00 H new ATOM 0 HG2 PRO A 44 27.502 22.306 5.710 1.00 25.00 H new ATOM 0 HG3 PRO A 44 27.761 21.023 6.875 1.00 25.00 H new ATOM 0 HD2 PRO A 44 25.827 22.834 7.302 1.00 25.00 H new ATOM 0 HD3 PRO A 44 26.783 22.254 8.651 1.00 25.00 H new ATOM 666 N LEU A 45 28.086 25.133 5.214 1.00 25.00 N ATOM 667 CA LEU A 45 28.277 26.019 4.062 1.00 25.00 C ATOM 668 C LEU A 45 28.136 27.453 4.529 1.00 25.00 C ATOM 669 O LEU A 45 28.821 28.354 4.047 1.00 25.00 O ATOM 670 CB LEU A 45 27.283 25.721 2.942 1.00 25.00 C ATOM 671 CG LEU A 45 27.492 26.499 1.621 1.00 25.00 C ATOM 672 CD1 LEU A 45 28.901 26.315 1.040 1.00 25.00 C ATOM 673 CD2 LEU A 45 26.463 26.028 0.591 1.00 25.00 C ATOM 0 H LEU A 45 27.184 24.660 5.258 1.00 25.00 H new ATOM 0 HA LEU A 45 29.273 25.852 3.651 1.00 25.00 H new ATOM 0 HB2 LEU A 45 27.324 24.654 2.722 1.00 25.00 H new ATOM 0 HB3 LEU A 45 26.279 25.932 3.309 1.00 25.00 H new ATOM 0 HG LEU A 45 27.366 27.558 1.846 1.00 25.00 H new ATOM 0 HD11 LEU A 45 28.990 26.883 0.114 1.00 25.00 H new ATOM 0 HD12 LEU A 45 29.640 26.672 1.757 1.00 25.00 H new ATOM 0 HD13 LEU A 45 29.075 25.259 0.835 1.00 25.00 H new ATOM 0 HD21 LEU A 45 26.606 26.573 -0.342 1.00 25.00 H new ATOM 0 HD22 LEU A 45 26.591 24.961 0.411 1.00 25.00 H new ATOM 0 HD23 LEU A 45 25.458 26.214 0.970 1.00 25.00 H new ATOM 685 N ALA A 46 27.254 27.667 5.490 1.00 25.00 N ATOM 686 CA ALA A 46 27.055 29.003 6.023 1.00 25.00 C ATOM 687 C ALA A 46 28.322 29.574 6.654 1.00 25.00 C ATOM 688 O ALA A 46 28.685 30.686 6.340 1.00 25.00 O ATOM 689 CB ALA A 46 25.947 29.002 7.018 1.00 25.00 C ATOM 0 H ALA A 46 26.672 26.944 5.912 1.00 25.00 H new ATOM 0 HA ALA A 46 26.793 29.646 5.183 1.00 25.00 H new ATOM 0 HB1 ALA A 46 25.809 30.010 7.410 1.00 25.00 H new ATOM 0 HB2 ALA A 46 25.027 28.670 6.537 1.00 25.00 H new ATOM 0 HB3 ALA A 46 26.193 28.326 7.836 1.00 25.00 H new ATOM 695 N GLU A 47 28.991 28.831 7.528 1.00 25.00 N ATOM 696 CA GLU A 47 30.199 29.356 8.192 1.00 25.00 C ATOM 697 C GLU A 47 31.284 29.706 7.170 1.00 25.00 C ATOM 698 O GLU A 47 32.049 30.658 7.352 1.00 25.00 O ATOM 699 CB GLU A 47 30.744 28.374 9.242 1.00 25.00 C ATOM 700 CG GLU A 47 31.272 27.060 8.686 1.00 25.00 C ATOM 701 CD GLU A 47 31.943 26.218 9.747 1.00 25.00 C ATOM 702 OE1 GLU A 47 33.196 26.226 9.792 1.00 25.00 O ATOM 703 OE2 GLU A 47 31.236 25.556 10.534 1.00 25.00 O ATOM 0 H GLU A 47 28.732 27.881 7.796 1.00 25.00 H new ATOM 0 HA GLU A 47 29.908 30.270 8.710 1.00 25.00 H new ATOM 0 HB2 GLU A 47 31.545 28.865 9.794 1.00 25.00 H new ATOM 0 HB3 GLU A 47 29.952 28.155 9.958 1.00 25.00 H new ATOM 0 HG2 GLU A 47 30.449 26.497 8.245 1.00 25.00 H new ATOM 0 HG3 GLU A 47 31.982 27.266 7.885 1.00 25.00 H new ATOM 710 N ALA A 48 31.312 28.969 6.074 1.00 25.00 N ATOM 711 CA ALA A 48 32.226 29.224 4.987 1.00 25.00 C ATOM 712 C ALA A 48 31.921 30.579 4.336 1.00 25.00 C ATOM 713 O ALA A 48 32.829 31.342 4.024 1.00 25.00 O ATOM 714 CB ALA A 48 32.122 28.083 3.972 1.00 25.00 C ATOM 0 H ALA A 48 30.695 28.172 5.917 1.00 25.00 H new ATOM 0 HA ALA A 48 33.247 29.268 5.366 1.00 25.00 H new ATOM 0 HB1 ALA A 48 32.809 28.267 3.146 1.00 25.00 H new ATOM 0 HB2 ALA A 48 32.380 27.141 4.456 1.00 25.00 H new ATOM 0 HB3 ALA A 48 31.103 28.028 3.590 1.00 25.00 H new ATOM 720 N LEU A 49 30.638 30.884 4.189 1.00 25.00 N ATOM 721 CA LEU A 49 30.204 32.171 3.654 1.00 25.00 C ATOM 722 C LEU A 49 30.556 33.297 4.624 1.00 25.00 C ATOM 723 O LEU A 49 31.004 34.361 4.211 1.00 25.00 O ATOM 724 CB LEU A 49 28.684 32.157 3.441 1.00 25.00 C ATOM 725 CG LEU A 49 28.094 33.410 2.784 1.00 25.00 C ATOM 726 CD1 LEU A 49 28.326 33.370 1.285 1.00 25.00 C ATOM 727 CD2 LEU A 49 26.609 33.502 3.101 1.00 25.00 C ATOM 0 H LEU A 49 29.874 30.254 4.434 1.00 25.00 H new ATOM 0 HA LEU A 49 30.713 32.340 2.705 1.00 25.00 H new ATOM 0 HB2 LEU A 49 28.429 31.293 2.827 1.00 25.00 H new ATOM 0 HB3 LEU A 49 28.201 32.014 4.408 1.00 25.00 H new ATOM 0 HG LEU A 49 28.590 34.296 3.181 1.00 25.00 H new ATOM 0 HD11 LEU A 49 27.903 34.264 0.827 1.00 25.00 H new ATOM 0 HD12 LEU A 49 29.396 33.331 1.083 1.00 25.00 H new ATOM 0 HD13 LEU A 49 27.845 32.486 0.866 1.00 25.00 H new ATOM 0 HD21 LEU A 49 26.192 34.394 2.633 1.00 25.00 H new ATOM 0 HD22 LEU A 49 26.100 32.618 2.717 1.00 25.00 H new ATOM 0 HD23 LEU A 49 26.470 33.560 4.181 1.00 25.00 H new ATOM 739 N LEU A 50 30.346 33.053 5.914 1.00 25.00 N ATOM 740 CA LEU A 50 30.564 34.081 6.944 1.00 25.00 C ATOM 741 C LEU A 50 32.027 34.481 7.014 1.00 25.00 C ATOM 742 O LEU A 50 32.360 35.595 7.395 1.00 25.00 O ATOM 743 CB LEU A 50 30.145 33.582 8.341 1.00 25.00 C ATOM 744 CG LEU A 50 28.750 32.973 8.557 1.00 25.00 C ATOM 745 CD1 LEU A 50 28.453 32.881 10.035 1.00 25.00 C ATOM 746 CD2 LEU A 50 27.631 33.707 7.818 1.00 25.00 C ATOM 0 H LEU A 50 30.025 32.156 6.278 1.00 25.00 H new ATOM 0 HA LEU A 50 29.951 34.936 6.660 1.00 25.00 H new ATOM 0 HB2 LEU A 50 30.876 32.834 8.650 1.00 25.00 H new ATOM 0 HB3 LEU A 50 30.240 34.424 9.027 1.00 25.00 H new ATOM 0 HG LEU A 50 28.776 31.974 8.122 1.00 25.00 H new ATOM 0 HD11 LEU A 50 27.463 32.449 10.181 1.00 25.00 H new ATOM 0 HD12 LEU A 50 29.199 32.250 10.517 1.00 25.00 H new ATOM 0 HD13 LEU A 50 28.482 33.878 10.475 1.00 25.00 H new ATOM 0 HD21 LEU A 50 26.679 33.217 8.021 1.00 25.00 H new ATOM 0 HD22 LEU A 50 27.587 34.741 8.159 1.00 25.00 H new ATOM 0 HD23 LEU A 50 27.828 33.687 6.746 1.00 25.00 H new ATOM 758 N SER A 51 32.895 33.551 6.654 1.00 25.00 N ATOM 759 CA SER A 51 34.325 33.779 6.678 1.00 25.00 C ATOM 760 C SER A 51 34.798 34.644 5.509 1.00 25.00 C ATOM 761 O SER A 51 35.896 35.179 5.541 1.00 25.00 O ATOM 762 CB SER A 51 35.023 32.439 6.607 1.00 25.00 C ATOM 763 OG SER A 51 34.635 31.588 7.682 1.00 25.00 O ATOM 0 H SER A 51 32.626 32.619 6.338 1.00 25.00 H new ATOM 0 HA SER A 51 34.566 34.310 7.599 1.00 25.00 H new ATOM 0 HB2 SER A 51 34.790 31.956 5.658 1.00 25.00 H new ATOM 0 HB3 SER A 51 36.102 32.589 6.632 1.00 25.00 H new ATOM 0 HG SER A 51 33.706 31.303 7.554 1.00 25.00 H new ATOM 769 N GLY A 52 33.998 34.733 4.452 1.00 25.00 N ATOM 770 CA GLY A 52 34.371 35.506 3.272 1.00 25.00 C ATOM 771 C GLY A 52 35.224 34.725 2.282 1.00 25.00 C ATOM 772 O GLY A 52 35.145 34.945 1.068 1.00 25.00 O ATOM 0 H GLY A 52 33.087 34.279 4.388 1.00 25.00 H new ATOM 0 HA2 GLY A 52 33.466 35.848 2.770 1.00 25.00 H new ATOM 0 HA3 GLY A 52 34.916 36.396 3.587 1.00 25.00 H new ATOM 