USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1077 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 132 SER OG : rot 150:sc= -0.324 USER MOD Set 1.2: A 134 ASN : amide:sc= -0.394 K(o=-0.72,f=-2.3!) USER MOD Set 2.1: A 80 LYS NZ :NH3+ -129:sc= -0.618 (180deg=-2.76!) USER MOD Set 2.2: A 82 ASN :FLIP amide:sc= 0 F(o=-2.1,f=-0.62) USER MOD Set 3.1: A 23 ASN : amide:sc= -2.97 K(o=-3,f=-9!) USER MOD Set 3.2: A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 133:sc= -1.01 (180deg=-1.83) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.737 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.008 USER MOD Single : A 10 GLN : amide:sc= -1.21 X(o=-1.2,f=-1.6) USER MOD Single : A 18 LYS NZ :NH3+ -166:sc= 0.0209 (180deg=-0.18) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -0.751 K(o=-0.75,f=-5!) USER MOD Single : A 38 ASN : amide:sc= -2.63 K(o=-2.6,f=-6.5!) USER MOD Single : A 39 MET CE :methyl -133:sc= -2.78 (180deg=-6.63!) USER MOD Single : A 43 HIS : no HD1:sc= -0.225 X(o=-0.22,f=-0.063) USER MOD Single : A 45 SER OG : rot 180:sc= 0.877 USER MOD Single : A 47 TYR OH : rot 30:sc= 0 USER MOD Single : A 48 TYR OH : rot -6:sc= -3.6! USER MOD Single : A 55 HIS :FLIP no HD1:sc= -0.158 F(o=-1,f=-0.16) USER MOD Single : A 63 SER OG : rot 130:sc= -0.101 USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.275 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 69 SER OG : rot 180:sc=0.000466 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 CYS SG : rot -14:sc= 0.737 USER MOD Single : A 75 ASN : amide:sc= 0.366 K(o=0.37,f=-0.33) USER MOD Single : A 77 LYS NZ :NH3+ -164:sc= -1.2 (180deg=-1.6) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN :FLIP amide:sc= -0.0628 F(o=-0.86,f=-0.063) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -137:sc= -0.137 (180deg=-1.6!) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc=-0.00147 X(o=-0.0015,f=-0.2) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.102) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot -48:sc= 0.94 USER MOD Single : A 119 GLN : amide:sc= -1.47 K(o=-1.5,f=-2.4) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.0979 K(o=-0.098,f=-1.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.445 0.918 -0.348 1.00 0.00 N ATOM 2 CA GLY A 1 1.682 -0.089 -1.063 1.00 0.00 C ATOM 3 C GLY A 1 2.461 -1.375 -1.259 1.00 0.00 C ATOM 4 O GLY A 1 2.861 -2.020 -0.289 1.00 0.00 O ATOM 0 H1 GLY A 1 2.365 1.830 -0.842 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.073 1.014 0.618 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.444 0.633 -0.308 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.765 -0.303 -0.514 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.387 0.305 -2.035 1.00 0.00 H new ATOM 8 N ILE A 2 2.674 -1.749 -2.516 1.00 0.00 N ATOM 9 CA ILE A 2 3.409 -2.967 -2.835 1.00 0.00 C ATOM 10 C ILE A 2 4.343 -2.750 -4.021 1.00 0.00 C ATOM 11 O ILE A 2 3.897 -2.461 -5.132 1.00 0.00 O ATOM 12 CB ILE A 2 2.455 -4.133 -3.153 1.00 0.00 C ATOM 13 CG1 ILE A 2 1.399 -4.271 -2.056 1.00 0.00 C ATOM 14 CG2 ILE A 2 3.237 -5.429 -3.309 1.00 0.00 C ATOM 15 CD1 ILE A 2 0.298 -5.250 -2.396 1.00 0.00 C ATOM 0 H ILE A 2 2.348 -1.227 -3.329 1.00 0.00 H new ATOM 0 HA ILE A 2 3.998 -3.221 -1.954 1.00 0.00 H new ATOM 0 HB ILE A 2 1.948 -3.921 -4.094 1.00 0.00 H new ATOM 0 HG12 ILE A 2 1.885 -4.589 -1.134 1.00 0.00 H new ATOM 0 HG13 ILE A 2 0.958 -3.293 -1.863 1.00 0.00 H new ATOM 0 HG21 ILE A 2 2.549 -6.244 -3.534 1.00 0.00 H new ATOM 0 HG22 ILE A 2 3.955 -5.325 -4.123 1.00 0.00 H new ATOM 0 HG23 ILE A 2 3.768 -5.647 -2.383 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -0.415 -5.296 -1.573 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -0.214 -4.922 -3.301 1.00 0.00 H new ATOM 0 HD13 ILE A 2 0.728 -6.238 -2.560 1.00 0.00 H new ATOM 27 N THR A 3 5.642 -2.894 -3.779 1.00 0.00 N ATOM 28 CA THR A 3 6.640 -2.715 -4.826 1.00 0.00 C ATOM 29 C THR A 3 8.053 -2.804 -4.261 1.00 0.00 C ATOM 30 O THR A 3 8.323 -2.390 -3.133 1.00 0.00 O ATOM 31 CB THR A 3 6.468 -1.360 -5.539 1.00 0.00 C ATOM 32 OG1 THR A 3 7.647 -1.050 -6.292 1.00 0.00 O ATOM 33 CG2 THR A 3 6.196 -0.251 -4.535 1.00 0.00 C ATOM 0 H THR A 3 6.028 -3.134 -2.866 1.00 0.00 H new ATOM 0 HA THR A 3 6.490 -3.519 -5.547 1.00 0.00 H new ATOM 0 HB THR A 3 5.615 -1.435 -6.214 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.529 -0.188 -6.744 1.00 0.00 H new ATOM 0 HG21 THR A 3 6.078 0.696 -5.062 1.00 0.00 H new ATOM 0 HG22 THR A 3 5.283 -0.475 -3.983 1.00 0.00 H new ATOM 0 HG23 THR A 3 7.032 -0.177 -3.839 1.00 0.00 H new ATOM 41 N PRO A 4 8.977 -3.355 -5.061 1.00 0.00 N ATOM 42 CA PRO A 4 10.379 -3.510 -4.661 1.00 0.00 C ATOM 43 C PRO A 4 11.108 -2.173 -4.576 1.00 0.00 C ATOM 44 O PRO A 4 11.758 -1.873 -3.575 1.00 0.00 O ATOM 45 CB PRO A 4 10.973 -4.373 -5.777 1.00 0.00 C ATOM 46 CG PRO A 4 10.107 -4.111 -6.961 1.00 0.00 C ATOM 47 CD PRO A 4 8.725 -3.870 -6.417 1.00 0.00 C ATOM 0 HA PRO A 4 10.474 -3.949 -3.668 1.00 0.00 H new ATOM 0 HB2 PRO A 4 12.010 -4.102 -5.977 1.00 0.00 H new ATOM 0 HB3 PRO A 4 10.966 -5.429 -5.507 1.00 0.00 H new ATOM 0 HG2 PRO A 4 10.462 -3.246 -7.521 1.00 0.00 H new ATOM 0 HG3 PRO A 4 10.115 -4.959 -7.646 1.00 0.00 H new ATOM 0 HD2 PRO A 4 8.174 -3.151 -7.024 1.00 0.00 H new ATOM 0 HD3 PRO A 4 8.136 -4.787 -6.396 1.00 0.00 H new ATOM 55 N ARG A 5 10.996 -1.375 -5.633 1.00 0.00 N ATOM 56 CA ARG A 5 11.646 -0.071 -5.677 1.00 0.00 C ATOM 57 C ARG A 5 10.953 0.848 -6.680 1.00 0.00 C ATOM 58 O ARG A 5 10.479 0.399 -7.724 1.00 0.00 O ATOM 59 CB ARG A 5 13.122 -0.225 -6.046 1.00 0.00 C ATOM 60 CG ARG A 5 14.041 -0.355 -4.842 1.00 0.00 C ATOM 61 CD ARG A 5 14.571 -1.773 -4.697 1.00 0.00 C ATOM 62 NE ARG A 5 15.968 -1.794 -4.272 1.00 0.00 N ATOM 63 CZ ARG A 5 16.370 -1.455 -3.053 1.00 0.00 C ATOM 64 NH1 ARG A 5 15.486 -1.070 -2.142 1.00 0.00 N ATOM 65 NH2 ARG A 5 17.659 -1.500 -2.742 1.00 0.00 N ATOM 0 H ARG A 5 10.462 -1.609 -6.470 1.00 0.00 H new ATOM 0 HA ARG A 5 11.571 0.378 -4.686 1.00 0.00 H new ATOM 0 HB2 ARG A 5 13.240 -1.105 -6.679 1.00 0.00 H new ATOM 0 HB3 ARG A 5 13.432 0.637 -6.637 1.00 0.00 H new ATOM 0 HG2 ARG A 5 14.876 0.338 -4.944 1.00 0.00 H new ATOM 0 HG3 ARG A 5 13.501 -0.073 -3.938 1.00 0.00 H new ATOM 0 HD2 ARG A 5 13.963 -2.315 -3.972 1.00 0.00 H new ATOM 0 HD3 ARG A 5 14.474 -2.296 -5.649 1.00 0.00 H new ATOM 0 HE ARG A 5 16.673 -2.085 -4.949 1.00 0.00 H new ATOM 0 HH11 ARG A 5 14.494 -1.034 -2.377 1.00 0.00 H new ATOM 0 HH12 ARG A 5 15.798 -0.810 -1.206 1.00 0.00 H new ATOM 0 HH21 ARG A 5 18.342 -1.795 -3.440 1.00 0.00 H new ATOM 0 HH22 ARG A 5 17.967 -1.239 -1.805 1.00 0.00 H new ATOM 79 N PHE A 6 10.898 2.135 -6.355 1.00 0.00 N ATOM 80 CA PHE A 6 10.262 3.117 -7.226 1.00 0.00 C ATOM 81 C PHE A 6 10.726 4.530 -6.883 1.00 0.00 C ATOM 82 O PHE A 6 10.761 4.917 -5.716 1.00 0.00 O ATOM 83 CB PHE A 6 8.739 3.025 -7.107 1.00 0.00 C ATOM 84 CG PHE A 6 8.217 3.447 -5.763 1.00 0.00 C ATOM 85 CD1 PHE A 6 8.070 2.523 -4.741 1.00 0.00 C ATOM 86 CD2 PHE A 6 7.872 4.767 -5.522 1.00 0.00 C ATOM 87 CE1 PHE A 6 7.589 2.907 -3.504 1.00 0.00 C ATOM 88 CE2 PHE A 6 7.392 5.158 -4.287 1.00 0.00 C ATOM 89 CZ PHE A 6 7.249 4.227 -3.277 1.00 0.00 C ATOM 0 H PHE A 6 11.286 2.523 -5.495 1.00 0.00 H new ATOM 0 HA PHE A 6 10.553 2.897 -8.253 1.00 0.00 H new ATOM 0 HB2 PHE A 6 8.284 3.648 -7.877 1.00 0.00 H new ATOM 0 HB3 PHE A 6 8.428 1.999 -7.303 1.00 0.00 H new ATOM 0 HD1 PHE A 6 8.335 1.490 -4.913 1.00 0.00 H new ATOM 0 HD2 PHE A 6 7.980 5.499 -6.309 1.00 0.00 H new ATOM 0 HE1 PHE A 6 7.479 2.177 -2.716 1.00 0.00 H new ATOM 0 HE2 PHE A 6 7.129 6.191 -4.112 1.00 0.00 H new ATOM 0 HZ PHE A 6 6.872 4.530 -2.311 1.00 0.00 H new ATOM 99 N SER A 7 11.083 5.294 -7.910 1.00 0.00 N ATOM 100 CA SER A 7 11.549 6.663 -7.719 1.00 0.00 C ATOM 101 C SER A 7 10.714 7.641 -8.538 1.00 0.00 C ATOM 102 O SER A 7 10.378 7.372 -9.692 1.00 0.00 O ATOM 103 CB SER A 7 13.023 6.781 -8.110 1.00 0.00 C ATOM 104 OG SER A 7 13.855 6.808 -6.963 1.00 0.00 O ATOM 0 H SER A 7 11.059 4.989 -8.883 1.00 0.00 H new ATOM 0 HA SER A 7 11.439 6.914 -6.664 1.00 0.00 H new ATOM 0 HB2 SER A 7 13.302 5.941 -8.746 1.00 0.00 H new ATOM 0 HB3 SER A 7 13.176 7.688 -8.695 1.00 0.00 H new ATOM 0 HG SER A 7 14.792 6.882 -7.240 1.00 0.00 H new ATOM 110 N ILE A 8 10.382 8.777 -7.934 1.00 0.00 N ATOM 111 CA ILE A 8 9.587 9.796 -8.607 1.00 0.00 C ATOM 112 C ILE A 8 10.415 11.046 -8.883 1.00 0.00 C ATOM 113 O ILE A 8 11.259 11.436 -8.076 1.00 0.00 O ATOM 114 CB ILE A 8 8.351 10.186 -7.775 1.00 0.00 C ATOM 115 CG1 ILE A 8 7.668 8.935 -7.219 1.00 0.00 C ATOM 116 CG2 ILE A 8 7.378 10.996 -8.619 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.409 9.232 -6.433 1.00 0.00 C ATOM 0 H ILE A 8 10.652 9.015 -6.979 1.00 0.00 H new ATOM 0 HA ILE A 8 9.257 9.365 -9.553 1.00 0.00 H new ATOM 0 HB ILE A 8 8.676 10.803 -6.937 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.422 8.268 -8.045 1.00 0.00 H new ATOM 0 HG13 ILE A 8 8.370 8.402 -6.577 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.510 11.264 -8.017 1.00 0.00 H new ATOM 0 HG22 ILE A 8 7.869 11.903 -8.971 1.00 0.00 H new ATOM 0 HG23 ILE A 8 7.057 10.402 -9.475 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.979 8.299 -6.069 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.652 9.874 -5.586 1.00 0.00 H new ATOM 0 HD13 ILE A 8 5.689 9.737 -7.077 1.00 0.00 H new ATOM 129 N THR A 9 10.167 11.673 -10.029 1.00 0.00 N ATOM 130 CA THR A 9 10.889 12.880 -10.412 1.00 0.00 C ATOM 131 C THR A 9 9.926 14.004 -10.777 1.00 0.00 C ATOM 132 O THR A 9 8.847 13.758 -11.316 1.00 0.00 O ATOM 133 CB THR A 9 11.829 12.618 -11.603 1.00 0.00 C ATOM 134 OG1 THR A 9 12.324 11.275 -11.551 1.00 0.00 O ATOM 135 CG2 THR A 9 12.996 13.594 -11.597 1.00 0.00 C ATOM 0 H THR A 9 9.471 11.365 -10.708 1.00 0.00 H new ATOM 0 HA THR A 9 11.483 13.180 -9.549 1.00 0.00 H new ATOM 0 HB THR A 9 11.261 12.760 -12.523 1.00 0.00 H new ATOM 0 HG1 THR A 9 12.920 11.116 -12.313 1.00 0.00 H new ATOM 0 HG21 THR A 9 13.646 13.389 -12.448 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.618 14.614 -11.667 1.00 0.00 H new ATOM 0 HG23 THR A 9 13.562 13.479 -10.672 1.00 0.00 H new ATOM 143 N GLN A 10 10.323 15.237 -10.479 1.00 0.00 N ATOM 144 CA GLN A 10 9.494 16.399 -10.776 1.00 0.00 C ATOM 145 C GLN A 10 10.090 17.215 -11.919 1.00 0.00 C ATOM 146 O GLN A 10 11.309 17.335 -12.039 1.00 0.00 O ATOM 147 CB GLN A 10 9.343 17.276 -9.532 1.00 0.00 C ATOM 148 CG GLN A 10 10.669 17.682 -8.909 1.00 0.00 C ATOM 149 CD GLN A 10 11.166 16.678 -7.888 1.00 0.00 C ATOM 150 OE1 GLN A 10 12.112 15.932 -8.143 1.00 0.00 O ATOM 151 NE2 GLN A 10 10.529 16.653 -6.723 1.00 0.00 N ATOM 0 H GLN A 10 11.213 15.457 -10.032 1.00 0.00 H new ATOM 0 HA GLN A 10 8.510 16.043 -11.082 1.00 0.00 H new ATOM 0 HB2 GLN A 10 8.785 18.174 -9.797 1.00 0.00 H new ATOM 0 HB3 GLN A 10 8.751 16.740 -8.790 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.416 17.795 -9.695 1.00 0.00 H new ATOM 0 HG3 GLN A 10 10.559 18.656 -8.432 1.00 0.00 H new ATOM 0 HE21 GLN A 10 9.750 17.289 -6.554 1.00 0.00 H new ATOM 0 HE22 GLN A 10 10.819 15.998 -5.997 1.00 0.00 H new ATOM 160 N ASP A 11 9.222 17.773 -12.756 1.00 0.00 N ATOM 161 CA ASP A 11 9.662 18.578 -13.889 1.00 0.00 C ATOM 162 C ASP A 11 8.904 19.901 -13.943 1.00 0.00 C ATOM 163 O ASP A 11 7.922 20.093 -13.226 1.00 0.00 O ATOM 164 CB ASP A 11 9.465 17.809 -15.196 1.00 0.00 C ATOM 165 CG ASP A 11 9.686 16.319 -15.029 1.00 0.00 C ATOM 166 OD1 ASP A 11 10.666 15.935 -14.356 1.00 0.00 O ATOM 167 OD2 ASP A 11 8.880 15.535 -15.572 1.00 0.00 O ATOM 0 H ASP A 11 8.210 17.682 -12.671 1.00 0.00 H new ATOM 0 HA ASP A 11 10.723 18.793 -13.760 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.456 17.984 -15.569 1.00 0.00 H new ATOM 0 HB3 ASP A 11 10.154 18.194 -15.948 1.00 0.00 H new ATOM 172 N GLU A 12 9.367 20.808 -14.797 1.00 0.00 N ATOM 173 CA GLU A 12 8.732 22.113 -14.942 1.00 0.00 C ATOM 174 C GLU A 12 7.587 22.052 -15.949 1.00 0.00 C ATOM 175 O GLU A 12 7.005 23.076 -16.305 1.00 0.00 O ATOM 176 CB GLU A 12 9.759 23.158 -15.384 1.00 0.00 C ATOM 177 CG GLU A 12 10.191 23.011 -16.834 1.00 0.00 C ATOM 178 CD GLU A 12 11.304 23.970 -17.210 1.00 0.00 C ATOM 179 OE1 GLU A 12 11.229 25.152 -16.815 1.00 0.00 O ATOM 180 OE2 GLU A 12 12.250 23.537 -17.901 1.00 0.00 O ATOM 0 H GLU A 12 10.178 20.664 -15.398 1.00 0.00 H new ATOM 0 HA GLU A 12 8.325 22.401 -13.972 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.339 24.153 -15.238 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.637 23.086 -14.743 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.524 21.988 -17.008 1.00 0.00 H new ATOM 0 HG3 GLU A 12 9.333 23.183 -17.484 1.00 0.00 H new ATOM 187 N GLU A 13 7.270 20.843 -16.403 1.00 0.00 N ATOM 188 CA GLU A 13 6.195 20.649 -17.369 1.00 0.00 C ATOM 189 C GLU A 13 5.194 19.612 -16.869 1.00 0.00 C ATOM 190 O GLU A 13 3.990 19.736 -17.093 1.00 