776 N ASP A 53 36.018 33.802 2.809 1.00 25.00 N ATOM 777 CA ASP A 53 36.893 32.932 2.038 1.00 25.00 C ATOM 778 C ASP A 53 36.141 32.141 0.975 1.00 25.00 C ATOM 779 O ASP A 53 35.474 31.149 1.264 1.00 25.00 O ATOM 780 CB ASP A 53 37.578 31.976 2.992 1.00 25.00 C ATOM 781 CG ASP A 53 38.729 32.604 3.734 1.00 25.00 C ATOM 782 OD1 ASP A 53 38.938 32.219 4.904 1.00 25.00 O ATOM 783 OD2 ASP A 53 39.430 33.460 3.159 1.00 25.00 O ATOM 0 H ASP A 53 36.072 33.634 3.814 1.00 25.00 H new ATOM 0 HA ASP A 53 37.619 33.556 1.516 1.00 25.00 H new ATOM 0 HB2 ASP A 53 36.848 31.606 3.712 1.00 25.00 H new ATOM 0 HB3 ASP A 53 37.941 31.113 2.434 1.00 25.00 H new ATOM 788 N LEU A 54 36.290 32.562 -0.276 1.00 25.00 N ATOM 789 CA LEU A 54 35.680 31.848 -1.393 1.00 25.00 C ATOM 790 C LEU A 54 36.268 30.443 -1.421 1.00 25.00 C ATOM 791 O LEU A 54 35.591 29.490 -1.754 1.00 25.00 O ATOM 792 CB LEU A 54 35.967 32.560 -2.719 1.00 25.00 C ATOM 793 CG LEU A 54 35.361 31.975 -4.020 1.00 25.00 C ATOM 794 CD1 LEU A 54 36.267 30.926 -4.675 1.00 25.00 C ATOM 795 CD2 LEU A 54 33.942 31.408 -3.851 1.00 25.00 C ATOM 0 H LEU A 54 36.824 33.389 -0.542 1.00 25.00 H new ATOM 0 HA LEU A 54 34.598 31.813 -1.264 1.00 25.00 H new ATOM 0 HB2 LEU A 54 35.619 33.589 -2.625 1.00 25.00 H new ATOM 0 HB3 LEU A 54 37.049 32.600 -2.846 1.00 25.00 H new ATOM 0 HG LEU A 54 35.286 32.835 -4.685 1.00 25.00 H new ATOM 0 HD11 LEU A 54 35.793 30.551 -5.582 1.00 25.00 H new ATOM 0 HD12 LEU A 54 37.225 31.380 -4.928 1.00 25.00 H new ATOM 0 HD13 LEU A 54 36.428 30.101 -3.982 1.00 25.00 H new ATOM 0 HD21 LEU A 54 33.590 31.018 -4.806 1.00 25.00 H new ATOM 0 HD22 LEU A 54 33.957 30.605 -3.114 1.00 25.00 H new ATOM 0 HD23 LEU A 54 33.272 32.199 -3.512 1.00 25.00 H new ATOM 807 N GLU A 55 37.526 30.319 -1.036 1.00 25.00 N ATOM 808 CA GLU A 55 38.206 29.024 -1.022 1.00 25.00 C ATOM 809 C GLU A 55 37.433 27.994 -0.209 1.00 25.00 C ATOM 810 O GLU A 55 37.112 26.906 -0.698 1.00 25.00 O ATOM 811 CB GLU A 55 39.608 29.175 -0.433 1.00 25.00 C ATOM 812 CG GLU A 55 40.348 30.363 -0.989 1.00 25.00 C ATOM 813 CD GLU A 55 41.851 30.241 -0.808 1.00 25.00 C ATOM 814 OE1 GLU A 55 42.592 30.597 -1.746 1.00 25.00 O ATOM 815 OE2 GLU A 55 42.290 29.761 0.261 1.00 25.00 O ATOM 0 H GLU A 55 38.105 31.100 -0.726 1.00 25.00 H new ATOM 0 HA GLU A 55 38.268 28.675 -2.053 1.00 25.00 H new ATOM 0 HB2 GLU A 55 39.534 29.273 0.650 1.00 25.00 H new ATOM 0 HB3 GLU A 55 40.181 28.269 -0.633 1.00 25.00 H new ATOM 0 HG2 GLU A 55 40.119 30.467 -2.050 1.00 25.00 H new ATOM 0 HG3 GLU A 55 39.997 31.270 -0.497 1.00 25.00 H new ATOM 822 N LYS A 56 37.099 28.344 1.024 1.00 25.00 N ATOM 823 CA LYS A 56 36.353 27.420 1.880 1.00 25.00 C ATOM 824 C LYS A 56 34.905 27.331 1.436 1.00 25.00 C ATOM 825 O LYS A 56 34.322 26.258 1.486 1.00 25.00 O ATOM 826 CB LYS A 56 36.494 27.771 3.373 1.00 25.00 C ATOM 827 CG LYS A 56 35.850 29.006 3.857 1.00 25.00 C ATOM 828 CD LYS A 56 36.401 29.381 5.250 1.00 25.00 C ATOM 829 CE LYS A 56 35.796 28.555 6.397 1.00 25.00 C ATOM 830 NZ LYS A 56 36.234 29.074 7.741 1.00 25.00 N ATOM 0 H LYS A 56 37.325 29.242 1.452 1.00 25.00 H new ATOM 0 HA LYS A 56 36.791 26.428 1.766 1.00 25.00 H new ATOM 0 HB2 LYS A 56 36.095 26.938 3.951 1.00 25.00 H new ATOM 0 HB3 LYS A 56 37.558 27.837 3.602 1.00 25.00 H new ATOM 0 HG2 LYS A 56 36.032 29.819 3.155 1.00 25.00 H new ATOM 0 HG3 LYS A 56 34.770 28.866 3.910 1.00 25.00 H new ATOM 0 HD2 LYS A 56 37.483 29.249 5.251 1.00 25.00 H new ATOM 0 HD3 LYS A 56 36.209 30.438 5.435 1.00 25.00 H new ATOM 0 HE2 LYS A 56 34.708 28.582 6.332 1.00 25.00 H new ATOM 0 HE3 LYS A 56 36.096 27.512 6.293 1.00 25.00 H new ATOM 0 HZ1 LYS A 56 35.951 28.401 8.482 1.00 25.00 H new ATOM 0 HZ2 LYS A 56 37.268 29.185 7.750 1.00 25.00 H new ATOM 0 HZ3 LYS A 56 35.786 29.995 7.920 1.00 25.00 H new ATOM 844 N PHE A 57 34.341 28.424 0.942 1.00 25.00 N ATOM 845 CA PHE A 57 32.969 28.395 0.437 1.00 25.00 C ATOM 846 C PHE A 57 32.844 27.391 -0.707 1.00 25.00 C ATOM 847 O PHE A 57 31.992 26.521 -0.667 1.00 25.00 O ATOM 848 CB PHE A 57 32.517 29.783 -0.017 1.00 25.00 C ATOM 849 CG PHE A 57 31.106 29.811 -0.524 1.00 25.00 C ATOM 850 CD1 PHE A 57 30.026 29.874 0.375 1.00 25.00 C ATOM 851 CD2 PHE A 57 30.843 29.756 -1.906 1.00 25.00 C ATOM 852 CE1 PHE A 57 28.693 29.875 -0.098 1.00 25.00 C ATOM 853 CE2 PHE A 57 29.516 29.756 -2.388 1.00 25.00 C ATOM 854 CZ PHE A 57 28.442 29.815 -1.485 1.00 25.00 C ATOM 0 H PHE A 57 34.802 29.332 0.879 1.00 25.00 H new ATOM 0 HA PHE A 57 32.317 28.081 1.252 1.00 25.00 H new ATOM 0 HB2 PHE A 57 32.610 30.479 0.817 1.00 25.00 H new ATOM 0 HB3 PHE A 57 33.185 30.136 -0.803 1.00 25.00 H new ATOM 0 HD1 PHE A 57 30.216 29.922 1.437 1.00 25.00 H new ATOM 0 HD2 PHE A 57 31.665 29.713 -2.605 1.00 25.00 H new ATOM 0 HE1 PHE A 57 27.870 29.922 0.600 1.00 25.00 H new ATOM 0 HE2 PHE A 57 29.327 29.711 -3.450 1.00 25.00 H new ATOM 0 HZ PHE A 57 27.426 29.814 -1.852 1.00 25.00 H new ATOM 864 N SER A 58 33.728 27.481 -1.689 1.00 25.00 N ATOM 865 CA SER A 58 33.744 26.567 -2.823 1.00 25.00 C ATOM 866 C SER A 58 34.003 25.130 -2.400 1.00 25.00 C ATOM 867 O SER A 58 33.317 24.218 -2.846 1.00 25.00 O ATOM 868 CB SER A 58 34.842 26.996 -3.800 1.00 25.00 C ATOM 869 OG SER A 58 34.887 26.133 -4.920 1.00 25.00 O ATOM 0 H SER A 58 34.458 28.193 -1.723 1.00 25.00 H new ATOM 0 HA SER A 58 32.761 26.609 -3.292 1.00 25.00 H new ATOM 0 HB2 SER A 58 34.661 28.019 -4.131 1.00 25.00 H new ATOM 0 HB3 SER A 58 35.807 26.991 -3.293 1.00 25.00 H new ATOM 0 HG SER A 58 35.594 26.427 -5.531 1.00 25.00 H new ATOM 875 N ARG A 59 34.971 24.917 -1.520 1.00 25.00 N ATOM 876 CA ARG A 59 35.298 23.561 -1.078 1.00 25.00 C ATOM 877 C ARG A 59 34.083 22.894 -0.440 1.00 25.00 C ATOM 878 O ARG A 59 33.764 21.750 -0.744 1.00 25.00 O ATOM 879 CB ARG A 59 36.466 23.611 -0.087 1.00 25.00 C ATOM 880 CG ARG A 59 36.863 22.242 0.497 1.00 25.00 C ATOM 881 CD ARG A 59 36.270 22.029 1.894 1.00 25.00 C ATOM 882 NE ARG A 59 36.579 20.695 2.435 1.00 25.00 N ATOM 883 CZ ARG A 59 36.382 20.315 3.694 1.00 25.00 C ATOM 884 NH1 ARG A 59 35.896 21.128 4.601 1.00 25.00 N ATOM 885 NH2 ARG A 59 36.680 19.100 4.049 1.00 25.00 N ATOM 0 H ARG A 59 35.540 25.652 -1.100 1.00 25.00 H new ATOM 0 HA ARG A 59 35.591 22.968 -1.944 1.00 25.00 H new ATOM 0 HB2 ARG A 59 37.332 24.044 -0.587 1.00 25.00 H new ATOM 0 HB3 ARG A 59 36.203 24.280 0.733 1.00 25.00 H new ATOM 0 HG2 ARG A 59 36.521 21.449 -0.168 1.00 25.00 H new ATOM 0 HG3 ARG A 59 37.949 22.169 0.548 1.00 25.00 H new ATOM 0 HD2 ARG A 59 36.657 22.791 2.570 1.00 25.00 H new ATOM 0 HD3 ARG A 59 35.189 22.160 1.851 1.00 25.00 H new ATOM 0 HE ARG A 59 36.975 20.008 1.794 1.00 25.00 H new ATOM 0 HH11 ARG A 59 35.656 22.087 4.350 1.00 25.00 H new ATOM 0 HH12 ARG A 59 35.758 20.801 5.557 1.00 25.00 H new ATOM 0 HH21 ARG A 59 37.061 18.448 3.364 1.00 25.00 H new ATOM 0 HH22 ARG A 59 36.532 18.799 5.012 1.00 25.00 H new ATOM 899 N VAL A 60 33.400 23.617 0.434 1.00 25.00 N ATOM 900 CA VAL A 60 32.239 23.061 1.118 1.00 25.00 C ATOM 901 C VAL A 60 31.088 22.943 0.124 1.00 25.00 C ATOM 902 O VAL A 60 30.300 22.015 0.207 1.00 25.00 O ATOM 903 CB VAL A 60 31.839 23.913 2.358 1.00 25.00 C ATOM 904 CG1 VAL A 60 30.615 23.309 3.058 1.00 25.00 C ATOM 905 CG2 VAL A 60 33.004 23.965 3.365 1.00 25.00 C ATOM 0 H VAL A 60 33.625 24.580 0.686 1.00 25.00 H new ATOM 0 HA VAL A 60 32.489 22.070 1.496 1.00 25.00 H new ATOM 0 HB VAL A 60 31.601 24.918 2.011 1.00 25.00 H new ATOM 0 HG11 VAL A 60 30.352 23.919 3.922 1.00 25.00 H new ATOM 0 HG12 VAL A 60 29.775 23.282 2.364 1.00 25.00 H new ATOM 0 HG13 VAL A 60 30.847 22.296 3.387 1.00 25.00 H new ATOM 0 HG21 VAL A 60 32.713 24.564 4.228 1.00 25.00 H new ATOM 0 HG22 VAL A 60 33.249 22.954 3.691 1.00 25.00 H new ATOM 0 HG23 VAL A 60 33.876 24.414 2.890 1.00 25.00 H new ATOM 915 N LEU A 61 31.012 23.852 -0.840 1.00 25.00 N ATOM 916 CA LEU A 61 29.962 23.800 -1.857 1.00 25.00 C ATOM 917 C LEU A 61 30.013 22.472 -2.604 1.00 25.00 C ATOM 918 O LEU A 61 28.987 21.837 -2.793 1.00 25.00 O ATOM 919 CB LEU A 61 30.106 24.955 -2.859 1.00 25.00 C ATOM 920 CG LEU A 61 28.857 25.223 -3.712 1.00 25.00 C ATOM 921 CD1 LEU A 61 28.106 26.386 -3.112 1.00 25.00 C ATOM 922 CD2 LEU A 61 29.204 25.566 -5.155 1.00 25.00 C ATOM 0 H LEU A 61 31.661 24.632 -0.941 1.00 25.00 H new ATOM 0 HA LEU A 61 29.002 23.895 -1.349 1.00 25.00 H new ATOM 0 HB2 LEU A 61 30.358 25.864 -2.312 1.00 25.00 H new ATOM 0 HB3 LEU A 61 30.944 24.740 -3.523 1.00 25.00 H new ATOM 0 HG LEU A 61 28.256 24.314 -3.718 1.00 25.00 H new ATOM 0 HD11 LEU A 61 27.215 26.590 -3.706 1.00 25.00 H new ATOM 0 HD12 LEU A 61 27.813 26.142 -2.091 1.00 25.00 H new ATOM 0 HD13 LEU A 61 28.747 27.268 -3.105 1.00 25.00 H new ATOM 0 HD21 LEU A 61 28.287 25.747 -5.717 1.00 25.00 H new ATOM 0 HD22 LEU A 61 29.825 26.461 -5.177 1.00 25.00 H new ATOM 0 HD23 LEU A 61 29.748 24.736 -5.606 1.00 25.00 H new ATOM 934 N VAL A 62 31.203 22.034 -2.995 1.00 25.00 N ATOM 935 CA VAL A 62 31.349 20.767 -3.719 1.00 25.00 C ATOM 936 C VAL A 62 30.992 19.590 -2.818 1.00 25.00 C ATOM 937 O VAL A 62 30.290 18.673 -3.230 1.00 25.00 O ATOM 938 CB VAL A 62 32.797 20.576 -4.259 1.00 25.00 C ATOM 939 CG1 VAL A 62 32.932 19.241 -5.021 1.00 25.00 C ATOM 940 CG2 VAL A 62 33.163 21.724 -5.197 1.00 25.00 C ATOM 0 H VAL A 62 32.079 22.530 -2.827 1.00 25.00 H new ATOM 0 HA VAL A 62 30.664 20.802 -4.566 1.00 25.00 H new ATOM 0 HB VAL A 62 33.474 20.566 -3.404 1.00 25.00 H new ATOM 0 HG11 VAL A 62 33.953 19.133 -5.387 1.00 25.00 H new ATOM 0 HG12 VAL A 62 32.698 18.414 -4.351 1.00 25.00 H new ATOM 0 HG13 VAL A 62 32.241 19.232 -5.864 1.00 25.00 H new ATOM 0 HG21 VAL A 62 34.178 21.581 -5.569 1.00 25.00 H new ATOM 0 HG22 VAL A 62 32.468 21.744 -6.037 1.00 25.00 H new ATOM 0 HG23 VAL A 62 33.105 22.668 -4.656 1.00 25.00 H new ATOM 950 N GLU A 63 31.443 19.615 -1.577 1.00 25.00 N ATOM 951 CA GLU A 63 31.123 18.530 -0.640 1.00 25.00 C ATOM 952 C GLU A 63 29.614 18.450 -0.395 1.00 25.00 C ATOM 953 O GLU A 63 29.031 17.364 -0.377 1.00 25.00 O ATOM 954 CB GLU A 63 31.879 18.724 0.676 1.00 25.00 C ATOM 955 CG GLU A 63 33.382 18.505 0.514 1.00 25.00 C ATOM 956 CD GLU A 63 34.128 18.503 1.838 1.00 25.00 C ATOM 957 OE1 GLU A 63 35.204 17.858 1.903 1.00 25.00 O ATOM 958 OE2 GLU A 63 33.691 19.187 2.791 1.00 25.00 O ATOM 0 H GLU A 63 32.024 20.358 -1.190 1.00 25.00 H new ATOM 0 HA GLU A 63 31.441 17.586 -1.084 1.00 25.00 H new ATOM 0 HB2 GLU A 63 31.698 19.731 1.052 1.00 25.00 H new ATOM 0 HB3 GLU A 63 31.491 18.031 1.422 1.00 25.00 H new ATOM 0 HG2 GLU A 63 33.553 17.556 0.006 1.00 25.00 H new ATOM 0 HG3 GLU A 63 33.791 19.287 -0.126 1.00 25.00 H new ATOM 965 N GLN A 64 28.966 19.598 -0.290 1.00 25.00 N ATOM 966 CA GLN A 64 27.516 19.641 -0.152 1.00 25.00 C ATOM 967 C GLN A 64 26.849 19.157 -1.429 1.00 25.00 C ATOM 968 O GLN A 64 25.866 18.447 -1.360 1.00 25.00 O ATOM 969 CB GLN A 64 27.047 21.067 0.147 1.00 25.00 C ATOM 970 CG GLN A 64 27.351 21.534 1.564 1.00 25.00 C ATOM 971 CD GLN A 64 26.464 20.872 2.592 1.00 25.00 C ATOM 972 OE1 GLN A 64 25.244 20.853 2.449 1.00 25.00 O ATOM 973 NE2 GLN A 64 27.057 20.352 3.632 1.00 25.00 N ATOM 0 H GLN A 64 29.418 20.512 -0.297 1.00 25.00 H new ATOM 0 HA GLN A 64 27.237 18.988 0.675 1.00 25.00 H new ATOM 0 HB2 GLN A 64 27.520 21.750 -0.559 1.00 25.00 H new ATOM 0 HB3 GLN A 64 25.972 21.128 -0.022 1.00 25.00 H new ATOM 0 HG2 GLN A 64 28.394 21.321 1.798 1.00 25.00 H new ATOM 0 HG3 GLN A 64 27.225 22.615 1.622 1.00 25.00 H new ATOM 0 HE21 GLN A 64 28.073 20.389 3.711 1.00 25.00 H new ATOM 0 HE22 GLN A 64 26.504 19.908 4.365 1.00 25.00 H new ATOM 982 N GLN A 65 27.376 19.520 -2.591 1.00 25.00 N ATOM 983 CA GLN A 65 26.799 19.069 -3.862 1.00 25.00 C ATOM 984 C GLN A 65 26.835 17.554 -3.954 1.00 25.00 C ATOM 985 O GLN A 65 25.871 16.946 -4.402 1.00 25.00 O ATOM 986 CB GLN A 65 27.561 19.641 -5.061 1.00 25.00 C ATOM 987 CG GLN A 65 27.200 21.072 -5.428 1.00 25.00 C ATOM 988 CD GLN A 65 28.066 21.600 -6.554 1.00 25.00 C ATOM 989 OE1 GLN A 65 28.739 20.850 -7.238 1.00 25.00 O ATOM 990 NE2 GLN A 65 28.044 22.887 -6.747 1.00 25.00 N ATOM 0 H GLN A 65 28.195 20.120 -2.686 1.00 25.00 H new ATOM 0 HA GLN A 65 25.769 19.426 -3.888 1.00 25.00 H new ATOM 0 HB2 GLN A 65 28.629 19.594 -4.849 1.00 25.00 H new ATOM 0 HB3 GLN A 65 27.379 19.003 -5.926 1.00 25.00 H new ATOM 0 HG2 GLN A 65 26.152 21.118 -5.723 1.00 25.00 H new ATOM 0 HG3 GLN A 65 27.313 21.711 -4.552 1.00 25.00 H new ATOM 0 HE21 GLN A 65 27.467 23.482 -6.152 1.00 25.00 H new ATOM 0 HE22 GLN A 65 28.604 23.300 -7.493 1.00 25.00 H new ATOM 999 N GLN A 66 27.926 16.940 -3.516 1.00 25.00 N ATOM 1000 CA GLN A 66 28.054 15.488 -3.579 1.00 25.00 C ATOM 1001 C GLN A 66 26.966 14.815 -2.745 1.00 25.00 C ATOM 1002 O GLN A 66 26.346 