0.00 O ATOM 191 CB GLU A 13 6.767 20.212 -18.720 1.00 0.00 C ATOM 192 CG GLU A 13 8.036 19.385 -18.604 1.00 0.00 C ATOM 193 CD GLU A 13 8.545 18.906 -19.950 1.00 0.00 C ATOM 194 OE1 GLU A 13 7.908 19.232 -20.974 1.00 0.00 O ATOM 195 OE2 GLU A 13 9.578 18.206 -19.980 1.00 0.00 O ATOM 0 H GLU A 13 7.742 19.985 -16.118 1.00 0.00 H new ATOM 0 HA GLU A 13 5.676 21.599 -17.492 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.014 19.633 -19.254 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.974 21.097 -19.321 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.810 19.979 -18.118 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.847 18.523 -17.964 1.00 0.00 H new ATOM 202 N PHE A 14 5.701 18.588 -16.190 1.00 0.00 N ATOM 203 CA PHE A 14 4.853 17.528 -15.658 1.00 0.00 C ATOM 204 C PHE A 14 5.626 16.654 -14.675 1.00 0.00 C ATOM 205 O PHE A 14 6.789 16.922 -14.373 1.00 0.00 O ATOM 206 CB PHE A 14 4.301 16.668 -16.797 1.00 0.00 C ATOM 207 CG PHE A 14 5.367 15.968 -17.591 1.00 0.00 C ATOM 208 CD1 PHE A 14 6.120 16.661 -18.525 1.00 0.00 C ATOM 209 CD2 PHE A 14 5.615 14.619 -17.403 1.00 0.00 C ATOM 210 CE1 PHE A 14 7.101 16.019 -19.257 1.00 0.00 C ATOM 211 CE2 PHE A 14 6.595 13.972 -18.132 1.00 0.00 C ATOM 212 CZ PHE A 14 7.340 14.673 -19.060 1.00 0.00 C ATOM 0 H PHE A 14 6.695 18.470 -15.995 1.00 0.00 H new ATOM 0 HA PHE A 14 4.022 17.994 -15.127 1.00 0.00 H new ATOM 0 HB2 PHE A 14 3.620 15.924 -16.383 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.715 17.298 -17.466 1.00 0.00 H new ATOM 0 HD1 PHE A 14 5.939 17.714 -18.683 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.036 14.066 -16.678 1.00 0.00 H new ATOM 0 HE1 PHE A 14 7.681 16.570 -19.983 1.00 0.00 H new ATOM 0 HE2 PHE A 14 6.778 12.919 -17.976 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.107 14.170 -19.630 1.00 0.00 H new ATOM 222 N ILE A 15 4.971 15.609 -14.180 1.00 0.00 N ATOM 223 CA ILE A 15 5.597 14.696 -13.232 1.00 0.00 C ATOM 224 C ILE A 15 5.969 13.378 -13.902 1.00 0.00 C ATOM 225 O ILE A 15 5.231 12.868 -14.746 1.00 0.00 O ATOM 226 CB ILE A 15 4.672 14.407 -12.035 1.00 0.00 C ATOM 227 CG1 ILE A 15 4.770 15.533 -11.004 1.00 0.00 C ATOM 228 CG2 ILE A 15 5.028 13.070 -11.402 1.00 0.00 C ATOM 229 CD1 ILE A 15 6.098 15.577 -10.280 1.00 0.00 C ATOM 0 H ILE A 15 4.008 15.374 -14.420 1.00 0.00 H new ATOM 0 HA ILE A 15 6.502 15.186 -12.872 1.00 0.00 H new ATOM 0 HB ILE A 15 3.644 14.356 -12.393 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.606 16.488 -11.504 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.971 15.415 -10.273 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.366 12.879 -10.557 1.00 0.00 H new ATOM 0 HG22 ILE A 15 4.913 12.276 -12.140 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.061 13.095 -11.055 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.096 16.400 -9.565 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.255 14.637 -9.751 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.901 15.726 -11.002 1.00 0.00 H new ATOM 241 N PHE A 16 7.118 12.829 -13.521 1.00 0.00 N ATOM 242 CA PHE A 16 7.588 11.569 -14.084 1.00 0.00 C ATOM 243 C PHE A 16 7.867 10.551 -12.982 1.00 0.00 C ATOM 244 O PHE A 16 8.814 10.700 -12.208 1.00 0.00 O ATOM 245 CB PHE A 16 8.852 11.798 -14.915 1.00 0.00 C ATOM 246 CG PHE A 16 9.679 10.558 -15.101 1.00 0.00 C ATOM 247 CD1 PHE A 16 9.353 9.631 -16.078 1.00 0.00 C ATOM 248 CD2 PHE A 16 10.784 10.319 -14.299 1.00 0.00 C ATOM 249 CE1 PHE A 16 10.112 8.489 -16.251 1.00 0.00 C ATOM 250 CE2 PHE A 16 11.547 9.179 -14.467 1.00 0.00 C ATOM 251 CZ PHE A 16 11.211 8.264 -15.445 1.00 0.00 C ATOM 0 H PHE A 16 7.741 13.238 -12.824 1.00 0.00 H new ATOM 0 HA PHE A 16 6.804 11.173 -14.729 1.00 0.00 H new ATOM 0 HB2 PHE A 16 8.569 12.186 -15.893 1.00 0.00 H new ATOM 0 HB3 PHE A 16 9.461 12.562 -14.433 1.00 0.00 H new ATOM 0 HD1 PHE A 16 8.496 9.803 -16.712 1.00 0.00 H new ATOM 0 HD2 PHE A 16 11.052 11.032 -13.534 1.00 0.00 H new ATOM 0 HE1 PHE A 16 9.846 7.774 -17.015 1.00 0.00 H new ATOM 0 HE2 PHE A 16 12.405 9.004 -13.834 1.00 0.00 H new ATOM 0 HZ PHE A 16 11.807 7.373 -15.580 1.00 0.00 H new ATOM 261 N LEU A 17 7.036 9.517 -12.916 1.00 0.00 N ATOM 262 CA LEU A 17 7.191 8.474 -11.908 1.00 0.00 C ATOM 263 C LEU A 17 7.847 7.233 -12.506 1.00 0.00 C ATOM 264 O LEU A 17 7.365 6.677 -13.493 1.00 0.00 O ATOM 265 CB LEU A 17 5.832 8.108 -11.310 1.00 0.00 C ATOM 266 CG LEU A 17 5.688 6.675 -10.796 1.00 0.00 C ATOM 267 CD1 LEU A 17 6.707 6.396 -9.702 1.00 0.00 C ATOM 268 CD2 LEU A 17 4.275 6.430 -10.286 1.00 0.00 C ATOM 0 H LEU A 17 6.248 9.378 -13.548 1.00 0.00 H new ATOM 0 HA LEU A 17 7.836 8.859 -11.118 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.625 8.791 -10.486 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.067 8.280 -12.067 1.00 0.00 H new ATOM 0 HG LEU A 17 5.877 5.992 -11.624 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.590 5.372 -9.348 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.713 6.530 -10.099 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.549 7.086 -8.873 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.191 5.405 -9.924 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.057 7.121 -9.472 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.563 6.588 -11.096 1.00 0.00 H new ATOM 280 N LYS A 18 8.948 6.802 -11.901 1.00 0.00 N ATOM 281 CA LYS A 18 9.669 5.625 -12.370 1.00 0.00 C ATOM 282 C LYS A 18 9.511 4.465 -11.393 1.00 0.00 C ATOM 283 O LYS A 18 9.556 4.655 -10.177 1.00 0.00 O ATOM 284 CB LYS A 18 11.153 5.951 -12.555 1.00 0.00 C ATOM 285 CG LYS A 18 12.050 4.725 -12.551 1.00 0.00 C ATOM 286 CD LYS A 18 13.483 5.082 -12.908 1.00 0.00 C ATOM 287 CE LYS A 18 14.025 6.181 -12.008 1.00 0.00 C ATOM 288 NZ LYS A 18 15.513 6.171 -11.954 1.00 0.00 N ATOM 0 H LYS A 18 9.361 7.251 -11.084 1.00 0.00 H new ATOM 0 HA LYS A 18 9.246 5.329 -13.330 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.285 6.484 -13.497 1.00 0.00 H new ATOM 0 HB3 LYS A 18 11.470 6.626 -11.760 1.00 0.00 H new ATOM 0 HG2 LYS A 18 12.025 4.258 -11.567 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.669 3.992 -13.262 1.00 0.00 H new ATOM 0 HD2 LYS A 18 14.112 4.196 -12.821 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.530 5.406 -13.948 1.00 0.00 H new ATOM 0 HE2 LYS A 18 13.681 7.150 -12.371 1.00 0.00 H new ATOM 0 HE3 LYS A 18 13.624 6.057 -11.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 15.836 6.764 -11.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 15.849 5.197 -11.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 15.895 6.545 -12.846 1.00 0.00 H new ATOM 302 N ILE A 19 9.327 3.264 -11.932 1.00 0.00 N ATOM 303 CA ILE A 19 9.165 2.074 -11.106 1.00 0.00 C ATOM 304 C ILE A 19 10.134 0.975 -11.530 1.00 0.00 C ATOM 305 O ILE A 19 10.156 0.565 -12.691 1.00 0.00 O ATOM 306 CB ILE A 19 7.726 1.530 -11.180 1.00 0.00 C ATOM 307 CG1 ILE A 19 6.719 2.653 -10.922 1.00 0.00 C ATOM 308 CG2 ILE A 19 7.535 0.400 -10.178 1.00 0.00 C ATOM 309 CD1 ILE A 19 6.167 3.270 -12.187 1.00 0.00 C ATOM 0 H ILE A 19 9.286 3.090 -12.936 1.00 0.00 H new ATOM 0 HA ILE A 19 9.381 2.370 -10.079 1.00 0.00 H new ATOM 0 HB ILE A 19 7.553 1.135 -12.181 1.00 0.00 H new ATOM 0 HG12 ILE A 19 5.893 2.261 -10.328 1.00 0.00 H new ATOM 0 HG13 ILE A 19 7.198 3.430 -10.327 1.00 0.00 H new ATOM 0 HG21 ILE A 19 6.513 0.026 -10.242 1.00 0.00 H new ATOM 0 HG22 ILE A 19 8.232 -0.407 -10.403 1.00 0.00 H new ATOM 0 HG23 ILE A 19 7.723 0.771 -9.171 1.00 0.00 H new ATOM 0 HD11 ILE A 19 5.460 4.058 -11.929 1.00 0.00 H new ATOM 0 HD12 ILE A 19 6.984 3.692 -12.772 1.00 0.00 H new ATOM 0 HD13 ILE A 19 5.659 2.505 -12.773 1.00 0.00 H new ATOM 321 N PHE A 20 10.934 0.501 -10.581 1.00 0.00 N ATOM 322 CA PHE A 20 11.905 -0.552 -10.855 1.00 0.00 C ATOM 323 C PHE A 20 11.282 -1.931 -10.663 1.00 0.00 C ATOM 324 O PHE A 20 10.581 -2.175 -9.680 1.00 0.00 O ATOM 325 CB PHE A 20 13.125 -0.400 -9.943 1.00 0.00 C ATOM 326 CG PHE A 20 13.744 0.968 -9.993 1.00 0.00 C ATOM 327 CD1 PHE A 20 14.601 1.317 -11.025 1.00 0.00 C ATOM 328 CD2 PHE A 20 13.469 1.904 -9.009 1.00 0.00 C ATOM 329 CE1 PHE A 20 15.173 2.574 -11.073 1.00 0.00 C ATOM 330 CE2 PHE A 20 14.038 3.163 -9.053 1.00 0.00 C ATOM 331 CZ PHE A 20 14.890 3.499 -10.086 1.00 0.00 C ATOM 0 H PHE A 20 10.929 0.829 -9.615 1.00 0.00 H new ATOM 0 HA PHE A 20 12.222 -0.458 -11.894 1.00 0.00 H new ATOM 0 HB2 PHE A 20 12.831 -0.620 -8.917 1.00 0.00 H new ATOM 0 HB3 PHE A 20 13.874 -1.140 -10.225 1.00 0.00 H new ATOM 0 HD1 PHE A 20 14.824 0.599 -11.800 1.00 0.00 H new ATOM 0 HD2 PHE A 20 12.803 1.647 -8.199 1.00 0.00 H new ATOM 0 HE1 PHE A 20 15.841 2.833 -11.881 1.00 0.00 H new ATOM 0 HE2 PHE A 20 13.816 3.883 -8.280 1.00 0.00 H new ATOM 0 HZ PHE A 20 15.334 4.483 -10.123 1.00 0.00 H new ATOM 341 N ILE A 21 11.541 -2.828 -11.608 1.00 0.00 N ATOM 342 CA ILE A 21 11.006 -4.182 -11.543 1.00 0.00 C ATOM 343 C ILE A 21 11.933 -5.173 -12.238 1.00 0.00 C ATOM 344 O ILE A 21 12.917 -4.783 -12.867 1.00 0.00 O ATOM 345 CB ILE A 21 9.609 -4.266 -12.185 1.00 0.00 C ATOM 346 CG1 ILE A 21 9.679 -3.885 -13.665 1.00 0.00 C ATOM 347 CG2 ILE A 21 8.631 -3.364 -11.446 1.00 0.00 C ATOM 348 CD1 ILE A 21 8.409 -4.187 -14.428 1.00 0.00 C ATOM 0 H ILE A 21 12.118 -2.641 -12.428 1.00 0.00 H new ATOM 0 HA ILE A 21 10.928 -4.440 -10.487 1.00 0.00 H new ATOM 0 HB ILE A 21 9.253 -5.294 -12.111 1.00 0.00 H new ATOM 0 HG12 ILE A 21 9.898 -2.820 -13.748 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.508 -4.418 -14.130 1.00 0.00 H new ATOM 0 HG21 ILE A 21 7.648 -3.434 -11.912 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.562 -3.678 -10.404 1.00 0.00 H new ATOM 0 HG23 ILE A 21 8.981 -2.333 -11.492 1.00 0.00 H new ATOM 0 HD11 ILE A 21 8.531 -3.891 -15.470 1.00 0.00 H new ATOM 0 HD12 ILE A 21 8.199 -5.255 -14.377 1.00 0.00 H new ATOM 0 HD13 ILE A 21 7.580 -3.633 -13.988 1.00 0.00 H new ATOM 360 N SER A 22 11.611 -6.458 -12.122 1.00 0.00 N ATOM 361 CA SER A 22 12.416 -7.506 -12.738 1.00 0.00 C ATOM 362 C SER A 22 11.548 -8.427 -13.591 1.00 0.00 C ATOM 363 O SER A 22 11.963 -9.526 -13.956 1.00 0.00 O ATOM 364 CB SER A 22 13.140 -8.320 -11.664 1.00 0.00 C ATOM 365 OG SER A 22 13.902 -7.479 -10.814 1.00 0.00 O ATOM 0 H SER A 22 10.799 -6.798 -11.607 1.00 0.00 H new ATOM 0 HA SER A 22 13.155 -7.031 -13.383 1.00 0.00 H new ATOM 0 HB2 SER A 22 12.413 -8.877 -11.073 1.00 0.00 H new ATOM 0 HB3 SER A 22 13.794 -9.053 -12.137 1.00 0.00 H new ATOM 0 HG SER A 22 14.354 -8.023 -10.135 1.00 0.00 H new ATOM 371 N ASN A 23 10.341 -7.969 -13.904 1.00 0.00 N ATOM 372 CA ASN A 23 9.413 -8.751 -14.713 1.00 0.00 C ATOM 373 C ASN A 23 9.124 -10.099 -14.060 1.00 0.00 C ATOM 374 O ASN A 23 8.799 -11.072 -14.740 1.00 0.00 O ATOM 375 CB ASN A 23 9.983 -8.964 -16.117 1.00 0.00 C ATOM 376 CG ASN A 23 11.061 -7.955 -16.462 1.00 0.00 C ATOM 377 OD1 ASN A 23 12.158 -8.323 -16.885 1.00 0.00 O ATOM 378 ND2 ASN A 23 10.754 -6.676 -16.284 1.00 0.00 N ATOM 0 H ASN A 23 9.982 -7.061 -13.610 1.00 0.00 H new ATOM 0 HA ASN A 23 8.478 -8.196 -14.787 1.00 0.00 H new ATOM 0 HB2 ASN A 23 10.394 -9.971 -16.190 1.00 0.00 H new ATOM 0 HB3 ASN A 23 9.177 -8.895 -16.848 1.00 0.00 H new ATOM 0 HD21 ASN A 23 11.439 -5.952 -16.500 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.833 -6.417 -15.931 1.00 0.00 H new ATOM 385 N ILE A 24 9.244 -10.147 -12.737 1.00 0.00 N ATOM 386 CA ILE A 24 8.994 -11.374 -11.992 1.00 0.00 C ATOM 387 C ILE A 24 7.538 -11.808 -12.121 1.00 0.00 C ATOM 388 O ILE A 24 7.240 -12.999 -12.216 1.00 0.00 O ATOM 389 CB ILE A 24 9.338 -11.207 -10.500 1.00 0.00 C ATOM 390 CG1 ILE A 24 8.814 -9.867 -9.981 1.00 0.00 C ATOM 391 CG2 ILE A 24 10.840 -11.313 -10.288 1.00 0.00 C ATOM 392 CD1 ILE A 24 8.053 -9.980 -8.678 1.00 0.00 C ATOM 0 H ILE A 24 9.513 -9.350 -12.160 1.00 0.00 H new ATOM 0 HA ILE A 24 9.639 -12.141 -12.421 1.00 0.00 H new ATOM 0 HB ILE A 24 8.855 -12.007 -9.939 1.00 0.00 H new ATOM 0 HG12 ILE A 24 9.654 -9.186 -9.844 1.00 0.00 H new ATOM 0 HG13 ILE A 24 8.164 -9.424 -10.735 1.00 0.00 H new ATOM 0 HG21 ILE A 24 11.067 -11.193 -9.229 1.00 0.00 H new ATOM 0 HG22 ILE A 24 11.187 -12.290 -10.625 1.00 0.00 H new ATOM 0 HG23 ILE A 24 11.344 -10.532 -10.858 1.00 0.00 H new ATOM 0 HD11 ILE A 24 7.711 -8.992 -8.370 1.00 0.00 H new ATOM 0 HD12 ILE A 24 7.193 -10.635 -8.815 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.706 -10.394 -7.910 1.00 0.00 H new ATOM 404 N ARG A 25 6.634 -10.834 -12.126 1.00 0.00 N ATOM 405 CA ARG A 25 5.208 -11.115 -12.245 1.00 0.00 C ATOM 406 C ARG A 25 4.521 -10.079 -13.129 1.00 0.00 C ATOM 407 O ARG A 25 3.399 -9.655 -12.849 1.00 0.00 O ATOM 408 CB ARG A 25 4.554 -11.136 -10.862 1.00 0.00 C ATOM 409 CG ARG A 25 5.345 -11.918 -9.826 1.00 0.00 C ATOM 410 CD ARG A 25 5.348 -13.407 -10.134 1.00 0.00 C ATOM 411 NE ARG A 25 4.608 -14.174 -9.136 1.00 0.00 N ATOM 412 CZ ARG A 25 4.782 -15.475 -8.932 1.00 0.00 C ATOM 