13.855 -3.190 1.00 25.00 O ATOM 1003 CB GLN A 66 29.428 15.039 -3.079 1.00 25.00 C ATOM 1004 CG GLN A 66 30.569 15.388 -4.023 1.00 25.00 C ATOM 1005 CD GLN A 66 31.914 14.998 -3.457 1.00 25.00 C ATOM 1006 OE1 GLN A 66 32.286 13.840 -3.468 1.00 25.00 O ATOM 1007 NE2 GLN A 66 32.635 15.961 -2.949 1.00 25.00 N ATOM 0 H GLN A 66 28.732 17.420 -3.115 1.00 25.00 H new ATOM 0 HA GLN A 66 27.942 15.191 -4.622 1.00 25.00 H new ATOM 0 HB2 GLN A 66 29.619 15.497 -2.109 1.00 25.00 H new ATOM 0 HB3 GLN A 66 29.413 13.960 -2.925 1.00 25.00 H new ATOM 0 HG2 GLN A 66 30.417 14.883 -4.977 1.00 25.00 H new ATOM 0 HG3 GLN A 66 30.558 16.459 -4.224 1.00 25.00 H new ATOM 0 HE21 GLN A 66 32.286 16.919 -2.960 1.00 25.00 H new ATOM 0 HE22 GLN A 66 33.547 15.755 -2.541 1.00 25.00 H new ATOM 1016 N ASP A 67 26.716 15.322 -1.546 1.00 25.00 N ATOM 1017 CA ASP A 67 25.690 14.721 -0.693 1.00 25.00 C ATOM 1018 C ASP A 67 24.288 15.057 -1.177 1.00 25.00 C ATOM 1019 O ASP A 67 23.386 14.214 -1.177 1.00 25.00 O ATOM 1020 CB ASP A 67 25.817 15.193 0.749 1.00 25.00 C ATOM 1021 CG ASP A 67 25.063 14.288 1.703 1.00 25.00 C ATOM 1022 OD1 ASP A 67 25.288 13.056 1.643 1.00 25.00 O ATOM 1023 OD2 ASP A 67 24.204 14.784 2.460 1.00 25.00 O ATOM 0 H ASP A 67 27.194 16.129 -1.145 1.00 25.00 H new ATOM 0 HA ASP A 67 25.847 13.644 -0.746 1.00 25.00 H new ATOM 0 HB2 ASP A 67 26.870 15.223 1.031 1.00 25.00 H new ATOM 0 HB3 ASP A 67 25.435 16.210 0.834 1.00 25.00 H new ATOM 1028 N ARG A 68 24.098 16.295 -1.605 1.00 25.00 N ATOM 1029 CA ARG A 68 22.791 16.742 -2.066 1.00 25.00 C ATOM 1030 C ARG A 68 22.378 15.986 -3.301 1.00 25.00 C ATOM 1031 O ARG A 68 21.225 15.638 -3.428 1.00 25.00 O ATOM 1032 CB ARG A 68 22.789 18.237 -2.359 1.00 25.00 C ATOM 1033 CG ARG A 68 22.724 19.096 -1.108 1.00 25.00 C ATOM 1034 CD ARG A 68 22.611 20.562 -1.478 1.00 25.00 C ATOM 1035 NE ARG A 68 22.610 21.421 -0.283 1.00 25.00 N ATOM 1036 CZ ARG A 68 22.188 22.681 -0.247 1.00 25.00 C ATOM 1037 NH1 ARG A 68 21.716 23.296 -1.303 1.00 25.00 N ATOM 1038 NH2 ARG A 68 22.230 23.330 0.882 1.00 25.00 N ATOM 0 H ARG A 68 24.828 17.006 -1.643 1.00 25.00 H new ATOM 0 HA ARG A 68 22.077 16.544 -1.267 1.00 25.00 H new ATOM 0 HB2 ARG A 68 23.689 18.491 -2.919 1.00 25.00 H new ATOM 0 HB3 ARG A 68 21.938 18.474 -2.998 1.00 25.00 H new ATOM 0 HG2 ARG A 68 21.868 18.801 -0.501 1.00 25.00 H new ATOM 0 HG3 ARG A 68 23.616 18.935 -0.502 1.00 25.00 H new ATOM 0 HD2 ARG A 68 23.442 20.840 -2.126 1.00 25.00 H new ATOM 0 HD3 ARG A 68 21.695 20.726 -2.046 1.00 25.00 H new ATOM 0 HE ARG A 68 22.961 21.018 0.586 1.00 25.00 H new ATOM 0 HH11 ARG A 68 21.662 22.807 -2.196 1.00 25.00 H new ATOM 0 HH12 ARG A 68 21.403 24.264 -1.232 1.00 25.00 H new ATOM 0 HH21 ARG A 68 22.583 22.871 1.721 1.00 25.00 H new ATOM 0 HH22 ARG A 68 21.910 24.297 0.926 1.00 25.00 H new ATOM 1052 N ALA A 69 23.317 15.672 -4.179 1.00 25.00 N ATOM 1053 CA ALA A 69 23.014 14.930 -5.404 1.00 25.00 C ATOM 1054 C ALA A 69 22.329 13.596 -5.102 1.00 25.00 C ATOM 1055 O ALA A 69 21.514 13.118 -5.884 1.00 25.00 O ATOM 1056 CB ALA A 69 24.301 14.698 -6.207 1.00 25.00 C ATOM 0 H ALA A 69 24.301 15.918 -4.070 1.00 25.00 H new ATOM 0 HA ALA A 69 22.321 15.528 -5.996 1.00 25.00 H new ATOM 0 HB1 ALA A 69 24.067 14.145 -7.117 1.00 25.00 H new ATOM 0 HB2 ALA A 69 24.744 15.659 -6.470 1.00 25.00 H new ATOM 0 HB3 ALA A 69 25.007 14.125 -5.606 1.00 25.00 H new ATOM 1062 N ARG A 70 22.647 13.000 -3.961 1.00 25.00 N ATOM 1063 CA ARG A 70 22.064 11.712 -3.574 1.00 25.00 C ATOM 1064 C ARG A 70 20.566 11.846 -3.331 1.00 25.00 C ATOM 1065 O ARG A 70 19.775 11.059 -3.831 1.00 25.00 O ATOM 1066 CB ARG A 70 22.749 11.189 -2.303 1.00 25.00 C ATOM 1067 CG ARG A 70 24.274 11.098 -2.419 1.00 25.00 C ATOM 1068 CD ARG A 70 24.928 10.982 -1.050 1.00 25.00 C ATOM 1069 NE ARG A 70 24.778 9.643 -0.459 1.00 25.00 N ATOM 1070 CZ ARG A 70 24.967 9.349 0.824 1.00 25.00 C ATOM 1071 NH1 ARG A 70 25.271 10.249 1.722 1.00 25.00 N ATOM 1072 NH2 ARG A 70 24.840 8.112 1.213 1.00 25.00 N ATOM 0 H ARG A 70 23.305 13.384 -3.283 1.00 25.00 H new ATOM 0 HA ARG A 70 22.221 11.006 -4.389 1.00 25.00 H new ATOM 0 HB2 ARG A 70 22.495 11.843 -1.469 1.00 25.00 H new ATOM 0 HB3 ARG A 70 22.352 10.202 -2.067 1.00 25.00 H new ATOM 0 HG2 ARG A 70 24.543 10.234 -3.027 1.00 25.00 H new ATOM 0 HG3 ARG A 70 24.655 11.981 -2.932 1.00 25.00 H new ATOM 0 HD2 ARG A 70 25.988 11.219 -1.138 1.00 25.00 H new ATOM 0 HD3 ARG A 70 24.490 11.721 -0.379 1.00 25.00 H new ATOM 0 HE ARG A 70 24.508 8.881 -1.082 1.00 25.00 H new ATOM 0 HH11 ARG A 70 25.373 11.227 1.450 1.00 25.00 H new ATOM 0 HH12 ARG A 70 25.406 9.974 2.695 1.00 25.00 H new ATOM 0 HH21 ARG A 70 24.599 7.387 0.537 1.00 25.00 H new ATOM 0 HH22 ARG A 70 24.981 7.869 2.193 1.00 25.00 H new ATOM 1086 N ARG A 71 20.179 12.851 -2.560 1.00 25.00 N ATOM 1087 CA ARG A 71 18.759 13.072 -2.226 1.00 25.00 C ATOM 1088 C ARG A 71 18.005 13.796 -3.337 1.00 25.00 C ATOM 1089 O ARG A 71 16.786 13.694 -3.443 1.00 25.00 O ATOM 1090 CB ARG A 71 18.638 13.889 -0.931 1.00 25.00 C ATOM 1091 CG ARG A 71 19.231 15.282 -1.035 1.00 25.00 C ATOM 1092 CD ARG A 71 18.890 16.203 0.097 1.00 25.00 C ATOM 1093 NE ARG A 71 18.949 17.570 -0.438 1.00 25.00 N ATOM 1094 CZ ARG A 71 18.972 18.689 0.268 1.00 25.00 C ATOM 1095 NH1 ARG A 71 18.954 18.697 1.577 1.00 25.00 N ATOM 1096 NH2 ARG A 71 19.011 19.820 -0.379 1.00 25.00 N ATOM 0 H ARG A 71 20.818 13.531 -2.149 1.00 25.00 H new ATOM 0 HA ARG A 71 18.311 12.087 -2.098 1.00 25.00 H new ATOM 0 HB2 ARG A 71 17.586 13.970 -0.659 1.00 25.00 H new ATOM 0 HB3 ARG A 71 19.135 13.351 -0.124 1.00 25.00 H new ATOM 0 HG2 ARG A 71 20.316 15.195 -1.098 1.00 25.00 H new ATOM 0 HG3 ARG A 71 18.893 15.736 -1.967 1.00 25.00 H new ATOM 0 HD2 ARG A 71 17.897 15.983 0.489 1.00 25.00 H new ATOM 0 HD3 ARG A 71 19.592 16.079 0.921 1.00 25.00 H new ATOM 0 HE ARG A 71 18.975 17.666 -1.453 1.00 25.00 H new ATOM 0 HH11 ARG A 71 18.921 17.817 2.092 1.00 25.00 H new ATOM 0 HH12 ARG A 71 18.973 19.583 2.082 1.00 25.00 H new ATOM 0 HH21 ARG A 71 19.023 19.824 -1.399 1.00 25.00 H new ATOM 0 HH22 ARG A 71 19.030 20.701 0.135 1.00 25.00 H new ATOM 1110 N GLU A 72 18.725 14.582 -4.120 1.00 25.00 N ATOM 1111 CA GLU A 72 18.104 15.450 -5.123 1.00 25.00 C ATOM 1112 C GLU A 72 17.419 14.638 -6.200 1.00 25.00 C ATOM 1113 O GLU A 72 16.425 15.069 -6.745 1.00 25.00 O ATOM 1114 CB GLU A 72 