413 NH1 ARG A 25 5.667 -16.150 -9.653 1.00 0.00 N ATOM 414 NH2 ARG A 25 4.071 -16.103 -8.004 1.00 0.00 N ATOM 0 H ARG A 25 6.864 -9.843 -12.049 1.00 0.00 H new ATOM 0 HA ARG A 25 5.094 -12.095 -12.709 1.00 0.00 H new ATOM 0 HB2 ARG A 25 4.429 -10.111 -10.513 1.00 0.00 H new ATOM 0 HB3 ARG A 25 3.557 -11.568 -10.947 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.370 -11.550 -9.796 1.00 0.00 H new ATOM 0 HG3 ARG A 25 4.917 -11.751 -8.838 1.00 0.00 H new ATOM 0 HD2 ARG A 25 4.910 -13.574 -11.118 1.00 0.00 H new ATOM 0 HD3 ARG A 25 6.376 -13.766 -10.178 1.00 0.00 H new ATOM 0 HE ARG A 25 3.920 -13.684 -8.564 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.216 -15.670 -10.366 1.00 0.00 H new ATOM 0 HH12 ARG A 25 5.799 -17.149 -9.494 1.00 0.00 H new ATOM 0 HH21 ARG A 25 3.390 -15.587 -7.447 1.00 0.00 H new ATOM 0 HH22 ARG A 25 4.205 -17.102 -7.848 1.00 0.00 H new ATOM 428 N PHE A 26 5.202 -9.674 -14.195 1.00 0.00 N ATOM 429 CA PHE A 26 4.658 -8.686 -15.120 1.00 0.00 C ATOM 430 C PHE A 26 3.830 -9.359 -16.210 1.00 0.00 C ATOM 431 O PHE A 26 4.374 -9.905 -17.170 1.00 0.00 O ATOM 432 CB PHE A 26 5.788 -7.871 -15.752 1.00 0.00 C ATOM 433 CG PHE A 26 5.389 -6.467 -16.107 1.00 0.00 C ATOM 434 CD1 PHE A 26 5.028 -5.565 -15.120 1.00 0.00 C ATOM 435 CD2 PHE A 26 5.375 -6.051 -17.429 1.00 0.00 C ATOM 436 CE1 PHE A 26 4.661 -4.272 -15.444 1.00 0.00 C ATOM 437 CE2 PHE A 26 5.009 -4.759 -17.758 1.00 0.00 C ATOM 438 CZ PHE A 26 4.650 -3.869 -16.765 1.00 0.00 C ATOM 0 H PHE A 26 6.132 -10.014 -14.440 1.00 0.00 H new ATOM 0 HA PHE A 26 4.008 -8.017 -14.556 1.00 0.00 H new ATOM 0 HB2 PHE A 26 6.631 -7.837 -15.061 1.00 0.00 H new ATOM 0 HB3 PHE A 26 6.133 -8.380 -16.652 1.00 0.00 H new ATOM 0 HD1 PHE A 26 5.033 -5.875 -14.086 1.00 0.00 H new ATOM 0 HD2 PHE A 26 5.653 -6.743 -18.210 1.00 0.00 H new ATOM 0 HE1 PHE A 26 4.383 -3.578 -14.665 1.00 0.00 H new ATOM 0 HE2 PHE A 26 5.004 -4.446 -18.792 1.00 0.00 H new ATOM 0 HZ PHE A 26 4.361 -2.860 -17.021 1.00 0.00 H new ATOM 448 N SER A 27 2.510 -9.315 -16.055 1.00 0.00 N ATOM 449 CA SER A 27 1.606 -9.924 -17.023 1.00 0.00 C ATOM 450 C SER A 27 1.399 -9.008 -18.225 1.00 0.00 C ATOM 451 O SER A 27 1.120 -9.469 -19.331 1.00 0.00 O ATOM 452 CB SER A 27 0.259 -10.236 -16.368 1.00 0.00 C ATOM 453 OG SER A 27 0.432 -10.983 -15.176 1.00 0.00 O ATOM 0 H SER A 27 2.043 -8.864 -15.268 1.00 0.00 H new ATOM 0 HA SER A 27 2.058 -10.853 -17.370 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.265 -9.306 -16.145 1.00 0.00 H new ATOM 0 HB3 SER A 27 -0.366 -10.795 -17.064 1.00 0.00 H new ATOM 0 HG SER A 27 -0.443 -11.168 -14.776 1.00 0.00 H new ATOM 459 N ALA A 28 1.539 -7.705 -17.999 1.00 0.00 N ATOM 460 CA ALA A 28 1.370 -6.723 -19.062 1.00 0.00 C ATOM 461 C ALA A 28 -0.030 -6.798 -19.662 1.00 0.00 C ATOM 462 O ALA A 28 -0.235 -6.466 -20.829 1.00 0.00 O ATOM 463 CB ALA A 28 2.421 -6.929 -20.143 1.00 0.00 C ATOM 0 H ALA A 28 1.769 -7.306 -17.089 1.00 0.00 H new ATOM 0 HA ALA A 28 1.499 -5.731 -18.629 1.00 0.00 H new ATOM 0 HB1 ALA A 28 2.283 -6.188 -20.931 1.00 0.00 H new ATOM 0 HB2 ALA A 28 3.415 -6.817 -19.710 1.00 0.00 H new ATOM 0 HB3 ALA A 28 2.319 -7.929 -20.564 1.00 0.00 H new ATOM 469 N VAL A 29 -0.991 -7.238 -18.856 1.00 0.00 N ATOM 470 CA VAL A 29 -2.372 -7.357 -19.307 1.00 0.00 C ATOM 471 C VAL A 29 -3.301 -6.487 -18.468 1.00 0.00 C ATOM 472 O VAL A 29 -4.353 -6.053 -18.935 1.00 0.00 O ATOM 473 CB VAL A 29 -2.859 -8.817 -19.246 1.00 0.00 C ATOM 474 CG1 VAL A 29 -4.270 -8.933 -19.802 1.00 0.00 C ATOM 475 CG2 VAL A 29 -1.903 -9.729 -20.000 1.00 0.00 C ATOM 0 H VAL A 29 -0.838 -7.518 -17.887 1.00 0.00 H new ATOM 0 HA VAL A 29 -2.397 -7.017 -20.342 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.879 -9.132 -18.203 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -4.597 -9.972 -19.751 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.945 -8.311 -19.214 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.281 -8.600 -20.840 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -2.262 -10.757 -19.947 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.849 -9.417 -21.043 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -0.912 -9.668 -19.551 1.00 0.00 H new ATOM 485 N GLY A 30 -2.904 -6.236 -17.224 1.00 0.00 N ATOM 486 CA GLY A 30 -3.713 -5.418 -16.338 1.00 0.00 C ATOM 487 C GLY A 30 -3.100 -4.055 -16.087 1.00 0.00 C ATOM 488 O GLY A 30 -3.470 -3.364 -15.137 1.00 0.00 O ATOM 0 H GLY A 30 -2.037 -6.584 -16.814 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -4.706 -5.292 -16.770 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -3.842 -5.936 -15.387 1.00 0.00 H new ATOM 492 N LEU A 31 -2.158 -3.666 -16.939 1.00 0.00 N ATOM 493 CA LEU A 31 -1.490 -2.376 -16.805 1.00 0.00 C ATOM 494 C LEU A 31 -2.462 -1.230 -17.066 1.00 0.00 C ATOM 495 O LEU A 31 -3.066 -1.148 -18.135 1.00 0.00 O ATOM 496 CB LEU A 31 -0.308 -2.288 -17.772 1.00 0.00 C ATOM 497 CG LEU A 31 0.590 -3.524 -17.849 1.00 0.00 C ATOM 498 CD1 LEU A 31 1.889 -3.196 -18.567 1.00 0.00 C ATOM 499 CD2 LEU A 31 0.871 -4.066 -16.455 1.00 0.00 C ATOM 0 H LEU A 31 -1.839 -4.225 -17.730 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.122 -2.290 -15.783 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.695 -2.082 -18.770 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.307 -1.434 -17.486 1.00 0.00 H new ATOM 0 HG LEU A 31 0.069 -4.294 -18.418 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.515 -4.087 -18.612 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.669 -2.855 -19.579 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.415 -2.410 -18.026 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.511 -4.945 -16.529 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.372 -3.301 -15.861 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.068 -4.340 -15.975 1.00 0.00 H new ATOM 511 N GLU A 32 -2.605 -0.346 -16.083 1.00 0.00 N ATOM 512 CA GLU A 32 -3.503 0.796 -16.209 1.00 0.00 C ATOM 513 C GLU A 32 -3.380 1.720 -15.001 1.00 0.00 C ATOM 514 O GLU A 32 -4.107 1.573 -14.018 1.00 0.00 O ATOM 515 CB GLU A 32 -4.950 0.321 -16.357 1.00 0.00 C ATOM 516 CG GLU A 32 -5.888 1.388 -16.896 1.00 0.00 C ATOM 517 CD GLU A 32 -7.261 0.841 -17.236 1.00 0.00 C ATOM 518 OE1 GLU A 32 -7.367 -0.378 -17.486 1.00 0.00 O ATOM 519 OE2 GLU A 32 -8.228 1.630 -17.251 1.00 0.00 O ATOM 0 H GLU A 32 -2.111 -0.399 -15.192 1.00 0.00 H new ATOM 0 HA GLU A 32 -3.218 1.353 -17.101 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -4.974 -0.542 -17.022 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -5.315 -0.015 -15.386 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -5.991 2.183 -16.157 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -5.449 1.836 -17.787 1.00 0.00 H new ATOM 526 N ILE A 33 -2.455 2.670 -15.082 1.00 0.00 N ATOM 527 CA ILE A 33 -2.237 3.618 -13.996 1.00 0.00 C ATOM 528 C ILE A 33 -3.116 4.853 -14.160 1.00 0.00 C ATOM 529 O ILE A 33 -3.168 5.453 -15.235 1.00 0.00 O ATOM 530 CB ILE A 33 -0.763 4.057 -13.920 1.00 0.00 C ATOM 531 CG1 ILE A 33 0.138 2.852 -13.644 1.00 0.00 C ATOM 532 CG2 ILE A 33 -0.581 5.119 -12.846 1.00 0.00 C ATOM 533 CD1 ILE A 33 1.615 3.171 -13.717 1.00 0.00 C ATOM 0 H ILE A 33 -1.844 2.804 -15.888 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.503 3.106 -13.071 1.00 0.00 H new ATOM 0 HB ILE A 33 -0.478 4.487 -14.880 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.091 2.457 -12.655 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.091 2.065 -14.363 1.00 0.00 H new ATOM 0 HG21 ILE A 33 0.466 5.419 -12.805 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.198 5.986 -13.083 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.881 4.714 -11.879 1.00 0.00 H new ATOM 0 HD11 ILE A 33 2.192 2.270 -13.511 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.859 3.538 -14.714 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.859 3.935 -12.979 1.00 0.00 H new ATOM 545 N ILE A 34 -3.804 5.229 -13.087 1.00 0.00 N ATOM 546 CA ILE A 34 -4.679 6.395 -13.111 1.00 0.00 C ATOM 547 C ILE A 34 -4.337 7.362 -11.983 1.00 0.00 C ATOM 548 O ILE A 34 -3.801 6.961 -10.949 1.00 0.00 O ATOM 549 CB ILE A 34 -6.160 5.990 -12.995 1.00 0.00 C ATOM 550 CG1 ILE A 34 -6.454 5.449 -11.594 1.00 0.00 C ATOM 551 CG2 ILE A 34 -6.511 4.955 -14.053 1.00 0.00 C ATOM 552 CD1 ILE A 34 -7.270 6.394 -10.740 1.00 0.00 C ATOM 0 H ILE A 34 -3.772 4.743 -12.191 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.521 6.889 -14.070 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.777 6.873 -13.161 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -6.986 4.502 -11.683 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -5.511 5.239 -11.089 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.561 4.679 -13.958 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.334 5.373 -15.044 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.890 4.070 -13.917 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.440 5.945 -9.761 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.731 7.333 -10.620 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.228 6.585 -11.223 1.00 0.00 H new ATOM 564 N ILE A 35 -4.653 8.636 -12.187 1.00 0.00 N ATOM 565 CA ILE A 35 -4.382 9.660 -11.185 1.00 0.00 C ATOM 566 C ILE A 35 -5.670 10.136 -10.523 1.00 0.00 C ATOM 567 O ILE A 35 -6.639 10.475 -11.202 1.00 0.00 O ATOM 568 CB ILE A 35 -3.656 10.871 -11.800 1.00 0.00 C ATOM 569 CG1 ILE A 35 -2.375 10.421 -12.507 1.00 0.00 C ATOM 570 CG2 ILE A 35 -3.340 11.901 -10.725 1.00 0.00 C ATOM 571 CD1 ILE A 35 -2.466 10.480 -14.015 1.00 0.00 C ATOM 0 H ILE A 35 -5.097 8.984 -13.037 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.738 9.204 -10.434 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.312 11.333 -12.537 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.547 11.048 -12.176 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.142 9.400 -12.205 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -2.827 12.751 -11.175 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.267 12.240 -10.262 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.700 11.451 -9.967 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.523 10.147 -14.450 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -3.272 9.831 -14.357 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.668 11.504 -14.328 1.00 0.00 H new ATOM 583 N GLN A 36 -5.673 10.159 -9.194 1.00 0.00 N ATOM 584 CA GLN A 36 -6.842 10.595 -8.441 1.00 0.00 C ATOM 585 C GLN A 36 -6.991 12.112 -8.496 1.00 0.00 C ATOM 586 O GLN A 36 -6.299 12.785 -9.259 1.00 0.00 O ATOM 587 CB GLN A 36 -6.739 10.134 -6.986 1.00 0.00 C ATOM 588 CG GLN A 36 -7.873 9.217 -6.556 1.00 0.00 C ATOM 589 CD GLN A 36 -9.240 9.792 -6.871 1.00 0.00 C ATOM 590 OE1 GLN A 36 -9.684 10.750 -6.236 1.00 0.00 O ATOM 591 NE2 GLN A 36 -9.916 9.211 -7.855 1.00 0.00 N ATOM 0 H GLN A 36 -4.879 9.881 -8.617 1.00 0.00 H new ATOM 0 HA GLN A 36 -7.724 10.145 -8.896 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -5.790 9.616 -6.844 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -6.725 11.009 -6.337 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -7.765 8.254 -7.054 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -7.799 9.032 -5.484 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -9.510 8.420 -8.355 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -10.841 9.556 -8.111 1.00 0.00 H new ATOM 600 N GLU A 37 -7.900 12.643 -7.683 1.00 0.00 N ATOM 601 CA GLU A 37 -8.140 14.080 -7.642 1.00 0.00 C ATOM 602 C GLU A 37 -6.832 14.845 -7.456 1.00 0.00 C ATOM 603 O GLU A 37 -6.651 15.930 -8.007 1.00 0.00 O ATOM 604 CB GLU A 37 -9.110 14.425 -6.510 1.00 0.00 C ATOM 605 CG GLU A 37 -8.812 13.699 -5.210 1.00 0.00 C ATOM 606 CD GLU A 37 -9.155 14.527 -3.987 1.00 0.00 C ATOM 607 OE1 GLU A 37 -9.869 15.540 -4.137 1.00 0.00 O ATOM 608 OE2 GLU A 37 -8.708 14.162 -2.879 1.00 0.00 O ATOM 0 H GLU A 37 -8.481 12.100 -7.045 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.582 14.376 -8.593 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -9.079 15.500 -6.331 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -10.125 14.184 -6.826 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.375 12.766 -5.182 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.755 13.434 -5.180 1.00 0.00 H new ATOM 615 N ASN A 38 -5.924 14.270 -6.674 1.00 0.00 N ATOM 616 CA ASN A 38 -4.633 14.898 -6.413 1.00 0.00 C ATOM 617 C ASN A 38 -3.519 13.856 -6.377 1.00 0.00 C ATOM 618 O ASN A 38 -2.483 14.018 -7.021 1.00 0.00 O ATOM 619 CB ASN A 38 -4.673 15.664 -5.090 1.00 0.00 C ATOM 620 CG ASN A 38 -5.094 14.787 -3.926 1.00 0.00 C ATOM 621 OD1 ASN A 38 -6.278 14.498 -3.749 1.00 0.00 O ATOM 622 ND2 ASN A 38 -4.124 14.359 -3.126 1.00 0.00 N ATOM 0 H ASN A 38 -6.058 13.371 -6.210 1.00 0.00 H new ATOM 0 HA ASN A 38 -4.427 15.597 -7.223 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -3.688 