19.117 16.398 -5.768 1.00 25.00 C ATOM 1115 CG GLU A 72 18.797 17.889 -5.567 1.00 25.00 C ATOM 1116 CD GLU A 72 19.088 18.417 -4.145 1.00 25.00 C ATOM 1117 OE1 GLU A 72 19.900 19.350 -3.998 1.00 25.00 O ATOM 1118 OE2 GLU A 72 18.419 17.980 -3.184 1.00 25.00 O ATOM 0 H GLU A 72 19.743 14.641 -4.085 1.00 25.00 H new ATOM 0 HA GLU A 72 17.361 16.048 -4.596 1.00 25.00 H new ATOM 0 HB2 GLU A 72 20.105 16.191 -5.357 1.00 25.00 H new ATOM 0 HB3 GLU A 72 19.166 16.189 -6.837 1.00 25.00 H new ATOM 0 HG2 GLU A 72 19.375 18.472 -6.284 1.00 25.00 H new ATOM 0 HG3 GLU A 72 17.744 18.056 -5.795 1.00 25.00 H new ATOM 1125 N GLN A 73 17.933 13.446 -6.461 1.00 25.00 N ATOM 1126 CA GLN A 73 17.326 12.532 -7.436 1.00 25.00 C ATOM 1127 C GLN A 73 15.839 12.296 -7.147 1.00 25.00 C ATOM 1128 O GLN A 73 15.018 12.321 -8.057 1.00 25.00 O ATOM 1129 CB GLN A 73 18.061 11.187 -7.413 1.00 25.00 C ATOM 1130 CG GLN A 73 19.481 11.256 -7.953 1.00 25.00 C ATOM 1131 CD GLN A 73 20.305 10.040 -7.582 1.00 25.00 C ATOM 1132 OE1 GLN A 73 19.987 8.924 -7.946 1.00 25.00 O ATOM 1133 NE2 GLN A 73 21.373 10.260 -6.866 1.00 25.00 N ATOM 0 H GLN A 73 18.773 13.081 -6.012 1.00 25.00 H new ATOM 0 HA GLN A 73 17.413 12.995 -8.419 1.00 25.00 H new ATOM 0 HB2 GLN A 73 18.089 10.816 -6.388 1.00 25.00 H new ATOM 0 HB3 GLN A 73 17.494 10.463 -7.999 1.00 25.00 H new ATOM 0 HG2 GLN A 73 19.449 11.351 -9.038 1.00 25.00 H new ATOM 0 HG3 GLN A 73 19.969 12.152 -7.569 1.00 25.00 H new ATOM 0 HE21 GLN A 73 21.608 11.210 -6.579 1.00 25.00 H new ATOM 0 HE22 GLN A 73 21.973 9.482 -6.593 1.00 25.00 H new ATOM 1142 N GLU A 74 15.493 12.103 -5.883 1.00 25.00 N ATOM 1143 CA GLU A 74 14.097 11.884 -5.491 1.00 25.00 C ATOM 1144 C GLU A 74 13.309 13.191 -5.540 1.00 25.00 C ATOM 1145 O GLU A 74 12.118 13.208 -5.827 1.00 25.00 O ATOM 1146 CB GLU A 74 14.038 11.323 -4.066 1.00 25.00 C ATOM 1147 CG GLU A 74 14.558 9.897 -3.951 1.00 25.00 C ATOM 1148 CD GLU A 74 13.718 8.916 -4.758 1.00 25.00 C ATOM 1149 OE1 GLU A 74 12.503 8.802 -4.482 1.00 25.00 O ATOM 1150 OE2 GLU A 74 14.265 8.277 -5.678 1.00 25.00 O ATOM 0 H GLU A 74 16.155 12.092 -5.107 1.00 25.00 H new ATOM 0 HA GLU A 74 13.656 11.174 -6.191 1.00 25.00 H new ATOM 0 HB2 GLU A 74 14.619 11.967 -3.406 1.00 25.00 H new ATOM 0 HB3 GLU A 74 13.007 11.354 -3.714 1.00 25.00 H new ATOM 0 HG2 GLU A 74 15.591 9.859 -4.296 1.00 25.00 H new ATOM 0 HG3 GLU A 74 14.561 9.596 -2.904 1.00 25.00 H new ATOM 1157 N ARG A 75 13.980 14.291 -5.243 1.00 25.00 N ATOM 1158 CA ARG A 75 13.330 15.605 -5.210 1.00 25.00 C ATOM 1159 C ARG A 75 12.960 16.119 -6.595 1.00 25.00 C ATOM 1160 O ARG A 75 11.890 16.666 -6.772 1.00 25.00 O ATOM 1161 CB ARG A 75 14.236 16.604 -4.498 1.00 25.00 C ATOM 1162 CG ARG A 75 14.314 16.349 -2.995 1.00 25.00 C ATOM 1163 CD ARG A 75 15.453 17.109 -2.329 1.00 25.00 C ATOM 1164 NE ARG A 75 15.487 18.532 -2.714 1.00 25.00 N ATOM 1165 CZ ARG A 75 14.699 19.487 -2.233 1.00 25.00 C ATOM 1166 NH1 ARG A 75 13.782 19.254 -1.325 1.00 25.00 N ATOM 1167 NH2 ARG A 75 14.837 20.704 -2.679 1.00 25.00 N ATOM 0 H ARG A 75 14.975 14.308 -5.020 1.00 25.00 H new ATOM 0 HA ARG A 75 12.394 15.491 -4.662 1.00 25.00 H new ATOM 0 HB2 ARG A 75 15.237 16.551 -4.925 1.00 25.00 H new ATOM 0 HB3 ARG A 75 13.867 17.615 -4.674 1.00 25.00 H new ATOM 0 HG2 ARG A 75 13.370 16.638 -2.532 1.00 25.00 H new ATOM 0 HG3 ARG A 75 14.442 15.281 -2.818 1.00 25.00 H new ATOM 0 HD2 ARG A 75 15.352 17.032 -1.246 1.00 25.00 H new ATOM 0 HD3 ARG A 75 16.401 16.642 -2.595 1.00 25.00 H new ATOM 0 HE ARG A 75 16.178 18.808 -3.412 1.00 25.00 H new ATOM 0 HH11 ARG A 75 13.653 18.310 -0.961 1.00 25.00 H new ATOM 0 HH12 ARG A 75 13.198 20.017 -0.983 1.00 25.00 H new ATOM 0 HH21 ARG A 75 15.542 20.911 -3.387 1.00 25.00 H new ATOM 0 HH22 ARG A 75 14.240 21.449 -2.320 1.00 25.00 H new ATOM 1181 N ILE A 76 13.847 15.951 -7.566 1.00 25.00 N ATOM 1182 CA ILE A 76 13.576 16.386 -8.942 1.00 25.00 C ATOM 1183 C ILE A 76 12.671 15.391 -9.674 1.00 25.00 C ATOM 1184 O ILE A 76 12.160 15.681 -10.751 1.00 25.00 O ATOM 1185 CB ILE A 76 14.886 16.632 -9.756 1.00 25.00 C ATOM 1186 CG1 ILE A 76 15.627 15.303 -10.040 1.00 25.00 C ATOM 1187 CG2 ILE A 76 15.785 17.654 -8.997 1.00 25.00 C ATOM 1188 CD1 ILE A 76 16.886 15.455 -10.902 1.00 25.00 C ATOM 0 H ILE A 76 14.761 15.518 -7.433 1.00 25.00 H new ATOM 0 HA ILE A 76 13.053 17.339 -8.867 1.00 25.00 H new ATOM 0 HB ILE A 76 14.631 17.056 -10.727 1.00 25.00 H new ATOM 0 HG12 ILE A 76 15.904 14.845 -9.091 1.00 25.00 H new ATOM 0 HG13 ILE A 76 14.941 14.617 -10.537 1.00 25.00 H new ATOM 0 HG21 ILE A 76 16.699 17.826 -9.565 1.00 25.00 H new ATOM 0 HG22 ILE A 76 15.248 18.595 -8.881 1.00 25.00 H new ATOM 0 HG23 ILE A 76 16.038 17.257 -8.014 1.00 25.00 H new ATOM 0 HD11 ILE A 76 17.344 14.477 -11.053 1.00 25.00 H new ATOM 0 HD12 ILE A 76 16.616 15.882 -11.868 1.00 25.00 H new ATOM 0 HD13 ILE A 76 17.594 16.114 -10.399 1.00 25.00 H new ATOM 1200 N ARG A 77 12.524 14.195 -9.108 1.00 25.00 N ATOM 1201 CA ARG A 77 11.737 13.123 -9.728 1.00 25.00 C ATOM 1202 C ARG A 77 10.313 13.585 -10.030 1.00 25.00 C ATOM 1203 O ARG A 77 9.739 13.213 -11.059 1.00 25.00 O ATOM 1204 CB ARG A 77 11.707 11.907 -8.781 1.00 25.00 C ATOM 1205 CG ARG A 77 11.891 10.533 -9.438 1.00 25.00 C ATOM 1206 CD ARG A 77 10.582 9.956 -9.987 1.00 25.00 C ATOM 1207 NE ARG A 77 10.266 10.506 -11.315 1.00 25.00 N ATOM 1208 CZ ARG A 77 10.564 9.952 -12.480 1.00 25.00 C ATOM 1209 NH1 ARG A 77 11.168 8.792 -12.576 1.00 25.00 N ATOM 1210 NH2 ARG A 77 10.249 10.587 -13.572 1.00 25.00 N ATOM 0 H ARG A 77 12.942 13.939 -8.213 1.00 25.00 H new ATOM 0 HA ARG A 77 12.205 12.848 -10.673 1.00 25.00 H new ATOM 0 HB2 ARG A 77 12.489 12.036 -8.032 1.00 25.00 H new ATOM 0 HB3 ARG A 77 10.755 11.909 -8.251 1.00 25.00 H new ATOM 0 HG2 ARG A 77 12.614 10.618 -10.249 1.00 25.00 H new ATOM 0 HG3 ARG A 77 12.310 9.840 -8.709 1.00 25.00 H new ATOM 0 HD2 ARG A 77 10.660 8.871 -10.051 1.00 25.00 H new ATOM 0 HD3 ARG A 77 9.768 10.177 -9.297 1.00 25.00 H new ATOM 0 HE ARG A 77 9.771 11.398 -11.340 1.00 25.00 H new ATOM 0 HH11 ARG A 77 11.427 8.280 -11.732 1.00 25.00 H new ATOM 0 HH12 ARG A 77 11.379 8.401 -13.494 1.00 25.00 H new ATOM 0 HH21 ARG A 77 9.782 11.492 -13.519 1.00 25.00 H new ATOM 0 HH22 ARG A 77 10.469 10.179 -14.481 1.00 25.00 H new ATOM 1224 N LEU A 78 9.741 14.376 -9.136 1.00 25.00 N ATOM 1225 CA LEU A 78 8.391 