16.084 -4.887 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -5.365 16.502 -5.179 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -4.347 13.766 -2.327 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -3.156 14.624 -3.311 1.00 0.00 H new ATOM 629 N MET A 39 -3.741 12.786 -5.621 1.00 0.00 N ATOM 630 CA MET A 39 -2.757 11.716 -5.503 1.00 0.00 C ATOM 631 C MET A 39 -2.744 10.849 -6.757 1.00 0.00 C ATOM 632 O MET A 39 -3.570 11.025 -7.653 1.00 0.00 O ATOM 633 CB MET A 39 -3.055 10.853 -4.275 1.00 0.00 C ATOM 634 CG MET A 39 -3.982 9.684 -4.565 1.00 0.00 C ATOM 635 SD MET A 39 -4.839 9.096 -3.092 1.00 0.00 S ATOM 636 CE MET A 39 -3.453 8.660 -2.044 1.00 0.00 C ATOM 0 H MET A 39 -4.593 12.637 -5.081 1.00 0.00 H new ATOM 0 HA MET A 39 -1.774 12.172 -5.388 1.00 0.00 H new ATOM 0 HB2 MET A 39 -2.117 10.471 -3.873 1.00 0.00 H new ATOM 0 HB3 MET A 39 -3.502 11.478 -3.502 1.00 0.00 H new ATOM 0 HG2 MET A 39 -4.716 9.984 -5.312 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.405 8.866 -4.996 1.00 0.00 H new ATOM 0 HE1 MET A 39 -3.622 7.675 -1.609 1.00 0.00 H new ATOM 0 HE2 MET A 39 -2.539 8.643 -2.638 1.00 0.00 H new ATOM 0 HE3 MET A 39 -3.354 9.397 -1.247 1.00 0.00 H new ATOM 646 N ILE A 40 -1.801 9.914 -6.814 1.00 0.00 N ATOM 647 CA ILE A 40 -1.682 9.019 -7.959 1.00 0.00 C ATOM 648 C ILE A 40 -1.895 7.567 -7.546 1.00 0.00 C ATOM 649 O ILE A 40 -1.388 7.124 -6.515 1.00 0.00 O ATOM 650 CB ILE A 40 -0.305 9.152 -8.636 1.00 0.00 C ATOM 651 CG1 ILE A 40 -0.132 10.557 -9.217 1.00 0.00 C ATOM 652 CG2 ILE A 40 -0.146 8.100 -9.724 1.00 0.00 C ATOM 653 CD1 ILE A 40 1.206 10.772 -9.890 1.00 0.00 C ATOM 0 H ILE A 40 -1.109 9.757 -6.081 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.457 9.309 -8.669 1.00 0.00 H new ATOM 0 HB ILE A 40 0.469 8.991 -7.886 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.927 10.743 -9.939 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.249 11.289 -8.418 1.00 0.00 H new ATOM 0 HG21 ILE A 40 0.832 8.207 -10.193 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.231 7.106 -9.284 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.925 8.232 -10.475 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.259 11.789 -10.278 1.00 0.00 H new ATOM 0 HD12 ILE A 40 2.006 10.618 -9.166 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.318 10.064 -10.711 1.00 0.00 H new ATOM 665 N ILE A 41 -2.645 6.830 -8.358 1.00 0.00 N ATOM 666 CA ILE A 41 -2.922 5.427 -8.079 1.00 0.00 C ATOM 667 C ILE A 41 -2.179 4.516 -9.051 1.00 0.00 C ATOM 668 O ILE A 41 -2.376 4.593 -10.264 1.00 0.00 O ATOM 669 CB ILE A 41 -4.430 5.124 -8.159 1.00 0.00 C ATOM 670 CG1 ILE A 41 -5.199 5.977 -7.148 1.00 0.00 C ATOM 671 CG2 ILE A 41 -4.686 3.644 -7.916 1.00 0.00 C ATOM 672 CD1 ILE A 41 -4.724 5.798 -5.723 1.00 0.00 C ATOM 0 H ILE A 41 -3.072 7.182 -9.215 1.00 0.00 H new ATOM 0 HA ILE A 41 -2.574 5.232 -7.064 1.00 0.00 H new ATOM 0 HB ILE A 41 -4.783 5.375 -9.159 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -5.105 7.027 -7.425 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -6.258 5.726 -7.204 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -5.756 3.445 -7.976 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -4.165 3.056 -8.671 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -4.321 3.369 -6.927 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -5.313 6.432 -5.061 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.843 4.756 -5.428 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -3.673 6.077 -5.652 1.00 0.00 H new ATOM 684 N PHE A 42 -1.327 3.653 -8.509 1.00 0.00 N ATOM 685 CA PHE A 42 -0.554 2.725 -9.328 1.00 0.00 C ATOM 686 C PHE A 42 -1.181 1.334 -9.312 1.00 0.00 C ATOM 687 O PHE A 42 -1.014 0.577 -8.356 1.00 0.00 O ATOM 688 CB PHE A 42 0.890 2.652 -8.829 1.00 0.00 C ATOM 689 CG PHE A 42 1.698 1.571 -9.488 1.00 0.00 C ATOM 690 CD1 PHE A 42 2.328 1.801 -10.701 1.00 0.00 C ATOM 691 CD2 PHE A 42 1.828 0.326 -8.896 1.00 0.00 C ATOM 692 CE1 PHE A 42 3.072 0.808 -11.310 1.00 0.00 C ATOM 693 CE2 PHE A 42 2.571 -0.671 -9.500 1.00 0.00 C ATOM 694 CZ PHE A 42 3.194 -0.429 -10.709 1.00 0.00 C ATOM 0 H PHE A 42 -1.154 3.576 -7.507 1.00 0.00 H new ATOM 0 HA PHE A 42 -0.558 3.094 -10.354 1.00 0.00 H new ATOM 0 HB2 PHE A 42 1.375 3.613 -9.001 1.00 0.00 H new ATOM 0 HB3 PHE A 42 0.886 2.486 -7.752 1.00 0.00 H new ATOM 0 HD1 PHE A 42 2.237 2.767 -11.176 1.00 0.00 H new ATOM 0 HD2 PHE A 42 1.343 0.132 -7.951 1.00 0.00 H new ATOM 0 HE1 PHE A 42 3.558 1.000 -12.255 1.00 0.00 H new ATOM 0 HE2 PHE A 42 2.664 -1.638 -9.027 1.00 0.00 H new ATOM 0 HZ PHE A 42 3.775 -1.206 -11.183 1.00 0.00 H new ATOM 704 N HIS A 43 -1.904 1.005 -10.378 1.00 0.00 N ATOM 705 CA HIS A 43 -2.556 -0.295 -10.488 1.00 0.00 C ATOM 706 C HIS A 43 -1.721 -1.253 -11.332 1.00 0.00 C ATOM 707 O HIS A 43 -1.918 -2.468 -11.289 1.00 0.00 O ATOM 708 CB HIS A 43 -3.949 -0.140 -11.100 1.00 0.00 C ATOM 709 CG HIS A 43 -4.964 -1.078 -10.523 1.00 0.00 C ATOM 710 ND1 HIS A 43 -6.310 -1.001 -10.813 1.00 0.00 N ATOM 711 CD2 HIS A 43 -4.824 -2.119 -9.670 1.00 0.00 C ATOM 712 CE1 HIS A 43 -6.954 -1.953 -10.162 1.00 0.00 C ATOM 713 NE2 HIS A 43 -6.075 -2.646 -9.461 1.00 0.00 N ATOM 0 H HIS A 43 -2.053 1.621 -11.178 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.651 -0.712 -9.485 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -4.289 0.885 -10.954 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -3.885 -0.304 -12.176 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -3.900 -2.470 -9.234 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.018 -2.134 -10.197 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -6.290 -3.443 -8.862 1.00 0.00 H new ATOM 721 N LEU A 44 -0.788 -0.698 -12.098 1.00 0.00 N ATOM 722 CA LEU A 44 0.078 -1.503 -12.952 1.00 0.00 C ATOM 723 C LEU A 44 0.700 -2.654 -12.167 1.00 0.00 C ATOM 724 O LEU A 44 0.909 -2.553 -10.958 1.00 0.00 O ATOM 725 CB LEU A 44 1.179 -0.633 -13.562 1.00 0.00 C ATOM 726 CG LEU A 44 1.447 -0.836 -15.053 1.00 0.00 C ATOM 727 CD1 LEU A 44 1.636 0.503 -15.749 1.00 0.00 C ATOM 728 CD2 LEU A 44 2.665 -1.724 -15.260 1.00 0.00 C ATOM 0 H LEU A 44 -0.612 0.306 -12.145 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.531 -1.921 -13.753 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.919 0.413 -13.399 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.105 -0.820 -13.018 1.00 0.00 H new ATOM 0 HG LEU A 44 0.582 -1.332 -15.494 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.826 0.338 -16.810 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.735 1.105 -15.631 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.483 1.027 -15.306 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.841 -1.858 -16.327 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.538 -1.256 -14.804 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.490 -2.695 -14.797 1.00 0.00 H new ATOM 740 N SER A 45 0.997 -3.746 -12.864 1.00 0.00 N ATOM 741 CA SER A 45 1.594 -4.917 -12.232 1.00 0.00 C ATOM 742 C SER A 45 0.658 -5.503 -11.180 1.00 0.00 C ATOM 743 O SER A 45 -0.334 -4.891 -10.784 1.00 0.00 O ATOM 744 CB SER A 45 2.934 -4.549 -11.591 1.00 0.00 C ATOM 745 OG SER A 45 2.871 -4.659 -10.180 1.00 0.00 O ATOM 0 H SER A 45 0.834 -3.844 -13.866 1.00 0.00 H new ATOM 0 HA SER A 45 1.762 -5.669 -13.003 1.00 0.00 H new ATOM 0 HB2 SER A 45 3.717 -5.203 -11.975 1.00 0.00 H new ATOM 0 HB3 SER A 45 3.206 -3.530 -11.868 1.00 0.00 H new ATOM 0 HG SER A 45 3.740 -4.420 -9.794 1.00 0.00 H new ATOM 751 N PRO A 46 0.979 -6.720 -10.715 1.00 0.00 N ATOM 752 CA PRO A 46 0.181 -7.417 -9.703 1.00 0.00 C ATOM 753 C PRO A 46 0.282 -6.759 -8.331 1.00 0.00 C ATOM 754 O PRO A 46 -0.405 -7.156 -7.389 1.00 0.00 O ATOM 755 CB PRO A 46 0.795 -8.819 -9.670 1.00 0.00 C ATOM 756 CG PRO A 46 2.195 -8.630 -10.142 1.00 0.00 C ATOM 757 CD PRO A 46 2.147 -7.509 -11.143 1.00 0.00 C ATOM 0 HA PRO A 46 -0.882 -7.408 -9.945 1.00 0.00 H new ATOM 0 HB2 PRO A 46 0.769 -9.239 -8.664 1.00 0.00 H new ATOM 0 HB3 PRO A 46 0.249 -9.506 -10.316 1.00 0.00 H new ATOM 0 HG2 PRO A 46 2.857 -8.384 -9.312 1.00 0.00 H new ATOM 0 HG3 PRO A 46 2.580 -9.543 -10.597 1.00 0.00 H new ATOM 0 HD2 PRO A 46 3.061 -6.915 -11.126 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.029 -7.883 -12.160 1.00 0.00 H new ATOM 765 N TYR A 47 1.142 -5.752 -8.225 1.00 0.00 N ATOM 766 CA TYR A 47 1.334 -5.040 -6.967 1.00 0.00 C ATOM 767 C TYR A 47 0.707 -3.650 -7.027 1.00 0.00 C ATOM 768 O TYR A 47 0.958 -2.883 -7.956 1.00 0.00 O ATOM 769 CB TYR A 47 2.824 -4.926 -6.644 1.00 0.00 C ATOM 770 CG TYR A 47 3.538 -6.259 -6.598 1.00 0.00 C ATOM 771 CD1 TYR A 47 2.901 -7.393 -6.109 1.00 0.00 C ATOM 772 CD2 TYR A 47 4.848 -6.384 -7.042 1.00 0.00 C ATOM 773 CE1 TYR A 47 3.548 -8.612 -6.064 1.00 0.00 C ATOM 774 CE2 TYR A 47 5.503 -7.599 -7.002 1.00 0.00 C ATOM 775 CZ TYR A 47 4.849 -8.711 -6.512 1.00 0.00 C ATOM 776 OH TYR A 47 5.499 -9.923 -6.470 1.00 0.00 O ATOM 0 H TYR A 47 1.717 -5.410 -8.995 1.00 0.00 H new ATOM 0 HA TYR A 47 0.841 -5.608 -6.178 1.00 0.00 H new ATOM 0 HB2 TYR A 47 3.302 -4.293 -7.392 1.00 0.00 H new ATOM 0 HB3 TYR A 47 2.941 -4.427 -5.682 1.00 0.00 H new ATOM 0 HD1 TYR A 47 1.882 -7.320 -5.758 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.363 -5.516 -7.425 1.00 0.00 H new ATOM 0 HE1 TYR A 47 3.038 -9.483 -5.680 1.00 0.00 H new ATOM 0 HE2 TYR A 47 6.522 -7.679 -7.352 1.00 0.00 H new ATOM 0 HH TYR A 47 4.847 -10.648 -6.570 1.00 0.00 H new ATOM 786 N TYR A 48 -0.109 -3.334 -6.028 1.00 0.00 N ATOM 787 CA TYR A 48 -0.774 -2.038 -5.966 1.00 0.00 C ATOM 788 C TYR A 48 0.024 -1.056 -5.113 1.00 0.00 C ATOM 789 O TYR A 48 0.406 -1.365 -3.983 1.00 0.00 O ATOM 790 CB TYR A 48 -2.186 -2.192 -5.399 1.00 0.00 C ATOM 791 CG TYR A 48 -2.954 -0.892 -5.322 1.00 0.00 C ATOM 792 CD1 TYR A 48 -2.811 -0.042 -4.232 1.00 0.00 C ATOM 793 CD2 TYR A 48 -3.821 -0.513 -6.339 1.00 0.00 C ATOM 794 CE1 TYR A 48 -3.511 1.147 -4.157 1.00 0.00 C ATOM 795 CE2 TYR A 48 -4.524 0.675 -6.273 1.00 0.00 C ATOM 796 CZ TYR A 48 -4.365 1.501 -5.180 1.00 0.00 C ATOM 797 OH TYR A 48 -5.064 2.685 -5.110 1.00 0.00 O ATOM 0 H TYR A 48 -0.326 -3.957 -5.250 1.00 0.00 H new ATOM 0 HA TYR A 48 -0.838 -1.643 -6.980 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -2.742 -2.896 -6.018 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -2.122 -2.626 -4.401 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -2.141 -0.315 -3.430 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -3.948 -1.158 -7.196 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -3.390 1.795 -3.302 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -5.194 0.955 -7.073 1.00 0.00 H new ATOM 0 HH TYR A 48 -4.915 3.102 -4.236 1.00 0.00 H new ATOM 807 N LEU A 49 0.272 0.128 -5.661 1.00 0.00 N ATOM 808 CA LEU A 49 1.024 1.157 -4.952 1.00 0.00 C ATOM 809 C LEU A 49 0.272 2.484 -4.959 1.00 0.00 C ATOM 810 O LEU A 49 -0.379 2.834 -5.944 1.00 0.00 O ATOM 811 CB LEU A 49 2.404 1.337 -5.587 1.00 0.00 C ATOM 812 CG LEU A 49 3.417 2.145 -4.775 1.00 0.00 C ATOM 813 CD1 LEU A 49 3.134 3.634 -4.900 1.00 0.00 C ATOM 814 CD2 LEU A 49 3.393 1.717 -3.315 1.00 0.00 C ATOM 0 H LEU A 49 -0.037 0.399 -6.594 1.00 0.00 H new ATOM 0 HA LEU A 49 1.146 0.835 -3.918 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.826 0.350 -5.777 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.276 1.821 -6.555 1.00 0.00 H new ATOM 0 HG LEU A 49 4.412 1.950 -5.174 1.00 0.00 H new ATOM 0 HD11 LEU A 49 3.865 4.194 -4.316 1.00 0.00 H new ATOM 0 HD12 LEU A 49 3.202 3.931 -5.947 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.132 3.846 -4.527 1.00 0.00 H new ATOM 0 HD21 LEU A 49 4.120 2.302 -2.752 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.397 1.883 -2.904 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.644 0.659 -3.242 1.00 0.00 H new ATOM 826 N ARG A 50 0.368 3.218 -3.856 1.00 0.00 N ATOM 827 CA ARG A 50 -0.303 4.507 -3.736 1.00 0.00 C ATOM 828 C ARG A 50 0.707 5.626 -3.497 1.00 0.00 C ATOM 829 O ARG A 50 1.622 5.487 -2.684 1.00 0.00 O ATOM 830 CB ARG A 50 -1.320 4.472 -2.594 1.00 0.00 C ATOM 831 CG ARG A 50 -2.483 5.432 -2.784 1.00 0.00 C ATOM 832 CD ARG A 50 -3.782 4.846 -2.252 1.00 0.00 C ATOM 833 NE ARG A 50 -4.016 5.211 -0.858 1.00 0.00 N ATOM 834 CZ ARG A 50 -5.194 5.095 -0.255 1.00 0.00 C ATOM 835 NH1 ARG A 50 -6.240 4.627 -0.922 1.00 0.00 N ATOM 836 NH2 ARG A 50 -5.328 5.448 1.017 1.00 0.00 N ATOM 0 H ARG A 50 0.904 2.943 -3.033 1.00 0.00 H new ATOM 0 HA ARG A 50 -0.824 4.705 -4.672 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -1.709 3.458 -2.496 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -0.812 4.710 -1.659 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -2.269 6.370 -2.272 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -2.595 5.665 -3.843 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -4.614 5.195 -2.863 