14.895 -9.312 1.00 25.00 C ATOM 1226 C LEU A 78 8.255 16.145 -8.458 1.00 25.00 C ATOM 1227 O LEU A 78 8.954 16.287 -7.461 1.00 25.00 O ATOM 1228 CB LEU A 78 7.358 13.848 -8.875 1.00 25.00 C ATOM 1229 CG LEU A 78 6.368 13.390 -9.959 1.00 25.00 C ATOM 1230 CD1 LEU A 78 5.524 12.240 -9.410 1.00 25.00 C ATOM 1231 CD2 LEU A 78 5.451 14.534 -10.416 1.00 25.00 C ATOM 0 H LEU A 78 10.195 14.676 -8.273 1.00 25.00 H new ATOM 0 HA LEU A 78 8.213 15.130 -10.362 1.00 25.00 H new ATOM 0 HB2 LEU A 78 7.891 12.973 -8.503 1.00 25.00 H new ATOM 0 HB3 LEU A 78 6.789 14.254 -8.038 1.00 25.00 H new ATOM 0 HG LEU A 78 6.940 13.061 -10.827 1.00 25.00 H new ATOM 0 HD11 LEU A 78 4.819 11.909 -10.173 1.00 25.00 H new ATOM 0 HD12 LEU A 78 6.175 11.411 -9.134 1.00 25.00 H new ATOM 0 HD13 LEU A 78 4.975 12.579 -8.531 1.00 25.00 H new ATOM 0 HD21 LEU A 78 4.767 14.168 -11.182 1.00 25.00 H new ATOM 0 HD22 LEU A 78 4.879 14.904 -9.565 1.00 25.00 H new ATOM 0 HD23 LEU A 78 6.055 15.343 -10.826 1.00 25.00 H new ATOM 1243 N PHE A 79 7.328 17.013 -8.843 1.00 25.00 N ATOM 1244 CA PHE A 79 7.062 18.265 -8.161 1.00 25.00 C ATOM 1245 C PHE A 79 8.336 19.111 -8.029 1.00 25.00 C ATOM 1246 O PHE A 79 9.159 19.120 -8.935 1.00 25.00 O ATOM 1247 CB PHE A 79 6.410 17.979 -6.813 1.00 25.00 C ATOM 1248 CG PHE A 79 5.278 16.991 -6.886 1.00 25.00 C ATOM 1249 CD1 PHE A 79 4.076 17.321 -7.541 1.00 25.00 C ATOM 1250 CD2 PHE A 79 5.408 15.719 -6.297 1.00 25.00 C ATOM 1251 CE1 PHE A 79 3.014 16.387 -7.620 1.00 25.00 C ATOM 1252 CE2 PHE A 79 4.355 14.774 -6.369 1.00 25.00 C ATOM 1253 CZ PHE A 79 3.157 15.107 -7.036 1.00 25.00 C ATOM 0 H PHE A 79 6.730 16.860 -9.655 1.00 25.00 H new ATOM 0 HA PHE A 79 6.367 18.858 -8.755 1.00 25.00 H new ATOM 0 HB2 PHE A 79 7.167 17.600 -6.126 1.00 25.00 H new ATOM 0 HB3 PHE A 79 6.038 18.914 -6.394 1.00 25.00 H new ATOM 0 HD1 PHE A 79 3.962 18.297 -7.988 1.00 25.00 H new ATOM 0 HD2 PHE A 79 6.322 15.460 -5.784 1.00 25.00 H new ATOM 0 HE1 PHE A 79 2.097 16.652 -8.125 1.00 25.00 H new ATOM 0 HE2 PHE A 79 4.469 13.801 -5.914 1.00 25.00 H new ATOM 0 HZ PHE A 79 2.354 14.388 -7.100 1.00 25.00 H new ATOM 1263 N SER A 80 8.453 19.852 -6.930 1.00 25.00 N ATOM 1264 CA SER A 80 9.588 20.751 -6.667 1.00 25.00 C ATOM 1265 C SER A 80 9.800 21.810 -7.750 1.00 25.00 C ATOM 1266 O SER A 80 10.889 22.347 -7.905 1.00 25.00 O ATOM 1267 CB SER A 80 10.881 19.948 -6.463 1.00 25.00 C ATOM 1268 OG SER A 80 10.692 18.916 -5.507 1.00 25.00 O ATOM 0 H SER A 80 7.757 19.849 -6.184 1.00 25.00 H new ATOM 0 HA SER A 80 9.334 21.287 -5.752 1.00 25.00 H new ATOM 0 HB2 SER A 80 11.199 19.516 -7.412 1.00 25.00 H new ATOM 0 HB3 SER A 80 11.679 20.613 -6.133 1.00 25.00 H new ATOM 0 HG SER A 80 11.059 18.077 -5.855 1.00 25.00 H new ATOM 1274 N ALA A 81 8.728 22.119 -8.463 1.00 25.00 N ATOM 1275 CA ALA A 81 8.744 23.094 -9.555 1.00 25.00 C ATOM 1276 C ALA A 81 8.235 24.453 -9.060 1.00 25.00 C ATOM 1277 O ALA A 81 7.512 25.156 -9.760 1.00 25.00 O ATOM 1278 CB ALA A 81 7.879 22.581 -10.713 1.00 25.00 C ATOM 0 H ALA A 81 7.812 21.699 -8.303 1.00 25.00 H new ATOM 0 HA ALA A 81 9.767 23.223 -9.909 1.00 25.00 H new ATOM 0 HB1 ALA A 81 7.891 23.307 -11.526 1.00 25.00 H new ATOM 0 HB2 ALA A 81 8.275 21.630 -11.070 1.00 25.00 H new ATOM 0 HB3 ALA A 81 6.855 22.440 -10.368 1.00 25.00 H new ATOM 1284 N ASP A 82 8.591 24.789 -7.831 1.00 25.00 N ATOM 1285 CA ASP A 82 8.155 26.043 -7.209 1.00 25.00 C ATOM 1286 C ASP A 82 9.395 26.892 -6.902 1.00 25.00 C ATOM 1287 O ASP A 82 10.033 26.721 -5.856 1.00 25.00 O ATOM 1288 CB ASP A 82 7.392 25.708 -5.919 1.00 25.00 C ATOM 1289 CG ASP A 82 6.809 26.936 -5.241 1.00 25.00 C ATOM 1290 OD1 ASP A 82 6.577 27.952 -5.924 1.00 25.00 O ATOM 1291 OD2 ASP A 82 6.502 26.846 -4.030 1.00 25.00 O ATOM 0 H ASP A 82 9.184 24.211 -7.236 1.00 25.00 H new ATOM 0 HA ASP A 82 7.498 26.604 -7.874 1.00 25.00 H new ATOM 0 HB2 ASP A 82 6.587 25.010 -6.150 1.00 25.00 H new ATOM 0 HB3 ASP A 82 8.064 25.202 -5.226 1.00 25.00 H new ATOM 1296 N PRO A 83 9.790 27.782 -7.834 1.00 25.00 N ATOM 1297 CA PRO A 83 10.997 28.564 -7.559 1.00 25.00 C ATOM 1298 C PRO A 83 10.719 29.828 -6.753 1.00 25.00 C ATOM 1299 O PRO A 83 9.646 30.416 -6.830 1.00 25.00 O ATOM 1300 CB PRO A 83 11.471 28.934 -8.961 1.00 25.00 C ATOM 1301 CG PRO A 83 10.218 29.151 -9.692 1.00 25.00 C ATOM 1302 CD PRO A 83 9.248 28.100 -9.170 1.00 25.00 C ATOM 0 HA PRO A 83 11.718 28.007 -6.960 1.00 25.00 H new ATOM 0 HB2 PRO A 83 12.093 29.829 -8.953 1.00 25.00 H new ATOM 0 HB3 PRO A 83 12.065 28.137 -9.408 1.00 25.00 H new ATOM 0 HG2 PRO A 83 9.834 30.157 -9.521 1.00 25.00 H new ATOM 0 HG3 PRO A 83 10.368 29.046 -10.766 1.00 25.00 H new ATOM 0 HD2 PRO A 83 8.230 28.484 -9.111 1.00 25.00 H new ATOM 0 HD3 PRO A 83 9.220 27.221 -9.814 1.00 25.00 H new ATOM 1310 N PHE A 84 11.729 30.285 -6.037 1.00 25.00 N ATOM 1311 CA PHE A 84 11.642 31.546 -5.293 1.00 25.00 C ATOM 1312 C PHE A 84 12.775 32.442 -5.750 1.00 25.00 C ATOM 1313 O PHE A 84 12.973 33.556 -5.279 1.00 25.00 O ATOM 1314 CB PHE A 84 11.713 31.286 -3.781 1.00 25.00 C ATOM 1315 CG PHE A 84 10.363 31.059 -3.140 1.00 25.00 C ATOM 1316 CD1 PHE A 84 9.869 31.979 -2.193 1.00 25.00 C ATOM 1317 CD2 PHE A 84 9.573 29.939 -3.476 1.00 25.00 C ATOM 1318 CE1 PHE A 84 8.601 31.784 -1.582 1.00 25.00 C ATOM 1319 CE2 PHE A 84 8.303 29.740 -2.882 1.00 25.00 C ATOM 1320 CZ PHE A 84 7.817 30.663 -1.932 1.00 25.00 C ATOM 0 H PHE A 84 12.626 29.807 -5.949 1.00 25.00 H new ATOM 0 HA PHE A 84 10.688 32.035 -5.489 1.00 25.00 H new ATOM 0 HB2 PHE A 84 12.342 30.415 -3.600 1.00 25.00 H new ATOM 0 HB3 PHE A 84 12.197 32.135 -3.298 1.00 25.00 H new ATOM 0 HD1 PHE A 84 10.461 32.842 -1.929 1.00 25.00 H new ATOM 0 HD2 PHE A 84 9.942 29.224 -4.196 1.00 25.00 H new ATOM 0 HE1 PHE A 84 8.238 32.492 -0.852 1.00 25.00 H new ATOM 0 HE2 PHE A 84 7.707 28.882 -3.156 1.00 25.00 H new ATOM 0 HZ PHE A 84 6.850 30.513 -1.475 1.00 25.00 H new ATOM 1330 N ASP A 85 13.486 31.930 -6.733 1.00 25.00 N ATOM 1331 CA ASP A 85 14.672 32.565 -7.302 1.00 25.00 C ATOM 1332 C ASP A 85 14.257 33.397 -8.506 1.00 25.00 C ATOM 1333 O ASP A 85 14.875 33.365 -9.563 1.00 25.00 O ATOM 1334 CB ASP A 85 15.678 31.485 -7.712 1.00 25.00 C ATOM 1335 CG ASP A 85 16.084 30.602 -6.545 1.00 25.00 C ATOM 1336 OD1 ASP A 85 17.169 30.829 -5.972 1.00 25.00 O ATOM 1337 OD2 ASP A 85 15.290 29.693 -6.180 1.00 25.00 O ATOM 0 H ASP A 85 13.255 31.040 -7.174 1.00 25.00 H new ATOM 0 HA ASP A 85 15.143 33.217 -6.566 1.00 25.00 H new ATOM 0 HB2 ASP A 85 15.244 30.867 -8.498 1.00 25.00 H new ATOM 0 HB3 ASP A 85 16.565 31.959 -8.132 1.00 25.00 H new ATOM 1342 N LEU A 86 13.162 34.120 -8.341 1.00 25.00 N ATOM 1343 CA LEU A 86 12.572 34.909 -9.422 1.00 25.00 C ATOM 1344 C LEU A 86 13.493 36.065 -9.819 1.00 25.00 C ATOM 1345 O LEU A 86 13.464 36.553 -10.946 1.00 25.00 O ATOM 1346 CB LEU A 86 11.199 35.439 -8.976 1.00 25.00 C ATOM 1347 CG LEU A 86 10.190 34.381 -8.468 1.00 25.00 C ATOM 1348 CD1 LEU A 86 8.921 35.079 -7.989 1.00 25.00 C ATOM 1349 CD2 LEU A 86 9.825 33.343 -9.535 1.00 25.00 C ATOM 0 H LEU A 86 12.654 34.180 -7.458 1.00 25.00 H new ATOM 0 HA LEU A 86 12.444 34.272 -10.297 1.00 25.00 H new ATOM 0 HB2 LEU A 86 11.355 36.171 -8.184 1.00 25.00 H new ATOM 0 HB3 LEU A 86 10.747 35.968 -9.815 1.00 25.00 H new ATOM 0 HG LEU A 86 10.672 33.846 -7.649 1.00 25.00 H new ATOM 0 HD11 LEU A 86 8.209 34.335 -7.631 1.00 25.00 H new ATOM 0 HD12 LEU A 86 9.167 35.765 -7.179 1.00 25.00 H new ATOM 0 HD13 LEU A 86 8.478 35.636 -8.815 1.00 25.00 H new ATOM 0 HD21 LEU A 86 9.115 32.628 -9.119 1.00 25.00 H new ATOM 0 HD22 LEU A 86 9.376 33.845 -10.392 1.00 25.00 H new ATOM 0 HD23 LEU A 86 10.725 32.817 -9.853 1.00 25.00 H new ATOM 1361 N GLU A 87 14.326 36.467 -8.872 1.00 25.00 N ATOM 1362 CA GLU A 87 15.287 37.555 -9.059 1.00 25.00 C ATOM 1363 C GLU A 87 16.553 37.108 -9.793 1.00 25.00 C ATOM 1364 O GLU A 87 17.326 37.930 -10.280 1.00 25.00 O ATOM 1365 CB GLU A 87 15.719 38.066 -7.685 1.00 25.00 C ATOM 1366 CG GLU A 87 14.604 38.712 -6.862 1.00 25.00 C ATOM 1367 CD GLU A 87 14.395 40.181 -7.204 1.00 25.00 C ATOM 1368 OE1 GLU A 87 14.644 41.034 -6.322 1.00 25.00 O ATOM 1369 OE2 GLU A 87 13.953 40.485 -8.333 1.00 25.00 O ATOM 0 H GLU A 87 14.358 36.047 -7.943 1.00 25.00 H new ATOM 0 HA GLU A 87 14.792 38.321 -9.656 1.00 25.00 H new ATOM 0 HB2 GLU A 87 16.135 37.233 -7.117 1.00 25.00 H new ATOM 0 HB3 GLU A 87 16.521 38.793 -7.819 1.00 25.00 H new ATOM 0 HG2 GLU A 87 13.674 38.169 -7.029 1.00 25.00 H new ATOM 0 HG3 GLU A 87 14.841 38.620 -5.802 1.00 25.00 H new ATOM 1376 N ALA A 88 16.792 35.804 -9.810 1.00 25.00 N ATOM 1377 CA ALA A 88 18.045 35.216 -10.310 1.00 25.00 C ATOM 1378 C ALA A 88 18.134 35.158 -11.845 1.00 25.00 C ATOM 1379 O ALA A 88 18.637 34.185 -12.419 1.00 25.00 O ATOM 1380 CB ALA A 88 18.220 33.808 -9.719 1.00 25.00 C ATOM 0 H ALA A 88 16.122 35.112 -9.476 1.00 25.00 H new ATOM 0 HA ALA A 88 18.852 35.874 -9.986 1.00 25.00 H new ATOM 0 HB1 ALA A 88 19.148 33.371 -10.088 1.00 25.00 H new ATOM 0 HB2 ALA A 88 18.257 33.872 -8.631 1.00 25.00 H new ATOM 0 HB3 ALA A 88 17.380 33.181 -10.017 1.00 25.00 H new ATOM 1386 N GLN A 89 17.642 36.193 -12.502 1.00 25.00 N ATOM 1387 CA GLN A 89 17.673 36.264 -13.958 1.00 25.00 C ATOM 1388 C GLN A 89 19.124 36.270 -14.449 1.00 25.00 C ATOM 1389 O GLN A 89 19.954 37.053 -13.992 1.00 25.00 O ATOM 1390 CB GLN A 89 16.952 37.515 -14.452 1.00 25.00 C ATOM 1391 CG GLN A 89 15.493 37.589 -13.990 1.00 25.00 C ATOM 1392 CD GLN A 89 14.736 38.756 -14.591 1.00 25.00 C ATOM 1393 OE1 GLN A 89 15.214 39.439 -15.488 1.00 25.00 O ATOM 1394 NE2 GLN A 89 13.547 38.984 -14.103 1.00 25.00 N ATOM 0 H GLN A 89 17.214 37.001 -12.051 1.00 25.00 H new ATOM 0 HA GLN A 89 17.161 35.389 -14.358 1.00 25.00 H new ATOM 0 HB2 GLN A 89 17.484 38.398 -14.098 1.00 25.00 H new ATOM 0 HB3 GLN A 89 16.984 37.539 -15.541 1.00 25.00 H new ATOM 0 HG2 GLN A 89 14.987 36.661 -14.255 1.00 25.00 H new ATOM 0 HG3 GLN A 89 15.466 37.668 -12.903 1.00 25.00 H new ATOM 0 HE21 GLN A 89 13.181 38.394 -13.356 1.00 25.00 H new ATOM 0 HE22 GLN A 89 12.984 39.752 -14.469 1.00 25.00 H new ATOM 1403 N ALA A 90 19.429 35.359 -15.359 1.00 25.00 N ATOM 1404 CA ALA A 90 20.785 35.213 -15.874 1.00 25.00 C ATOM 1405 C ALA A 90 21.138 36.392 -16.778 1.00 25.00 C ATOM 1406 O ALA A 90 20.328 36.825 -17.600 1.00 25.00 O ATOM 1407 CB ALA A 90 20.912 33.889 -16.638 1.00 25.00 C ATOM 0 H ALA A 90 18.755 34.706 -15.759 1.00 25.00 H new ATOM 0 HA ALA A 90 21.484 35.203 -15.038 1.00 25.00 H new ATOM 0 HB1 ALA A 90 21.927 33.786 -17.020 1.00 25.00 H new ATOM 0 HB2 ALA A 90 20.691 33.059 -15.967 1.00 25.00 H new ATOM 0 HB3 ALA A 90 20.208 33.880 -17.470 1.00 25.00 H new ATOM 1413 N LYS A 91 22.362 36.881 -16.647 1.00 25.00 N ATOM 1414 CA LYS A 91 22.842 37.989 -17.465 1.00 25.00 C ATOM 1415 C LYS A 91 24.340 37.854 -17.576 1.00 25.00 C ATOM 1416 O LYS A 91 24.987 37.299 -16.697 1.00 25.00 O ATOM 1417 CB LYS A 91 22.526 39.323 -16.783 1.00 25.00 C ATOM 1418 CG LYS A 91 22.497 40.552 -17.696 1.00 25.00 C ATOM 1419 CD LYS A 91 22.367 41.806 -16.838 1.00 25.00 C ATOM 1420 CE LYS A 91 22.366 43.076 -17.669 1.00 25.00 C ATOM 1421 NZ LYS A 91 22.442 44.278 -16.761 1.00 25.00 N ATOM 0 H LYS A 91 23.046 36.527 -15.978 1.00 25.00 H new ATOM 0 HA LYS A 91 22.362 37.966 -18.443 1.00 25.00 H new ATOM 0 HB2 LYS A 91 21.557 39.237 -16.292 1.00 25.00 H new ATOM 0 HB3 LYS A 91 23.266 39.493 -16.001 1.00 25.00 H new ATOM 0 HG2 LYS A 91 23.407 40.598 -18.294 1.00 25.00 H new ATOM 0 HG3 LYS A 91 21.661 40.484 -18.392 1.00 25.00 H new ATOM 0 HD2 LYS A 91 21.445 41.753 -16.259 1.00 25.00 H new ATOM 0 HD3 LYS A 91 23.190 41.842 -16.125 1.00 25.00 H new ATOM 0 HE2 LYS A 91 23.212 43.073 -18.356 1.00 25.00 H new ATOM 0 HE3 LYS A 91 21.462 43.124 -18.277 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 22.424 45.147 -17.333 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 21.630 44.274 -16.111 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 23.325 44.243 -16.212 1.00 25.00 H new ATOM 1435 N ILE A 92 24.881 38.437 -18.622 1.00 25.00 N ATOM 1436 CA ILE A 92 26.317 38.563 -18.801 1.00 25.00 C ATOM 1437 C ILE A 92 26.478 40.019 -19.180 1.00 25.00 C ATOM 1438 O ILE A 92 25.936 40.466 -20.188 1.00 25.00 O ATOM 1439 CB ILE A 92 26.885 37.625 -19.918 1.00 25.00 C ATOM 1440 CG1 ILE A 92 26.618 36.147 -19.552 1.00 25.00 C ATOM 1441 CG2 ILE A 92 28.416 37.876 -20.093 1.00 25.00 C ATOM 1442 CD1 ILE A 92 26.994 35.132 -20.649 1.00 25.00 C ATOM 0 H ILE A 92 24.334 38.842 -19.382 1.00 25.00 H new ATOM 0 HA ILE A 92 26.869 38.270 -17.908 1.00 25.00 H new ATOM 0 HB ILE A 92 26.384 37.846 -20.861 1.00 25.00 H new ATOM 0 HG12 ILE A 92 27.175 35.905 -18.647 1.00 25.00 H new ATOM 0 HG13 ILE A 92 25.560 36.031 -19.316 1.00 25.00 H new