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -3.754 3.760 -2.343 1.00 0.00 H new ATOM 0 HE ARG A 50 -3.232 5.575 -0.317 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.141 4.355 -1.900 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -7.144 4.539 -0.457 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -4.526 5.809 1.533 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -6.233 5.358 1.479 1.00 0.00 H new ATOM 850 N LEU A 51 0.535 6.733 -4.210 1.00 0.00 N ATOM 851 CA LEU A 51 1.432 7.876 -4.077 1.00 0.00 C ATOM 852 C LEU A 51 0.652 9.145 -3.746 1.00 0.00 C ATOM 853 O LEU A 51 -0.150 9.620 -4.551 1.00 0.00 O ATOM 854 CB LEU A 51 2.230 8.076 -5.366 1.00 0.00 C ATOM 855 CG LEU A 51 3.176 6.939 -5.753 1.00 0.00 C ATOM 856 CD1 LEU A 51 3.762 7.179 -7.136 1.00 0.00 C ATOM 857 CD2 LEU A 51 4.285 6.793 -4.721 1.00 0.00 C ATOM 0 H LEU A 51 -0.217 6.864 -4.886 1.00 0.00 H new ATOM 0 HA LEU A 51 2.122 7.672 -3.258 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.527 8.231 -6.184 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.814 8.991 -5.270 1.00 0.00 H new ATOM 0 HG LEU A 51 2.605 6.011 -5.778 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.433 6.360 -7.394 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.956 7.233 -7.868 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.317 8.117 -7.138 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.949 5.979 -5.013 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.853 7.722 -4.663 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.849 6.574 -3.747 1.00 0.00 H new ATOM 869 N ARG A 52 0.894 9.689 -2.558 1.00 0.00 N ATOM 870 CA ARG A 52 0.215 10.903 -2.122 1.00 0.00 C ATOM 871 C ARG A 52 1.174 12.089 -2.113 1.00 0.00 C ATOM 872 O ARG A 52 2.077 12.166 -1.279 1.00 0.00 O ATOM 873 CB ARG A 52 -0.382 10.706 -0.727 1.00 0.00 C ATOM 874 CG ARG A 52 -1.162 11.909 -0.222 1.00 0.00 C ATOM 875 CD ARG A 52 -2.366 12.202 -1.104 1.00 0.00 C ATOM 876 NE ARG A 52 -3.439 12.861 -0.364 1.00 0.00 N ATOM 877 CZ ARG A 52 -4.170 12.255 0.564 1.00 0.00 C ATOM 878 NH1 ARG A 52 -3.945 10.984 0.866 1.00 0.00 N ATOM 879 NH2 ARG A 52 -5.129 12.922 1.194 1.00 0.00 N ATOM 0 H ARG A 52 1.555 9.308 -1.881 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.589 11.113 -2.828 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -1.040 9.837 -0.742 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.422 10.484 -0.025 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -1.494 11.726 0.800 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -0.509 12.782 -0.194 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -2.059 12.834 -1.938 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.739 11.270 -1.530 1.00 0.00 H new ATOM 0 HE ARG A 52 -3.638 13.840 -0.571 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -3.208 10.468 0.385 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.509 10.522 1.580 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -5.305 13.900 0.965 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -5.690 12.456 1.907 1.00 0.00 H new ATOM 893 N PHE A 53 0.973 13.013 -3.047 1.00 0.00 N ATOM 894 CA PHE A 53 1.821 14.195 -3.149 1.00 0.00 C ATOM 895 C PHE A 53 1.184 15.384 -2.436 1.00 0.00 C ATOM 896 O PHE A 53 -0.030 15.446 -2.241 1.00 0.00 O ATOM 897 CB PHE A 53 2.075 14.543 -4.617 1.00 0.00 C ATOM 898 CG PHE A 53 2.695 13.421 -5.400 1.00 0.00 C ATOM 899 CD1 PHE A 53 3.473 12.464 -4.768 1.00 0.00 C ATOM 900 CD2 PHE A 53 2.500 13.323 -6.768 1.00 0.00 C ATOM 901 CE1 PHE A 53 4.044 11.430 -5.486 1.00 0.00 C ATOM 902 CE2 PHE A 53 3.068 12.291 -7.491 1.00 0.00 C ATOM 903 CZ PHE A 53 3.842 11.344 -6.849 1.00 0.00 C ATOM 0 H PHE A 53 0.230 12.966 -3.744 1.00 0.00 H new ATOM 0 HA PHE A 53 2.772 13.971 -2.667 1.00 0.00 H new ATOM 0 HB2 PHE A 53 1.131 14.823 -5.084 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.727 15.415 -4.668 1.00 0.00 H new ATOM 0 HD1 PHE A 53 3.635 12.527 -3.702 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.897 14.062 -7.275 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.648 10.690 -4.981 1.00 0.00 H new ATOM 0 HE2 PHE A 53 2.907 12.225 -8.557 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.288 10.538 -7.412 1.00 0.00 H new ATOM 913 N PRO A 54 2.022 16.352 -2.035 1.00 0.00 N ATOM 914 CA PRO A 54 1.564 17.557 -1.338 1.00 0.00 C ATOM 915 C PRO A 54 0.769 18.487 -2.248 1.00 0.00 C ATOM 916 O PRO A 54 0.213 19.488 -1.795 1.00 0.00 O ATOM 917 CB PRO A 54 2.868 18.228 -0.896 1.00 0.00 C ATOM 918 CG PRO A 54 3.890 17.744 -1.864 1.00 0.00 C ATOM 919 CD PRO A 54 3.481 16.344 -2.234 1.00 0.00 C ATOM 0 HA PRO A 54 0.890 17.320 -0.515 1.00 0.00 H new ATOM 0 HB2 PRO A 54 2.782 19.314 -0.921 1.00 0.00 H new ATOM 0 HB3 PRO A 54 3.129 17.952 0.126 1.00 0.00 H new ATOM 0 HG2 PRO A 54 3.928 18.385 -2.745 1.00 0.00 H new ATOM 0 HG3 PRO A 54 4.885 17.755 -1.419 1.00 0.00 H new ATOM 0 HD2 PRO A 54 3.745 16.107 -3.265 1.00 0.00 H new ATOM 0 HD3 PRO A 54 3.969 15.602 -1.602 1.00 0.00 H new ATOM 927 N HIS A 55 0.718 18.149 -3.532 1.00 0.00 N ATOM 928 CA HIS A 55 -0.011 18.954 -4.506 1.00 0.00 C ATOM 929 C HIS A 55 -1.142 18.148 -5.139 1.00 0.00 C ATOM 930 O HIS A 55 -1.443 17.037 -4.704 1.00 0.00 O ATOM 931 CB HIS A 55 0.938 19.462 -5.592 1.00 0.00 C ATOM 932 CG HIS A 55 2.047 20.319 -5.064 1.00 0.00 C ATOM 933 ND1 HIS A 55 3.304 19.999 -4.677 1.00 0.00 N flip ATOM 934 CD2 HIS A 55 1.926 21.680 -4.882 1.00 0.00 C flip ATOM 935 CE1 HIS A 55 3.914 21.162 -4.273 1.00 0.00 C flip ATOM 936 NE2 HIS A 55 3.061 22.162 -4.408 1.00 0.00 N flip ATOM 0 H HIS A 55 1.172 17.324 -3.923 1.00 0.00 H new ATOM 0 HA HIS A 55 -0.444 19.807 -3.984 1.00 0.00 H new ATOM 0 HB2 HIS A 55 1.367 18.608 -6.116 1.00 0.00 H new ATOM 0 HB3 HIS A 55 0.367 20.032 -6.325 1.00 0.00 H new ATOM 0 HD2 HIS A 55 1.041 22.262 -5.094 1.00 0.00 H new ATOM 0 HE1 HIS A 55 4.926 21.245 -3.905 1.00 0.00 H new ATOM 0 HE2 HIS A 55 3.247 23.140 -4.184 1.00 0.00 H new ATOM 944 N GLU A 56 -1.765 18.718 -6.166 1.00 0.00 N ATOM 945 CA GLU A 56 -2.864 18.052 -6.856 1.00 0.00 C ATOM 946 C GLU A 56 -2.574 17.931 -8.349 1.00 0.00 C ATOM 947 O GLU A 56 -2.319 18.927 -9.027 1.00 0.00 O ATOM 948 CB GLU A 56 -4.170 18.819 -6.640 1.00 0.00 C ATOM 949 CG GLU A 56 -4.025 20.323 -6.793 1.00 0.00 C ATOM 950 CD GLU A 56 -3.588 21.001 -5.509 1.00 0.00 C ATOM 951 OE1 GLU A 56 -4.315 20.888 -4.500 1.00 0.00 O ATOM 952 OE2 GLU A 56 -2.517 21.644 -5.514 1.00 0.00 O ATOM 0 H GLU A 56 -1.528 19.638 -6.538 1.00 0.00 H new ATOM 0 HA GLU A 56 -2.967 17.050 -6.440 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.914 18.460 -7.351 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.550 18.599 -5.642 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -3.299 20.536 -7.577 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -4.977 20.745 -7.116 1.00 0.00 H new ATOM 959 N LEU A 57 -2.614 16.703 -8.856 1.00 0.00 N ATOM 960 CA LEU A 57 -2.355 16.449 -10.269 1.00 0.00 C ATOM 961 C LEU A 57 -3.659 16.244 -11.033 1.00 0.00 C ATOM 962 O LEU A 57 -4.746 16.382 -10.472 1.00 0.00 O ATOM 963 CB LEU A 57 -1.457 15.221 -10.430 1.00 0.00 C ATOM 964 CG LEU A 57 -0.201 15.189 -9.559 1.00 0.00 C ATOM 965 CD1 LEU A 57 0.091 13.770 -9.096 1.00 0.00 C ATOM 966 CD2 LEU A 57 0.989 15.759 -10.317 1.00 0.00 C ATOM 0 H LEU A 57 -2.823 15.868 -8.309 1.00 0.00 H new ATOM 0 HA LEU A 57 -1.846 17.320 -10.683 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.049 14.332 -10.212 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.152 15.153 -11.474 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.377 15.808 -8.679 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.988 13.767 -8.477 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.752 13.396 -8.515 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.246 13.129 -9.964 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.874 15.728 -9.681 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.166 15.167 -11.215 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.780 16.791 -10.599 1.00 0.00 H new ATOM 978 N ILE A 58 -3.542 15.913 -12.314 1.00 0.00 N ATOM 979 CA ILE A 58 -4.711 15.685 -13.154 1.00 0.00 C ATOM 980 C ILE A 58 -4.459 14.564 -14.156 1.00 0.00 C ATOM 981 O ILE A 58 -3.351 14.417 -14.673 1.00 0.00 O ATOM 982 CB ILE A 58 -5.112 16.961 -13.918 1.00 0.00 C ATOM 983 CG1 ILE A 58 -6.306 16.679 -14.833 1.00 0.00 C ATOM 984 CG2 ILE A 58 -3.934 17.488 -14.724 1.00 0.00 C ATOM 985 CD1 ILE A 58 -6.895 17.925 -15.458 1.00 0.00 C ATOM 0 H ILE A 58 -2.649 15.797 -12.793 1.00 0.00 H new ATOM 0 HA ILE A 58 -5.526 15.398 -12.489 1.00 0.00 H new ATOM 0 HB ILE A 58 -5.403 17.723 -13.195 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -5.994 15.998 -15.625 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -7.080 16.169 -14.260 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -4.233 18.390 -15.258 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -3.108 17.721 -14.052 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.615 16.731 -15.440 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -7.737 17.650 -16.094 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -7.238 18.599 -14.673 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -6.135 18.425 -16.059 1.00 0.00 H new ATOM 997 N ASP A 59 -5.494 13.776 -14.426 1.00 0.00 N ATOM 998 CA ASP A 59 -5.386 12.669 -15.369 1.00 0.00 C ATOM 999 C ASP A 59 -6.085 13.004 -16.683 1.00 0.00 C ATOM 1000 O ASP A 59 -7.313 13.045 -16.752 1.00 0.00 O ATOM 1001 CB ASP A 59 -5.988 11.398 -14.767 1.00 0.00 C ATOM 1002 CG ASP A 59 -6.551 10.468 -15.823 1.00 0.00 C ATOM 1003 OD1 ASP A 59 -5.775 10.016 -16.690 1.00 0.00 O ATOM 1004 OD2 ASP A 59 -7.769 10.192 -15.783 1.00 0.00 O ATOM 0 H ASP A 59 -6.417 13.883 -14.005 1.00 0.00 H new ATOM 0 HA ASP A 59 -4.329 12.500 -15.573 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -5.223 10.873 -14.195 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -6.779 11.670 -14.068 1.00 0.00 H new ATOM 1009 N ASP A 60 -5.294 13.244 -17.723 1.00 0.00 N ATOM 1010 CA ASP A 60 -5.836 13.576 -19.036 1.00 0.00 C ATOM 1011 C ASP A 60 -5.285 12.636 -20.104 1.00 0.00 C ATOM 1012 O ASP A 60 -4.598 11.664 -19.794 1.00 0.00 O ATOM 1013 CB ASP A 60 -5.507 15.026 -19.395 1.00 0.00 C ATOM 1014 CG ASP A 60 -6.729 15.922 -19.359 1.00 0.00 C ATOM 1015 OD1 ASP A 60 -7.696 15.579 -18.647 1.00 0.00 O ATOM 1016 OD2 ASP A 60 -6.718 16.968 -20.042 1.00 0.00 O ATOM 0 H ASP A 60 -4.275 13.215 -17.683 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.919 13.457 -18.996 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -4.759 15.409 -18.701 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -5.065 15.059 -20.391 1.00 0.00 H new ATOM 1021 N GLU A 61 -5.594 12.934 -21.362 1.00 0.00 N ATOM 1022 CA GLU A 61 -5.132 12.114 -22.476 1.00 0.00 C ATOM 1023 C GLU A 61 -3.607 12.072 -22.524 1.00 0.00 C ATOM 1024 O GLU A 61 -3.014 11.049 -22.868 1.00 0.00 O ATOM 1025 CB GLU A 61 -5.680 12.654 -23.798 1.00 0.00 C ATOM 1026 CG GLU A 61 -7.135 13.085 -23.724 1.00 0.00 C ATOM 1027 CD GLU A 61 -7.765 13.252 -25.093 1.00 0.00 C ATOM 1028 OE1 GLU A 61 -7.045 13.097 -26.101 1.00 0.00 O ATOM 1029 OE2 GLU A 61 -8.980 13.537 -25.155 1.00 0.00 O ATOM 0 H GLU A 61 -6.162 13.736 -21.635 1.00 0.00 H new ATOM 0 HA GLU A 61 -5.502 11.100 -22.325 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -5.074 13.504 -24.113 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -5.576 11.887 -24.565 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -7.700 12.346 -23.156 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -7.204 14.027 -23.179 1.00 0.00 H new ATOM 1036 N ARG A 62 -2.979 13.191 -22.178 1.00 0.00 N ATOM 1037 CA ARG A 62 -1.524 13.283 -22.184 1.00 0.00 C ATOM 1038 C ARG A 62 -0.911 12.272 -21.219 1.00 0.00 C ATOM 1039 O ARG A 62 0.133 11.685 -21.500 1.00 0.00 O ATOM 1040 CB ARG A 62 -1.080 14.698 -21.806 1.00 0.00 C ATOM 1041 CG ARG A 62 -1.843 15.282 -20.629 1.00 0.00 C ATOM 1042 CD ARG A 62 -2.704 16.462 -21.054 1.00 0.00 C ATOM 1043 NE ARG A 62 -2.031 17.739 -20.829 1.00 0.00 N ATOM 1044 CZ ARG A 62 -1.388 18.407 -21.780 1.00 0.00 C ATOM 1045 NH1 ARG A 62 -1.332 17.924 -23.013 1.00 0.00 N ATOM 1046 NH2 ARG A 62 -0.800 19.563 -21.498 1.00 0.00 N ATOM 0 H ARG A 62 -3.455 14.046 -21.890 1.00 0.00 H new ATOM 0 HA ARG A 62 -1.175 13.056 -23.191 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -0.016 14.684 -21.568 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -1.205 15.352 -22.669 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -2.473 14.512 -20.184 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -1.139 15.602 -19.860 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -2.955 16.366 -22.110 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -3.643 16.444 -20.500 1.00 0.00 H new ATOM 0 HE ARG A 62 -2.056 18.139 -19.891 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -1.784 17.037 -23.234 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -0.837 18.440 -23.741 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -0.842 19.939 -20.551 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -0.306 20.076 -22.229 1.00 0.00 H new ATOM 1060 N SER A 63 -1.569 12.074 -20.081 1.00 0.00 N ATOM 1061 CA SER A 63 -1.087 11.137 -19.073 1.00 0.00 C ATOM 1062 C SER A 63 -1.020 9.721 -19.635 1.00 0.00 C ATOM 1063 O SER A 63 -1.965 9.244 -20.265 1.00 0.00 O ATOM 1064 CB SER A 63 -1.996 11.167 -17.843 1.00 0.00 C ATOM 1065 OG SER A 63 -1.664 12.248 -16.989 1.00 0.00 O ATOM 0 H SER A 63 -2.437 12.550 -19.834 1.00 0.00 H new ATOM 0 HA SER A 63 -0.082 11.441 -18.781 1.00 0.00 H new ATOM 0 HB2 SER A 63 -3.036 11.254 -18.158 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.906 10.228 -17.297 1.00 0.00 H new ATOM 0 HG SER A 63 -2.475 12.751 -16.767 1.00 0.00 H new ATOM 1071 N THR A 64 0.105 9.051 -19.404 1.00 0.00 N ATOM 1072 CA THR A 64 0.298 7.690 -19.887 1.00 0.00 C ATOM 1073 C THR A 64 1.597 7.096 -19.354 1.00 0.00 C ATOM 1074 O THR A 64 2.460 7.816 -18.853 1.00 0.00 O ATOM 1075 CB THR A 64 0.317 7.639 -21.427 1.00 0.00 C ATOM 1076 OG1 THR A 64 0.496 6.289 -21.869 1.00 0.00 O ATOM 1077 CG2 THR A 64 1.431 8.512 -21.984 1.00 0.00 C ATOM 0 H THR A 64 0.897 9.430 -18.885 1.00 0.00 H new ATOM 0 HA THR A 64 -0.544 7.102 -19.521 1.00 0.00 H new ATOM 0 HB THR A 64 -0.637 8.018 -21.793 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.505 6.264 -22.849 1.00 0.00 H new ATOM 0 HG21 THR A 64 1.424 8.460 -23.073 1.00 0.00 H new ATOM 0 HG22 THR A 64 1.276 9.544 -21.669 1.00 0.00 H new ATOM 0 HG23 THR A 64 2.392 8.159 -21.610 1.00 0.00 H new ATOM 1085 N ALA A 65 1.730 5.779 -19.467 1.00 0.00 N ATOM 1086 CA ALA A 65 2.925 5.088 -18.998 1.00 0.00 C ATOM 1087 C ALA A 65 3.464 4.139 -20.063 1.00 0.00 C ATOM 1088 O ALA A 65 2.697 3.510 -20.791 1.00 0.00 O ATOM 1089 CB ALA A 65 2.626 4.329 -17.714 1.00 0.00 C ATOM 0 H ALA A 65 1.025 5.169 -19.880 1.00 0.00 H new ATOM 0 HA ALA A 65 3.691 5.836 -18.795 1.00 0.00 H new ATOM 0 HB1 ALA A 65 3.527 3.818 -17.375 1.00 0.00 H new ATOM 0 HB2 ALA A 65 2.295 5.029 -16.946 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.841 3.596 -17.899 1.00 0.00 H new ATOM 1095 N GLN A 66 4.787 4.043 -20.149 1.00 0.00 N ATOM 1096 CA GLN A 66 5.427 3.172 -21.127 1.00 0.00 C ATOM 1097 C GLN A 66 6.337 2.159 -20.439 1.00 0.00 C ATOM 1098 O GLN A 66 7.145 2.516 -19.582 1.00 0.00 O ATOM 1099 CB GLN A 66 6.232 4.000 -22.130 1.00 0.00 C ATOM 1100 CG GLN A 66 5.407 5.056 -22.848 1.00 0.00 C ATOM 1101 CD GLN A 66 6.254 6.193 -23.384 1.00 0.00 C ATOM 1102 OE1 GLN A 66 7.339 5.974 -23.924 1.00 0.00 O ATOM 1103 NE2 GLN A 66 5.762 7.418 -23.238 1.00 0.00 N ATOM 0 H GLN A 66 5.436 4.557 -19.553 1.00 0.00 H new ATOM 0 HA GLN A 66 4.646 2.629 -21.660 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.056 4.487 -21.608 1.00 0.00 H new ATOM 0 HB3 GLN A 66 6.674 3.331 -22.869 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.866 4.591 -23.672 1.00 0.00 H new ATOM 0 HG3 GLN A 66 4.660 5.456 -22.162 1.00 0.00 H new ATOM 0 HE21 GLN A 66 4.859 7.554 -22.784 1.00 0.00 H new ATOM 0 HE22 GLN A 66 6.288 8.223 -23.580 1.00 0.00 H new ATOM 1112 N TYR A 67 6.200 0.894 -20.821 1.00 0.00 N ATOM 1113 CA TYR A 67 7.007 -0.172 -20.240 1.00 0.00 C ATOM 1114 C TYR A 67 8.320 -0.337 -20.999 1.00 0.00 C ATOM 1115 O TYR A 67 8.329 -0.493 -22.220 1.00 0.00 O ATOM 1116 CB TYR A 67 6.232 -1.490 -20.247 1.00 0.00 C ATOM 1117 CG TYR A 67 7.097 -2.703 -19.989 1.00 0.00 C ATOM 1118 CD1 TYR A 67 8.107 -2.670 -19.035 1.00 0.00 C ATOM 1119 CD2 TYR A 67 6.903 -3.883 -20.697 1.00 0.00 C ATOM 1120 CE1 TYR A 67 8.900 -3.776 -18.796 1.00 0.00 C ATOM 1121 CE2 TYR A 67 7.690 -4.994 -20.464 1.00 0.00 C ATOM 1122 CZ TYR A 67 8.688 -4.935 -19.513 1.00 0.00 C ATOM 1123 OH TYR A 67 9.475 -6.039 -19.277 1.00 0.00 O ATOM 0 H TYR A 67 5.537 0.582 -21.531 1.00 0.00 H new ATOM 0 HA TYR A 67 7.235 0.101 -19.210 1.00 0.00 H new ATOM 0 HB2 TYR A 67 5.449 -1.445 -19.490 1.00 0.00 H new ATOM 0 HB3 TYR A 67 5.737 -1.606 -21.211 1.00 0.00 H new ATOM 0 HD1 TYR A 67 8.275 -1.765 -18.471 1.00 0.00 H new ATOM 0 HD2 TYR A 67 6.123 -3.932 -21.443 1.00 0.00 H new ATOM 0 HE1 TYR A 67 9.682 -3.733 -18.052 1.00 0.00 H new ATOM 0 HE2 TYR A 67 7.525 -5.903 -21.023 1.00 0.00 H new ATOM 0 HH TYR A 67 9.195 -6.772 -19.864 1.00 0.00 H new ATOM 1133 N ASP A 68 9.428 -0.302 -20.267 1.00 0.00 N ATOM 1134 CA ASP A 68 10.748 -0.448 -20.869 1.00 0.00 C ATOM 1135 C ASP A 68 11.297 -1.853 -20.639 1.00 0.00 C ATOM 1136 O ASP A 68 11.504 -2.270 -19.499 1.00 0.00 O ATOM 1137 CB ASP A 68 11.712 0.591 -20.295 1.00 0.00 C ATOM 1138 CG ASP A 68 11.568 1.945 -20.961 1.00 0.00 C ATOM 1139 OD1 ASP A 68 10.888 2.023 -22.006 1.00 0.00 O ATOM 1140 OD2 ASP A 68 12.133 2.927 -20.436 1.00 0.00 O ATOM 0 H ASP A 68 9.438 -0.174 -19.255 1.00 0.00 H new ATOM 0 HA ASP A 68 10.651 -0.287 -21.943 1.00 0.00 H new ATOM 0 HB2 ASP A 68 11.534 0.695 -19.225 1.00 0.00 H new ATOM 0 HB3 ASP A 68 12.736 0.237 -20.415 1.00 0.00 H new ATOM 1145 N SER A 69 11.530 -2.578 -21.728 1.00 0.00 N ATOM 1146 CA SER A 69 12.050 -3.937 -21.645 1.00 0.00 C ATOM 1147 C SER A 69 13.574 -3.933 -21.579 1.00 0.00 C ATOM 1148 O SER A 69 14.177 -4.677 -20.805 1.00 0.00 O ATOM 1149 CB SER A 69 11.583 -4.760 -22.848 1.00 0.00 C ATOM 1150 OG SER A 69 11.885 -4.100 -24.065 1.00 0.00 O ATOM 0 H SER A 69 11.367 -2.246 -22.679 1.00 0.00 H new ATOM 0 HA SER A 69 11.665 -4.391 -20.732 1.00 0.00 H new ATOM 0 HB2 SER A 69 12.064 -5.738 -22.832 1.00 0.00 H new ATOM 0 HB3 SER A 69 10.509 -4.931 -22.780 1.00 0.00 H new ATOM 0 HG SER A 69 11.578 -4.647 -24.818 1.00 0.00 H new ATOM 1156 N LYS A 70 14.193 -3.088 -22.398 1.00 0.00 N ATOM 1157 CA LYS A 70 15.647 -2.983 -22.434 1.00 0.00 C ATOM 1158 C LYS A 70 16.198 -2.588 -21.068 1.00 0.00 C ATOM 1159 O LYS A 70 17.378 -2.790 -20.782 1.00 0.00 O ATOM 1160 CB LYS A 70 16.078 -1.959 -23.485 1.00 0.00 C ATOM 1161 CG LYS A 70 15.773 -0.522 -23.097 1.00 0.00 C ATOM 1162 CD LYS A 70 14.497 -0.026 -23.757 1.00 0.00 C ATOM 1163 CE LYS A 70 13.783 0.998 -22.888 1.00 0.00 C ATOM 1164 NZ LYS A 70 14.191 2.391 -23.222 1.00 0.00 N ATOM 0 H LYS A 70 13.710 -2.466 -23.046 1.00 0.00 H new ATOM 0 HA LYS A 70 16.051 -3.960 -22.700 1.00 0.00 H new ATOM 0 HB2 LYS A 70 17.149 -2.060 -23.660 1.00 0.00 H new ATOM 0 HB3 LYS A 70 15.579 -2.186 -24.427 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.676 -0.449 -22.014 1.00 0.00 H new ATOM 0 HG3 LYS A 70 16.606 0.119 -23.386 1.00 0.00 H new ATOM 0 HD2 LYS A 70 14.735 0.418 -24.724 1.00 0.00 H new ATOM 0 HD3 LYS A 70 13.833 -0.869 -23.948 1.00 0.00 H new ATOM 0 HE2 LYS A 70 12.706 0.895 -23.016 1.00 0.00 H new ATOM 0 HE3 LYS A 70 14.000 0.798 -21.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 13.682 3.058 -22.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 15.215 2.497 -23.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 13.961 2.591 -24.216 1.00 0.00 H new ATOM 1178 N ASP A 71 15.336 -2.026 -20.227 1.00 0.00 N ATOM 1179 CA ASP A 71 15.736 -1.605 -18.890 1.00 0.00 C ATOM 1180 C ASP A 71 14.859 -2.261 -17.828 1.00 0.00 C ATOM 1181 O ASP A 71 15.104 -2.117 -16.631 1.00 0.00 O ATOM 1182 CB ASP A 71 15.656 -0.082 -18.765 1.00 0.00 C ATOM 1183 CG ASP A 71 16.322 0.431 -17.504 1.00 0.00 C ATOM 1184 OD1 ASP A 71 17.352 -0.147 -17.100 1.00 0.00 O ATOM 1185 OD2 ASP A 71 15.813 1.412 -16.921 1.00 0.00 O ATOM 0 H ASP A 71 14.356 -1.852 -20.448 1.00 0.00 H new ATOM 0 HA ASP A 71 16.767 -1.921 -18.731 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.128 0.376 -19.634 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.610 0.226 -18.771 1.00 0.00 H new ATOM 1190 N GLU A 72 13.835 -2.981 -18.276 1.00 0.00 N ATOM 1191 CA GLU A 72 12.921 -3.658 -17.364 1.00 0.00 C ATOM 1192 C GLU A 72 12.327 -2.674 -16.360 1.00 0.00 C ATOM 1193 O GLU A 72 11.945 -3.056 -15.253 1.00 0.00 O ATOM 1194 CB GLU A 72 13.645 -4.785 -16.623 1.00 0.00 C ATOM 1195 CG GLU A 72 13.973 -5.979 -17.504 1.00 0.00 C ATOM 1196 CD GLU A 72 14.809 -7.021 -16.786 1.00 0.00 C ATOM 1197 OE1 GLU A 72 14.558 -7.258 -15.586 1.00 0.00 O ATOM 1198 OE2 GLU A 72 15.714 -7.598 -17.423 1.00 0.00 O ATOM 0 H GLU A 72 13.618 -3.110 -19.264 1.00 0.00 H new ATOM 0 HA GLU A 72 12.109 -4.084 -17.954 1.00 0.00 H new ATOM 0 HB2 GLU A 72 14.569 -4.394 -16.197 1.00 0.00 H new ATOM 0 HB3 GLU A 72 13.026 -5.118 -15.790 1.00 0.00 H new ATOM 0 HG2 GLU A 72 13.046 -6.437 -17.849 1.00 0.00 H new ATOM 0 HG3 GLU A 72 14.508 -5.636 -18.390 1.00 0.00 H new ATOM 1205 N CYS A 73 12.254 -1.408 -16.754 1.00 0.00 N ATOM 1206 CA CYS A 73 11.708 -0.368 -15.889 1.00 0.00 C ATOM 1207 C CYS A 73 10.385 0.156 -16.437 1.00 0.00 C ATOM 1208 O CYS A 73 10.069 -0.035 -17.612 1.00 0.00 O ATOM 1209 CB CYS A 73 12.706 0.781 -15.746 1.00 0.00 C ATOM 1210 SG CYS A 73 12.715 1.552 -14.110 1.00 0.00 S ATOM 0 H CYS A 73 12.566 -1.076 -17.667 1.00 0.00 H new ATOM 0 HA CYS A 73 11.526 -0.805 -14.907 1.00 0.00 H new ATOM 0 HB2 CYS A 73 13.707 0.408 -15.966 1.00 0.00 H new ATOM 0 HB3 CYS A 73 12.478 1.541 -16.493 1.00 0.00 H new ATOM 0 HG CYS A 73 11.658 1.182 -13.450 1.00 0.00 H new ATOM 1216 N ILE A 74 9.614 0.816 -15.579 1.00 0.00 N ATOM 1217 CA ILE A 74 8.325 1.368 -15.978 1.00 0.00 C ATOM 1218 C ILE A 74 8.316 2.887 -15.855 1.00 0.00 C ATOM 1219 O ILE A 74 8.726 3.440 -14.835 1.00 0.00 O ATOM 1220 CB ILE A 74 7.178 0.788 -15.130 1.00 0.00 C ATOM 1221 CG1 ILE A 74 7.190 -0.741 -15.193 1.00 0.00 C ATOM 1222 CG2 ILE A 74 5.840 1.333 -15.605 1.00 0.00 C ATOM 1223 CD1 ILE A 74 6.696 -1.294 -16.512 1.00 0.00 C ATOM 0 H ILE A 74 9.860 0.981 -14.603 1.00 0.00 H new ATOM 0 HA ILE A 74 8.171 1.090 -17.021 1.00 0.00 H new ATOM 0 HB ILE A 74 7.324 1.091 -14.093 1.00 0.00 H new ATOM 0 HG12 ILE A 74 8.205 -1.096 -15.016 1.00 0.00 H new ATOM 0 HG13 ILE A 74 6.570 -1.135 -14.388 1.00 0.00 H new ATOM 0 HG21 ILE A 74 5.039 0.914 -14.996 1.00 0.00 H new ATOM 0 HG22 ILE A 74 5.836 2.419 -15.512 1.00 0.00 H new ATOM 0 HG23 ILE A 74 5.685 1.057 -16.648 1.00 0.00 H new ATOM 0 HD11 ILE A 74 6.732 -2.383 -16.486 1.00 0.00 H new ATOM 0 HD12 ILE A 74 5.670 -0.969 -16.681 1.00 0.00 H new ATOM 0 HD13 ILE A 74 7.330 -0.929 -17.320 1.00 0.00 H new ATOM 1235 N ASN A 75 7.843 3.557 -16.901 1.00 0.00 N ATOM 1236 CA ASN A 75 7.778 5.014 -16.910 1.00 0.00 C ATOM 1237 C ASN A 75 6.332 5.495 -16.846 1.00 0.00 C ATOM 1238 O ASN A 75 5.506 5.127 -17.681 1.00 0.00 O ATOM 1239 CB ASN A 75 8.456 5.568 -18.165 1.00 0.00 C ATOM 1240 CG ASN A 75 9.822 4.952 -18.404 1.00 0.00 C ATOM 1241 OD1 ASN A 75 10.848 5.542 -18.065 1.00 0.00 O ATOM 1242 ND2 ASN A 75 9.839 3.761 -18.991 1.00 0.00 N ATOM 0 H ASN A 75 7.499 3.114 -17.753 1.00 0.00 H new ATOM 0 HA ASN A 75 8.304 5.381 -16.029 1.00 0.00 H new ATOM 0 HB2 ASN A 75 7.820 5.382 -19.030 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.559 6.649 -18.072 1.00 0.00 H new ATOM 0 HD21 ASN A 75 10.728 3.297 -19.178 1.00 0.00 H new ATOM 0 HD22 ASN A 75 8.963 3.310 -19.255 1.00 0.00 H new ATOM 1249 N VAL A 76 6.032 6.321 -15.848 1.00 0.00 N ATOM 1250 CA VAL A 76 4.687 6.854 -15.675 1.00 0.00 C ATOM 1251 C VAL A 76 4.670 8.369 -15.843 1.00 0.00 C ATOM 1252 O VAL A 76 5.479 9.081 -15.246 1.00 0.00 O ATOM 1253 CB VAL A 76 4.115 6.496 -14.290 1.00 0.00 C ATOM 1254 CG1 VAL A 76 2.678 6.979 -14.165 1.00 0.00 C ATOM 1255 CG2 VAL A 76 4.205 4.997 -14.049 1.00 0.00 C ATOM 0 H VAL A 76 6.703 6.635 -15.147 1.00 0.00 H new ATOM 0 HA VAL A 76 4.065 6.399 -16.446 1.00 0.00 H new ATOM 0 HB VAL A 76 4.710 7.000 -13.528 1.00 0.00 H new ATOM 0 HG11 VAL A 76 2.291 6.717 -13.180 1.00 0.00 H new ATOM 0 HG12 VAL A 76 2.646 8.061 -14.292 1.00 0.00 H new ATOM 0 HG13 VAL A 76 2.067 6.505 -14.933 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.797 4.761 -13.066 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.635 4.471 -14.815 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.248 4.683 -14.093 1.00 0.00 H new ATOM 1265 N LYS A 77 3.743 8.858 -16.660 1.00 0.00 N ATOM 1266 CA LYS A 77 3.619 10.290 -16.906 1.00 0.00 C ATOM 1267 C LYS A 77 2.331 10.837 -16.298 1.00 0.00 C ATOM 1268 O LYS A 77 1.283 10.193 -16.357 1.00 0.00 O ATOM 1269 CB LYS A 77 3.646 10.574 -18.410 1.00 0.00 C ATOM 1270 CG LYS A 77 3.667 12.054 -18.749 1.00 0.00 C ATOM 1271 CD LYS A 77 2.271 12.581 -19.033 1.00 0.00 C ATOM 1272 CE LYS A 77 2.316 13.903 -19.785 1.00 0.00 C ATOM 1273 NZ LYS A 77 1.220 14.819 -19.364 1.00 0.00 N ATOM 0 H LYS A 77 3.067 8.284 -17.163 1.00 0.00 H new ATOM 0 HA LYS A 77 4.464 10.789 -16.433 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.524 10.098 -18.845 1.00 0.00 H new ATOM 0 HB3 LYS A 77 2.772 10.116 -18.873 1.00 0.00 H new ATOM 0 HG2 LYS A 77 4.106 12.611 -17.922 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.303 12.220 -19.618 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.716 11.847 -19.618 1.00 0.00 H new ATOM 0 HD3 LYS A 77 1.733 12.713 -18.094 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.278 14.385 -19.614 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.240 13.714 -20.