ATOM 0 HG21 ILE A 92 28.806 37.220 -20.872 1.00 25.00 H new ATOM 0 HG22 ILE A 92 28.584 38.915 -20.376 1.00 25.00 H new ATOM 0 HG23 ILE A 92 28.928 37.668 -19.154 1.00 25.00 H new ATOM 0 HD11 ILE A 92 26.772 34.123 -20.303 1.00 25.00 H new ATOM 0 HD12 ILE A 92 26.419 35.341 -21.551 1.00 25.00 H new ATOM 0 HD13 ILE A 92 28.058 35.213 -20.871 1.00 25.00 H new ATOM 1454 N GLU A 93 27.151 40.772 -18.333 1.00 25.00 N ATOM 1455 CA GLU A 93 27.357 42.189 -18.557 1.00 25.00 C ATOM 1456 C GLU A 93 28.853 42.442 -18.499 1.00 25.00 C ATOM 1457 O GLU A 93 29.581 41.754 -17.778 1.00 25.00 O ATOM 1458 CB GLU A 93 26.616 43.013 -17.506 1.00 25.00 C ATOM 1459 CG GLU A 93 26.705 42.463 -16.092 1.00 25.00 C ATOM 1460 CD GLU A 93 26.395 43.528 -15.066 1.00 25.00 C ATOM 1461 OE1 GLU A 93 27.306 43.868 -14.272 1.00 25.00 O ATOM 1462 OE2 GLU A 93 25.260 44.067 -15.088 1.00 25.00 O ATOM 0 H GLU A 93 27.570 40.420 -17.472 1.00 25.00 H new ATOM 0 HA GLU A 93 26.962 42.488 -19.528 1.00 25.00 H new ATOM 0 HB2 GLU A 93 27.014 44.028 -17.513 1.00 25.00 H new ATOM 0 HB3 GLU A 93 25.566 43.080 -17.790 1.00 25.00 H new ATOM 0 HG2 GLU A 93 26.008 41.632 -15.978 1.00 25.00 H new ATOM 0 HG3 GLU A 93 27.705 42.066 -15.916 1.00 25.00 H new ATOM 1469 N GLU A 94 29.314 43.391 -19.292 1.00 25.00 N ATOM 1470 CA GLU A 94 30.731 43.673 -19.413 1.00 25.00 C ATOM 1471 C GLU A 94 30.884 45.161 -19.674 1.00 25.00 C ATOM 1472 O GLU A 94 29.990 45.783 -20.237 1.00 25.00 O ATOM 1473 CB GLU A 94 31.314 42.865 -20.576 1.00 25.00 C ATOM 1474 CG GLU A 94 32.622 42.173 -20.247 1.00 25.00 C ATOM 1475 CD GLU A 94 33.754 43.160 -20.090 1.00 25.00 C ATOM 1476 OE1 GLU A 94 34.334 43.561 -21.111 1.00 25.00 O ATOM 1477 OE2 GLU A 94 33.995 43.620 -18.950 1.00 25.00 O ATOM 0 H GLU A 94 28.719 43.986 -19.868 1.00 25.00 H new ATOM 0 HA GLU A 94 31.263 43.396 -18.503 1.00 25.00 H new ATOM 0 HB2 GLU A 94 30.586 42.116 -20.886 1.00 25.00 H new ATOM 0 HB3 GLU A 94 31.469 43.530 -21.426 1.00 25.00 H new ATOM 0 HG2 GLU A 94 32.509 41.600 -19.327 1.00 25.00 H new ATOM 0 HG3 GLU A 94 32.866 41.462 -21.037 1.00 25.00 H new ATOM 1484 N ASP A 95 32.001 45.714 -19.233 1.00 25.00 N ATOM 1485 CA ASP A 95 32.291 47.145 -19.362 1.00 25.00 C ATOM 1486 C ASP A 95 33.809 47.301 -19.429 1.00 25.00 C ATOM 1487 O ASP A 95 34.407 48.037 -18.649 1.00 25.00 O ATOM 1488 CB ASP A 95 31.719 47.914 -18.162 1.00 25.00 C ATOM 1489 CG ASP A 95 31.716 49.422 -18.382 1.00 25.00 C ATOM 1490 OD1 ASP A 95 31.547 50.168 -17.390 1.00 25.00 O ATOM 1491 OD2 ASP A 95 31.810 49.862 -19.551 1.00 25.00 O ATOM 0 H ASP A 95 32.741 45.185 -18.771 1.00 25.00 H new ATOM 0 HA ASP A 95 31.829 47.552 -20.262 1.00 25.00 H new ATOM 0 HB2 ASP A 95 30.701 47.576 -17.970 1.00 25.00 H new ATOM 0 HB3 ASP A 95 32.305 47.681 -17.273 1.00 25.00 H new ATOM 1496 N ILE A 96 34.418 46.489 -20.295 1.00 25.00 N ATOM 1497 CA ILE A 96 35.882 46.350 -20.464 1.00 25.00 C ATOM 1498 C ILE A 96 36.670 46.335 -19.142 1.00 25.00 C ATOM 1499 O ILE A 96 37.804 46.814 -19.048 1.00 25.00 O ATOM 1500 CB ILE A 96 36.464 47.372 -21.501 1.00 25.00 C ATOM 1501 CG1 ILE A 96 36.220 48.831 -21.066 1.00 25.00 C ATOM 1502 CG2 ILE A 96 35.827 47.120 -22.896 1.00 25.00 C ATOM 1503 CD1 ILE A 96 37.098 49.862 -21.789 1.00 25.00 C ATOM 0 H ILE A 96 33.893 45.883 -20.926 1.00 25.00 H new ATOM 0 HA ILE A 96 36.025 45.355 -20.885 1.00 25.00 H new ATOM 0 HB ILE A 96 37.542 47.220 -21.554 1.00 25.00 H new ATOM 0 HG12 ILE A 96 35.173 49.079 -21.238 1.00 25.00 H new ATOM 0 HG13 ILE A 96 36.394 48.912 -19.993 1.00 25.00 H new ATOM 0 HG21 ILE A 96 36.233 47.831 -23.615 1.00 25.00 H new ATOM 0 HG22 ILE A 96 36.054 46.105 -23.222 1.00 25.00 H new ATOM 0 HG23 ILE A 96 34.746 47.247 -22.831 1.00 25.00 H new ATOM 0 HD11 ILE A 96 36.862 50.861 -21.423 1.00 25.00 H new ATOM 0 HD12 ILE A 96 38.149 49.644 -21.597 1.00 25.00 H new ATOM 0 HD13 ILE A 96 36.908 49.814 -22.861 1.00 25.00 H new ATOM 1515 N ARG A 97 36.079 45.714 -18.130 1.00 25.00 N ATOM 1516 CA ARG A 97 36.664 45.628 -16.785 1.00 25.00 C ATOM 1517 C ARG A 97 37.547 44.387 -16.674 1.00 25.00 C ATOM 1518 O ARG A 97 37.423 43.560 -15.770 1.00 25.00 O ATOM 1519 CB ARG A 97 35.548 45.646 -15.718 1.00 25.00 C ATOM 1520 CG ARG A 97 34.371 44.714 -16.012 1.00 25.00 C ATOM 1521 CD ARG A 97 33.257 44.840 -14.995 1.00 25.00 C ATOM 1522 NE ARG A 97 32.116 43.988 -15.378 1.00 25.00 N ATOM 1523 CZ ARG A 97 30.899 44.044 -14.845 1.00 25.00 C ATOM 1524 NH1 ARG A 97 30.581 44.884 -13.893 1.00 25.00 N ATOM 1525 NH2 ARG A 97 29.976 43.247 -15.279 1.00 25.00 N ATOM 0 H ARG A 97 35.174 45.251 -18.213 1.00 25.00 H new ATOM 0 HA ARG A 97 37.299 46.496 -16.608 1.00 25.00 H new ATOM 0 HB2 ARG A 97 35.979 45.372 -14.755 1.00 25.00 H new ATOM 0 HB3 ARG A 97 35.172 46.665 -15.621 1.00 25.00 H new ATOM 0 HG2 ARG A 97 33.978 44.934 -17.004 1.00 25.00 H new ATOM 0 HG3 ARG A 97 34.725 43.683 -16.031 1.00 25.00 H new ATOM 0 HD2 ARG A 97 33.621 44.551 -14.009 1.00 25.00 H new ATOM 0 HD3 ARG A 97 32.936 45.879 -14.924 1.00 25.00 H new ATOM 0 HE ARG A 97 32.273 43.298 -16.113 1.00 25.00 H new ATOM 0 HH11 ARG A 97 31.280 45.532 -13.530 1.00 25.00 H new ATOM 0 HH12 ARG A 97 29.634 44.891 -13.514 1.00 25.00 H new ATOM 0 HH21 ARG A 97 30.185 42.583 -16.024 1.00 25.00 H new ATOM 0 HH22 ARG A 97 29.040 43.283 -14.876 1.00 25.00 H new ATOM 1539 N GLN A 98 38.473 44.275 -17.631 1.00 25.00 N ATOM 1540 CA GLN A 98 39.433 43.173 -17.697 1.00 25.00 C ATOM 1541 C GLN A 98 40.358 43.155 -16.475 1.00 25.00 C ATOM 1542 O GLN A 98 41.049 44.079 -16.111 1.00 25.00 O ATOM 1543 CB GLN A 98 40.246 43.241 -19.015 1.00 25.00 C ATOM 1544 CG GLN A 98 41.188 42.025 -19.180 1.00 25.00 C ATOM 1545 CD GLN A 98 40.419 40.738 -19.342 1.00 25.00 C ATOM 1546 OE1 GLN A 98 39.826 40.429 -20.343 1.00 25.00 O ATOM 1547 NE2 GLN A 98 40.433 39.913 -18.304 1.00 25.00 N ATOM 1548 OXT GLN A 98 40.377 42.023 -15.852 1.00 25.00 O ATOM 0 H GLN A 98 38.577 44.952 -18.386 1.00 25.00 H new ATOM 0 HA GLN A 98 38.872 42.239 -17.688 1.00 25.00 H new ATOM 0 HB2 GLN A 98 39.561 43.286 -19.861 1.00 25.00 H new ATOM 0 HB3 GLN A 98 40.833 44.159 -19.031 1.00 25.00 H new ATOM 0 HG2 GLN A 98 41.829 42.177 -20.048 1.00 25.00 H new ATOM 0 HG3 GLN A 98 41.841 41.951 -18.311 1.00 25.00 H new ATOM 0 HE21 GLN A 98 40.934 40.171 -17.454 1.00 25.00 H new ATOM 0 HE22 GLN A 98 39.942 39.020 -18.356 1.00 25.00 H new TER 1558 GLN A 98