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.113 15.578 -20.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.330 14.286 -19.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.450 15.234 -18.438 1.00 0.00 H new ATOM 1287 N VAL A 78 2.416 12.029 -15.716 1.00 0.00 N ATOM 1288 CA VAL A 78 1.257 12.663 -15.100 1.00 0.00 C ATOM 1289 C VAL A 78 1.299 14.177 -15.279 1.00 0.00 C ATOM 1290 O VAL A 78 2.275 14.829 -14.912 1.00 0.00 O ATOM 1291 CB VAL A 78 1.172 12.338 -13.597 1.00 0.00 C ATOM 1292 CG1 VAL A 78 -0.006 13.060 -12.960 1.00 0.00 C ATOM 1293 CG2 VAL A 78 1.066 10.835 -13.383 1.00 0.00 C ATOM 0 H VAL A 78 3.276 12.575 -15.658 1.00 0.00 H new ATOM 0 HA VAL A 78 0.375 12.264 -15.601 1.00 0.00 H new ATOM 0 HB VAL A 78 2.085 12.688 -13.115 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.050 12.818 -11.898 1.00 0.00 H new ATOM 0 HG12 VAL A 78 0.117 14.136 -13.082 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.931 12.744 -13.443 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.007 10.623 -12.316 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.170 10.459 -13.878 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.945 10.345 -13.802 1.00 0.00 H new ATOM 1303 N ALA A 79 0.231 14.729 -15.847 1.00 0.00 N ATOM 1304 CA ALA A 79 0.145 16.167 -16.073 1.00 0.00 C ATOM 1305 C ALA A 79 -0.210 16.904 -14.786 1.00 0.00 C ATOM 1306 O ALA A 79 -1.112 16.498 -14.053 1.00 0.00 O ATOM 1307 CB ALA A 79 -0.880 16.470 -17.156 1.00 0.00 C ATOM 0 H ALA A 79 -0.585 14.203 -16.159 1.00 0.00 H new ATOM 0 HA ALA A 79 1.123 16.517 -16.404 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.934 17.547 -17.315 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -0.584 15.981 -18.084 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.857 16.099 -16.846 1.00 0.00 H new ATOM 1313 N LYS A 80 0.506 17.991 -14.516 1.00 0.00 N ATOM 1314 CA LYS A 80 0.267 18.787 -13.318 1.00 0.00 C ATOM 1315 C LYS A 80 -0.684 19.942 -13.613 1.00 0.00 C ATOM 1316 O LYS A 80 -0.642 20.535 -14.692 1.00 0.00 O ATOM 1317 CB LYS A 80 1.589 19.328 -12.769 1.00 0.00 C ATOM 1318 CG LYS A 80 1.709 19.222 -11.258 1.00 0.00 C ATOM 1319 CD LYS A 80 1.147 20.452 -10.566 1.00 0.00 C ATOM 1320 CE LYS A 80 0.980 20.224 -9.072 1.00 0.00 C ATOM 1321 NZ LYS A 80 -0.031 21.143 -8.480 1.00 0.00 N ATOM 0 H LYS A 80 1.257 18.341 -15.111 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.194 18.143 -12.569 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.414 18.784 -13.230 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.694 20.373 -13.061 1.00 0.00 H new ATOM 0 HG2 LYS A 80 1.179 18.335 -10.911 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.756 19.096 -10.983 1.00 0.00 H new ATOM 0 HD2 LYS A 80 1.811 21.300 -10.734 1.00 0.00 H new ATOM 0 HD3 LYS A 80 0.183 20.710 -11.006 1.00 0.00 H new ATOM 0 HE2 LYS A 80 0.680 19.191 -8.894 1.00 0.00 H new ATOM 0 HE3 LYS A 80 1.938 20.369 -8.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.375 21.617 -7.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -0.306 21.857 -9.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -0.869 20.598 -8.193 1.00 0.00 H new ATOM 1335 N LEU A 81 -1.541 20.259 -12.648 1.00 0.00 N ATOM 1336 CA LEU A 81 -2.502 21.345 -12.804 1.00 0.00 C ATOM 1337 C LEU A 81 -1.804 22.632 -13.231 1.00 0.00 C ATOM 1338 O LEU A 81 -2.288 23.351 -14.104 1.00 0.00 O ATOM 1339 CB LEU A 81 -3.261 21.572 -11.495 1.00 0.00 C ATOM 1340 CG LEU A 81 -4.194 20.444 -11.056 1.00 0.00 C ATOM 1341 CD1 LEU A 81 -4.966 20.845 -9.808 1.00 0.00 C ATOM 1342 CD2 LEU A 81 -5.150 20.074 -12.180 1.00 0.00 C ATOM 0 H LEU A 81 -1.590 19.779 -11.749 1.00 0.00 H new ATOM 0 HA LEU A 81 -3.210 21.062 -13.583 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.534 21.744 -10.702 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.848 22.485 -11.593 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.588 19.569 -10.819 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.625 20.030 -9.510 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.266 21.059 -9.000 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.561 21.734 -10.018 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.807 19.269 -11.849 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.749 20.944 -12.449 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.580 19.743 -13.048 1.00 0.00 H new ATOM 1354 N ASN A 82 -0.663 22.915 -12.610 1.00 0.00 N ATOM 1355 CA ASN A 82 0.102 24.115 -12.927 1.00 0.00 C ATOM 1356 C ASN A 82 1.505 23.755 -13.407 1.00 0.00 C ATOM 1357 O ASN A 82 2.138 22.840 -12.879 1.00 0.00 O ATOM 1358 CB ASN A 82 0.189 25.028 -11.703 1.00 0.00 C ATOM 1359 CG ASN A 82 -1.085 25.014 -10.880 1.00 0.00 C ATOM 1360 OD1 ASN A 82 -1.213 24.023 -10.004 1.00 0.00 O flip ATOM 1361 ND2 ASN A 82 -1.943 25.884 -11.029 1.00 0.00 N flip ATOM 0 H ASN A 82 -0.248 22.330 -11.885 1.00 0.00 H new ATOM 0 HA ASN A 82 -0.414 24.642 -13.730 1.00 0.00 H new ATOM 0 HB2 ASN A 82 1.025 24.715 -11.078 1.00 0.00 H new ATOM 0 HB3 ASN A 82 0.398 26.047 -12.028 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -1.803 26.627 -11.714 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -2.794 25.862 -10.468 1.00 0.00 H new ATOM 1368 N LYS A 83 1.985 24.480 -14.411 1.00 0.00 N ATOM 1369 CA LYS A 83 3.313 24.239 -14.963 1.00 0.00 C ATOM 1370 C LYS A 83 4.392 24.824 -14.057 1.00 0.00 C ATOM 1371 O LYS A 83 4.113 25.673 -13.211 1.00 0.00 O ATOM 1372 CB LYS A 83 3.424 24.846 -16.363 1.00 0.00 C ATOM 1373 CG LYS A 83 4.536 24.240 -17.202 1.00 0.00 C ATOM 1374 CD LYS A 83 4.256 24.387 -18.688 1.00 0.00 C ATOM 1375 CE LYS A 83 5.007 23.344 -19.503 1.00 0.00 C ATOM 1376 NZ LYS A 83 5.309 23.827 -20.878 1.00 0.00 N ATOM 0 H LYS A 83 1.474 25.240 -14.860 1.00 0.00 H new ATOM 0 HA LYS A 83 3.462 23.161 -15.028 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.475 24.715 -16.883 1.00 0.00 H new ATOM 0 HB3 LYS A 83 3.592 25.919 -16.272 1.00 0.00 H new ATOM 0 HG2 LYS A 83 5.482 24.725 -16.959 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.646 23.184 -16.954 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.186 24.290 -18.869 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.546 25.385 -19.017 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.937 23.087 -18.996 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.413 22.432 -19.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.821 23.088 -21.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.420 24.048 -21.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.897 24.683 -20.824 1.00 0.00 H new ATOM 1390 N ASN A 84 5.626 24.365 -14.241 1.00 0.00 N ATOM 1391 CA ASN A 84 6.747 24.844 -13.440 1.00 0.00 C ATOM 1392 C ASN A 84 6.535 24.527 -11.963 1.00 0.00 C ATOM 1393 O ASN A 84 7.181 25.112 -11.094 1.00 0.00 O ATOM 1394 CB ASN A 84 6.928 26.351 -13.629 1.00 0.00 C ATOM 1395 CG ASN A 84 7.935 26.681 -14.715 1.00 0.00 C ATOM 1396 OD1 ASN A 84 7.812 26.016 -15.857 1.00 0.00 O flip ATOM 1397 ND2 ASN A 84 8.812 27.524 -14.528 1.00 0.00 N flip ATOM 0 H ASN A 84 5.875 23.662 -14.937 1.00 0.00 H new ATOM 0 HA ASN A 84 7.648 24.331 -13.777 1.00 0.00 H new ATOM 0 HB2 ASN A 84 5.967 26.801 -13.879 1.00 0.00 H new ATOM 0 HB3 ASN A 84 7.253 26.796 -12.689 1.00 0.00 H new ATOM 0 HD21 ASN A 84 8.869 28.011 -13.634 1.00 0.00 H new ATOM 0 HD22 ASN A 84 9.482 27.736 -15.267 1.00 0.00 H new ATOM 1404 N GLU A 85 5.627 23.597 -11.687 1.00 0.00 N ATOM 1405 CA GLU A 85 5.330 23.203 -10.315 1.00 0.00 C ATOM 1406 C GLU A 85 6.231 22.053 -9.872 1.00 0.00 C ATOM 1407 O GLU A 85 6.170 20.955 -10.425 1.00 0.00 O ATOM 1408 CB GLU A 85 3.862 22.794 -10.184 1.00 0.00 C ATOM 1409 CG GLU A 85 3.312 22.939 -8.775 1.00 0.00 C ATOM 1410 CD GLU A 85 2.997 24.378 -8.417 1.00 0.00 C ATOM 1411 OE1 GLU A 85 3.927 25.211 -8.438 1.00 0.00 O ATOM 1412 OE2 GLU A 85 1.821 24.671 -8.116 1.00 0.00 O ATOM 0 H GLU A 85 5.084 23.102 -12.395 1.00 0.00 H new ATOM 0 HA GLU A 85 5.520 24.060 -9.669 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.263 23.401 -10.863 1.00 0.00 H new ATOM 0 HB3 GLU A 85 3.753 21.757 -10.502 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.408 22.338 -8.678 1.00 0.00 H new ATOM 0 HG3 GLU A 85 4.036 22.542 -8.064 1.00 0.00 H new ATOM 1419 N TYR A 86 7.066 22.315 -8.873 1.00 0.00 N ATOM 1420 CA TYR A 86 7.981 21.304 -8.357 1.00 0.00 C ATOM 1421 C TYR A 86 7.375 20.580 -7.159 1.00 0.00 C ATOM 1422 O TYR A 86 6.303 20.945 -6.675 1.00 0.00 O ATOM 1423 CB TYR A 86 9.311 21.946 -7.959 1.00 0.00 C ATOM 1424 CG TYR A 86 9.298 22.560 -6.577 1.00 0.00 C ATOM 1425 CD1 TYR A 86 8.875 23.868 -6.381 1.00 0.00 C ATOM 1426 CD2 TYR A 86 9.708 21.830 -5.468 1.00 0.00 C ATOM 1427 CE1 TYR A 86 8.862 24.433 -5.120 1.00 0.00 C ATOM 1428 CE2 TYR A 86 9.697 22.386 -4.204 1.00 0.00 C ATOM 1429 CZ TYR A 86 9.274 23.688 -4.035 1.00 0.00 C ATOM 1430 OH TYR A 86 9.262 24.246 -2.777 1.00 0.00 O ATOM 0 H TYR A 86 7.128 23.219 -8.404 1.00 0.00 H new ATOM 0 HA TYR A 86 8.158 20.575 -9.147 1.00 0.00 H new ATOM 0 HB2 TYR A 86 10.097 21.192 -8.005 1.00 0.00 H new ATOM 0 HB3 TYR A 86 9.565 22.716 -8.687 1.00 0.00 H new ATOM 0 HD1 TYR A 86 8.551 24.454 -7.228 1.00 0.00 H new ATOM 0 HD2 TYR A 86 10.041 20.811 -5.597 1.00 0.00 H new ATOM 0 HE1 TYR A 86 8.531 25.452 -4.985 1.00 0.00 H new ATOM 0 HE2 TYR A 86 10.018 21.805 -3.352 1.00 0.00 H new ATOM 0 HH TYR A 86 9.581 23.588 -2.124 1.00 0.00 H new ATOM 1440 N PHE A 87 8.069 19.551 -6.685 1.00 0.00 N ATOM 1441 CA PHE A 87 7.600 18.774 -5.543 1.00 0.00 C ATOM 1442 C PHE A 87 8.730 18.537 -4.545 1.00 0.00 C ATOM 1443 O PHE A 87 9.907 18.641 -4.890 1.00 0.00 O ATOM 1444 CB PHE A 87 7.029 17.434 -6.011 1.00 0.00 C ATOM 1445 CG PHE A 87 5.789 17.570 -6.848 1.00 0.00 C ATOM 1446 CD1 PHE A 87 5.861 18.063 -8.141 1.00 0.00 C ATOM 1447 CD2 PHE A 87 4.552 17.205 -6.342 1.00 0.00 C ATOM 1448 CE1 PHE A 87 4.722 18.190 -8.914 1.00 0.00 C ATOM 1449 CE2 PHE A 87 3.410 17.329 -7.110 1.00 0.00 C ATOM 1450 CZ PHE A 87 3.495 17.823 -8.397 1.00 0.00 C ATOM 0 H PHE A 87 8.958 19.236 -7.074 1.00 0.00 H new ATOM 0 HA PHE A 87 6.814 19.343 -5.047 1.00 0.00 H new ATOM 0 HB2 PHE A 87 7.789 16.905 -6.586 1.00 0.00 H new ATOM 0 HB3 PHE A 87 6.804 16.820 -5.139 1.00 0.00 H new ATOM 0 HD1 PHE A 87 6.818 18.351 -8.550 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.479 16.819 -5.336 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.792 18.576 -9.920 1.00 0.00 H new ATOM 0 HE2 PHE A 87 2.452 17.040 -6.704 1.00 0.00 H new ATOM 0 HZ PHE A 87 2.603 17.922 -8.998 1.00 0.00 H new ATOM 1460 N GLU A 88 8.363 18.220 -3.308 1.00 0.00 N ATOM 1461 CA GLU A 88 9.345 17.970 -2.260 1.00 0.00 C ATOM 1462 C GLU A 88 9.224 16.545 -1.729 1.00 0.00 C ATOM 1463 O GLU A 88 10.226 15.861 -1.520 1.00 0.00 O ATOM 1464 CB GLU A 88 9.168 18.970 -1.115 1.00 0.00 C ATOM 1465 CG GLU A 88 10.438 19.211 -0.316 1.00 0.00 C ATOM 1466 CD GLU A 88 10.246 20.230 0.791 1.00 0.00 C ATOM 1467 OE1 GLU A 88 9.626 19.882 1.817 1.00 0.00 O ATOM 1468 OE2 GLU A 88 10.716 21.376 0.629 1.00 0.00 O ATOM 0 H GLU A 88 7.393 18.130 -3.007 1.00 0.00 H new ATOM 0 HA GLU A 88 10.338 18.095 -2.691 1.00 0.00 H new ATOM 0 HB2 GLU A 88 8.820 19.919 -1.523 1.00 0.00 H new ATOM 0 HB3 GLU A 88 8.390 18.607 -0.444 1.00 0.00 H new ATOM 0 HG2 GLU A 88 10.775 18.269 0.117 1.00 0.00 H new ATOM 0 HG3 GLU A 88 11.226 19.553 -0.987 1.00 0.00 H new ATOM 1475 N ASP A 89 7.990 16.104 -1.512 1.00 0.00 N ATOM 1476 CA ASP A 89 7.736 14.760 -1.006 1.00 0.00 C ATOM 1477 C ASP A 89 8.244 13.706 -1.984 1.00 0.00 C ATOM 1478 O ASP A 89 8.415 12.540 -1.624 1.00 0.00 O ATOM 1479 CB ASP A 89 6.240 14.561 -0.754 1.00 0.00 C ATOM 1480 CG ASP A 89 5.696 15.519 0.288 1.00 0.00 C ATOM 1481 OD1 ASP A 89 6.459 16.396 0.744 1.00 0.00 O ATOM 1482 OD2 ASP A 89 4.507 15.391 0.647 1.00 0.00 O ATOM 0 H ASP A 89 7.150 16.658 -1.679 1.00 0.00 H new ATOM 0 HA ASP A 89 8.274 14.645 -0.065 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.696 14.698 -1.688 1.00 0.00 H new ATOM 0 HB3 ASP A 89 6.062 13.536 -0.429 1.00 0.00 H new ATOM 1487 N LEU A 90 8.483 14.122 -3.223 1.00 0.00 N ATOM 1488 CA LEU A 90 8.971 13.213 -4.255 1.00 0.00 C ATOM 1489 C LEU A 90 10.360 12.689 -3.906 1.00 0.00 C ATOM 1490 O LEU A 90 10.836 11.720 -4.497 1.00 0.00 O ATOM 1491 CB LEU A 90 9.006 13.920 -5.610 1.00 0.00 C ATOM 1492 CG LEU A 90 7.762 13.756 -6.485 1.00 0.00 C ATOM 1493 CD1 LEU A 90 6.532 14.295 -5.771 1.00 0.00 C ATOM 1494 CD2 LEU A 90 7.954 14.457 -7.822 1.00 0.00 C ATOM 0 H LEU A 90 8.347 15.083 -3.538 1.00 0.00 H new ATOM 0 HA LEU A 90 8.287 12.366 -4.312 1.00 0.00 H new ATOM 0 HB2 LEU A 90 9.167 14.984 -5.438 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.868 13.553 -6.167 1.00 0.00 H new ATOM 0 HG LEU A 90 7.611 12.693 -6.673 1.00 0.00 H new ATOM 0 HD11 LEU A 90 5.657 14.170 -6.409 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.383 13.749 -4.840 1.00 0.00 H new ATOM 0 HD13 LEU A 90 6.673 15.353 -5.552 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.059 14.330 -8.431 1.00 0.00 H new ATOM 0 HD22 LEU A 90 8.130 15.519 -7.654 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.810 14.025 -8.340 1.00 0.00 H new ATOM 1506 N ASP A 91 11.005 13.335 -2.941 1.00 0.00 N ATOM 1507 CA ASP A 91 12.339 12.933 -2.510 1.00 0.00 C ATOM 1508 C ASP A 91 12.266 12.049 -1.269 1.00 0.00 C ATOM 1509 O ASP A 91 13.286 11.748 -0.647 1.00 0.00 O ATOM 1510 CB ASP A 91 13.199 14.165 -2.224 1.00 0.00 C ATOM 1511 CG ASP A 91 13.794 14.761 -3.485 1.00 0.00 C ATOM 1512 OD1 ASP A 91 14.306 13.988 -4.323 1.00 0.00 O ATOM 1513 OD2 ASP A 91 13.748 15.999 -3.634 1.00 0.00 O ATOM 0 H ASP A 91 10.626 14.140 -2.442 1.00 0.00 H new ATOM 0 HA ASP A 91 12.797 12.359 -3.316 1.00 0.00 H new ATOM 0 HB2 ASP A 91 12.593 14.918 -1.720 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.003 13.893 -1.540 1.00 0.00 H new ATOM 1518 N LEU A 92 11.054 11.637 -0.913 1.00 0.00 N ATOM 1519 CA LEU A 92 10.847 10.788 0.255 1.00 0.00 C ATOM 1520 C LEU A 92 9.849 9.676 -0.050 1.00 0.00 C ATOM 1521 O LEU A 92 8.637 9.890 -0.091 1.00 0.00 O ATOM 1522 CB LEU A 92 10.351 11.624 1.436 1.00 0.00 C ATOM 1523 CG LEU A 92 10.952 13.024 1.567 1.00 0.00 C ATOM 1524 CD1 LEU A 92 10.108 13.883 2.496 1.00 0.00 C ATOM 1525 CD2 LEU A 92 12.386 12.944 2.069 1.00 0.00 C ATOM 0 H LEU A 92 10.200 11.877 -1.416 1.00 0.00 H new ATOM 0 HA LEU A 92 11.802 10.332 0.516 1.00 0.00 H new ATOM 0 HB2 LEU A 92 9.268 11.721 1.357 1.00 0.00 H new ATOM 0 HB3 LEU A 92 10.556 11.075 2.355 1.00 0.00 H new ATOM 0 HG LEU A 92 10.958 13.489 0.581 1.00 0.00 H new ATOM 0 HD11 LEU A 92 10.551 14.875 2.577 1.00 0.00 H new ATOM 0 HD12 LEU A 92 9.098 13.968 2.095 1.00 0.00 H new ATOM 0 HD13 LEU A 92 10.069 13.422 3.483 1.00 0.00 H new ATOM 0 HD21 LEU A 92 12.798 13.950 2.156 1.00 0.00 H new ATOM 0 HD22 LEU A 92 12.403 12.459 3.045 1.00 0.00 H new ATOM 0 HD23 LEU A 92 12.986 12.366 1.366 1.00 0.00 H new ATOM 1537 N PRO A 93 10.368 8.458 -0.267 1.00 0.00 N ATOM 1538 CA PRO A 93 9.539 7.287 -0.569 1.00 0.00 C ATOM 1539 C PRO A 93 8.719 6.832 0.633 1.00 0.00 C ATOM 1540 O PRO A 93 7.870 5.946 0.520 1.00 0.00 O ATOM 1541 CB PRO A 93 10.564 6.217 -0.954 1.00 0.00 C ATOM 1542 CG PRO A 93 11.817 6.627 -0.261 1.00 0.00 C ATOM 1543 CD PRO A 93 11.803 8.130 -0.233 1.00 0.00 C ATOM 0 HA PRO A 93 8.807 7.496 -1.349 1.00 0.00 H new ATOM 0 HB2 PRO A 93 10.241 5.226 -0.635 1.00 0.00 H new ATOM 0 HB3 PRO A 93 10.705 6.174 -2.034 1.00 0.00 H new ATOM 0 HG2 PRO A 93 11.856 6.218 0.749 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.695 6.255 -0.789 1.00 0.00 H new ATOM 0 HD2 PRO A 93 12.283 8.520 0.665 1.00 0.00 H new ATOM 0 HD3 PRO A 93 12.332 8.553 -1.087 1.00 0.00 H new ATOM 1551 N THR A 94 8.977 7.442 1.786 1.00 0.00 N ATOM 1552 CA THR A 94 8.264 7.099 3.009 1.00 0.00 C ATOM 1553 C THR A 94 7.082 8.034 3.238 1.00 0.00 C ATOM 1554 O THR A 94 6.124 7.684 3.928 1.00 0.00 O ATOM 1555 CB THR A 94 9.193 7.156 4.237 1.00 0.00 C ATOM 1556 OG1 THR A 94 9.534 8.515 4.531 1.00 0.00 O ATOM 1557 CG2 THR A 94 10.461 6.351 3.993 1.00 0.00 C ATOM 0 H THR A 94 9.676 8.177 1.898 1.00 0.00 H new ATOM 0 HA THR A 94 7.899 6.079 2.885 1.00 0.00 H new ATOM 0 HB THR A 94 8.664 6.723 5.086 1.00 0.00 H new ATOM 0 HG1 THR A 94 10.123 8.542 5.314 1.00 0.00 H new ATOM 0 HG21 THR A 94 11.102 6.406 4.873 1.00 0.00 H new ATOM 0 HG22 THR A 94 10.200 5.311 3.798 1.00 0.00 H new ATOM 0 HG23 THR A 94 10.991 6.759 3.132 1.00 0.00 H new ATOM 1565 N LYS A 95 7.154 9.224 2.652 1.00 0.00 N ATOM 1566 CA LYS A 95 6.088 10.210 2.790 1.00 0.00 C ATOM 1567 C LYS A 95 4.939 9.906 1.834 1.00 0.00 C ATOM 1568 O LYS A 95 3.788 10.254 2.100 1.00 0.00 O ATOM 1569 CB LYS A 95 6.630 11.617 2.522 1.00 0.00 C ATOM 1570 CG LYS A 95 7.455 12.179 3.667 1.00 0.00 C ATOM 1571 CD LYS A 95 6.640 12.276 4.946 1.00 0.00 C ATOM 1572 CE LYS A 95 7.393 13.031 6.031 1.00 0.00 C ATOM 1573 NZ LYS A 95 6.839 12.756 7.385 1.00 0.00 N ATOM 0 H LYS A 95 7.939 9.529 2.077 1.00 0.00 H new ATOM 0 HA LYS A 95 5.710 10.160 3.811 1.00 0.00 H new ATOM 0 HB2 LYS A 95 7.242 11.596 1.620 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.794 12.288 2.324 1.00 0.00 H new ATOM 0 HG2 LYS A 95 8.325 11.544 3.836 1.00 0.00 H new ATOM 0 HG3 LYS A 95 7.829 13.167 3.397 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.696 12.779 4.740 1.00 0.00 H new ATOM 0 HD3 LYS A 95 6.396 11.274 5.300 1.00 0.00 H new ATOM 0 HE2 LYS A 95 8.446 12.749 6.005 1.00 0.00 H new ATOM 0 HE3 LYS A 95 7.344 14.101 5.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 6.779 13.644 7.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 5.889 12.342 7.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.461 12.090 7.886 1.00 0.00 H new ATOM 1587 N LEU A 96 5.258 9.255 0.721 1.00 0.00 N ATOM 1588 CA LEU A 96 4.252 8.902 -0.274 1.00 0.00 C ATOM 1589 C LEU A 96 3.500 7.639 0.135 1.00 0.00 C ATOM 1590 O LEU A 96 2.278 7.560 0.000 1.00 0.00 O ATOM 1591 CB LEU A 96 4.907 8.699 -1.641 1.00 0.00 C ATOM 1592 CG LEU A 96 5.989 9.709 -2.024 1.00 0.00 C ATOM 1593 CD1 LEU A 96 6.906 9.131 -3.090 1.00 0.00 C ATOM 1594 CD2 LEU A 96 5.360 11.008 -2.506 1.00 0.00 C ATOM 0 H LEU A 96 6.206 8.961 0.485 1.00 0.00 H new ATOM 0 HA LEU A 96 3.538 9.723 -0.339 1.00 0.00 H new ATOM 0 HB2 LEU A 96 5.344 7.701 -1.667 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.128 8.726 -2.402 1.00 0.00 H new ATOM 0 HG LEU A 96 6.587 9.925 -1.138 1.00 0.00 H new ATOM 0 HD11 LEU A 96 7.670 9.864 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.384 8.229 -2.708 1.00 0.00 H new ATOM 0 HD13 LEU A 96 6.323 8.885 -3.977 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.145 11.715 -2.774 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.737 10.809 -3.378 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.746 11.432 -1.711 1.00 0.00 H new ATOM 1606 N LEU A 97 4.238 6.655 0.637 1.00 0.00 N ATOM 1607 CA LEU A 97 3.641 5.396 1.069 1.00 0.00 C ATOM 1608 C LEU A 97 2.717 5.612 2.262 1.00 0.00 C ATOM 1609 O LEU A 97 1.560 5.192 2.249 1.00 0.00 O ATOM 1610 CB LEU A 97 4.734 4.389 1.431 1.00 0.00 C ATOM 1611 CG LEU A 97 5.659 3.963 0.291 1.00 0.00 C ATOM 1612 CD1 LEU A 97 6.874 3.228 0.835 1.00 0.00 C ATOM 1613 CD2 LEU A 97 4.910 3.091 -0.707 1.00 0.00 C ATOM 0 H LEU A 97 5.250 6.705 0.755 1.00 0.00 H new ATOM 0 HA LEU A 97 3.050 5.000 0.243 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.344 4.816 2.227 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.258 3.497 1.838 1.00 0.00 H new ATOM 0 HG LEU A 97 6.003 4.859 -0.225 1.00 0.00 H new ATOM 0 HD11 LEU A 97 7.521 2.933 0.009 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.424 3.884 1.510 1.00 0.00 H new ATOM 0 HD13 LEU A 97 6.549 2.340 1.377 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.584 2.797 -1.511 1.00 0.00 H new ATOM 0 HD22 LEU A 97 4.537 2.200 -0.203 1.00 0.00 H new ATOM 0 HD23 LEU A 97 4.072 3.651 -1.122 1.00 0.00 H new ATOM 1625 N ALA A 98 3.235 6.272 3.293 1.00 0.00 N ATOM 1626 CA ALA A 98 2.455 6.548 4.493 1.00 0.00 C ATOM 1627 C ALA A 98 1.653 7.836 4.343 1.00 0.00 C ATOM 1628 O ALA A 98 2.217 8.931 4.331 1.00 0.00 O ATOM 1629 CB ALA A 98 3.367 6.630 5.708 1.00 0.00 C ATOM 0 H ALA A 98 4.191 6.625 3.321 1.00 0.00 H new ATOM 0 HA ALA A 98 1.751 5.728 4.635 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.771 6.837 6.597 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.891 5.682 5.834 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.093 7.430 5.564 1.00 0.00 H new ATOM 1635 N ARG A 99 0.337 7.699 4.229 1.00 0.00 N ATOM 1636 CA ARG A 99 -0.542 8.853 4.077 1.00 0.00 C ATOM 1637 C ARG A 99 -1.364 9.080 5.342 1.00 0.00 C ATOM 1638 O ARG A 99 -2.243 9.941 5.375 1.00 0.00 O ATOM 1639 CB ARG A 99 -1.473 8.658 2.879 1.00 0.00 C ATOM 1640 CG ARG A 99 -2.138 7.291 2.840 1.00 0.00 C ATOM 1641 CD ARG A 99 -1.306 6.289 2.055 1.00 0.00 C ATOM 1642 NE ARG A 99 -1.453 4.931 2.573 1.00 0.00 N ATOM 1643 CZ ARG A 99 -1.067 3.846 1.911 1.00 0.00 C ATOM 1644 NH1 ARG A 99 -0.514 3.960 0.711 1.00 0.00 N ATOM 1645 NH2 ARG A 99 -1.234 2.645 2.449 1.00 0.00 N ATOM 0 H ARG A 99 -0.145 6.800 4.239 1.00 0.00 H new ATOM 0 HA ARG A 99 0.080 9.732 3.906 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -2.245 9.428 2.900 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -0.904 8.802 1.960 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -2.284 6.927 3.857 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -3.126 7.379 2.388 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -1.605 6.312 1.007 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -0.256 6.580 2.094 1.00 0.00 H new ATOM 0 HE ARG A 99 -1.875 4.809 3.494 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -0.384 4.882 0.295 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -0.218 3.126 0.204 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -1.659 2.554 3.372 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -0.937 1.812 1.940 1.00 0.00 H new ATOM 1659 N GLN A 100 -1.072 8.302 6.379 1.00 0.00 N ATOM 1660 CA GLN A 100 -1.786 8.418 7.645 1.00 0.00 C ATOM 1661 C GLN A 100 -0.828 8.282 8.824 1.00 0.00 C ATOM 1662 O GLN A 100 -0.057 7.327 8.904 1.00 0.00 O ATOM 1663 CB GLN A 100 -2.881 7.354 7.737 1.00 0.00 C ATOM 1664 CG GLN A 100 -3.964 7.682 8.752 1.00 0.00 C ATOM 1665 CD GLN A 100 -5.026 8.608 8.192 1.00 0.00 C ATOM 1666 OE1 GLN A 100 -5.057 9.798 8.506 1.00 0.00 O ATOM 1667 NE2 GLN A 100 -5.905 8.065 7.357 1.00 0.00 N ATOM 0 H GLN A 100 -0.347 7.585 6.368 1.00 0.00 H new ATOM 0 HA GLN A 100 -2.245 9.406 7.685 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -3.340 7.231 6.756 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -2.427 6.398 7.999 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -4.434 6.758 9.088 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -3.508 8.145 9.627 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -5.842 7.074 7.124 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -6.643 8.639 6.949 1.00 0.00 H new ATOM 1676 N GLY A 101 -0.882 9.246 9.739 1.00 0.00 N ATOM 1677 CA GLY A 101 -0.014 9.216 10.901 1.00 0.00 C ATOM 1678 C GLY A 101 0.988 10.353 10.906 1.00 0.00 C ATOM 1679 O GLY A 101 1.848 10.435 10.028 1.00 0.00 O ATOM 0 H GLY A 101 -1.512 10.047 9.696 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -0.621 9.267 11.805 1.00 0.00 H new ATOM 0 HA3 GLY A 101 0.519 8.266 10.928 1.00 0.00 H new ATOM 1683 N ASP A 102 0.878 11.232 11.895 1.00 0.00 N ATOM 1684 CA ASP A 102 1.782 12.371 12.010 1.00 0.00 C ATOM 1685 C ASP A 102 3.125 11.942 12.594 1.00 0.00 C ATOM 1686 O ASP A 102 3.236 11.671 13.790 1.00 0.00 O ATOM 1687 CB ASP A 102 1.157 13.459 12.884 1.00 0.00 C ATOM 1688 CG ASP A 102 1.767 14.824 12.633 1.00 0.00 C ATOM 1689 OD1 ASP A 102 1.526 15.392 11.547 1.00 0.00 O ATOM 1690 OD2 ASP A 102 2.485 15.325 13.524 1.00 0.00 O ATOM 0 H ASP A 102 0.172 11.178 12.629 1.00 0.00 H new ATOM 0 HA ASP A 102 1.951 12.771 11.010 1.00 0.00 H new ATOM 0 HB2 ASP A 102 0.085 13.503 12.693 1.00 0.00 H new ATOM 0 HB3 ASP A 102 1.284 13.195 13.934 1.00 0.00 H new ATOM 1695 N LEU A 103 4.142 11.882 11.742 1.00 0.00 N ATOM 1696 CA LEU A 103 5.478 11.485 12.172 1.00 0.00 C ATOM 1697 C LEU A 103 6.412 12.690 12.230 1.00 0.00 C ATOM 1698 O LEU A 103 7.374 12.706 12.997 1.00 0.00 O ATOM 1699 CB LEU A 103 6.048 10.428 11.224 1.00 0.00 C ATOM 1700 CG LEU A 103 7.263 9.653 11.736 1.00 0.00 C ATOM 1701 CD1 LEU A 103 6.845 8.641 12.791 1.00 0.00 C ATOM 1702 CD2 LEU A 103 7.977 8.961 10.584 1.00 0.00 C ATOM 0 H LEU A 103 4.067 12.103 10.749 1.00 0.00 H new ATOM 0 HA LEU A 103 5.399 11.061 13.173 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.258 9.714 10.991 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.321 10.917 10.289 1.00 0.00 H new ATOM 0 HG LEU A 103 7.954 10.360 12.194 1.00 0.00 H new ATOM 0 HD11 LEU A 103 7.723 8.099 13.143 1.00 0.00 H new ATOM 0 HD12 LEU A 103 6.378 9.160 13.628 1.00 0.00 H new ATOM 0 HD13 LEU A 103 6.134 7.937 12.359 1.00 0.00 H new ATOM 0 HD21 LEU A 103 8.839 8.414 10.966 1.00 0.00 H new ATOM 0 HD22 LEU A 103 7.293 8.266 10.097 1.00 0.00 H new ATOM 0 HD23 LEU A 103 8.311 9.707 9.862 1.00 0.00 H new ATOM 1714 N ALA A 104 6.120 13.698 11.414 1.00 0.00 N ATOM 1715 CA ALA A 104 6.931 14.908 11.375 1.00 0.00 C ATOM 1716 C ALA A 104 8.358 14.599 10.935 1.00 0.00 C ATOM 1717 O ALA A 104 9.312 15.212 11.414 1.00 0.00 O ATOM 1718 CB ALA A 104 6.932 15.587 12.737 1.00 0.00 C ATOM 0 H ALA A 104 5.328 13.700 10.771 1.00 0.00 H new ATOM 0 HA ALA A 104 6.492 15.586 10.643 1.00 0.00 H new ATOM 0 HB1 ALA A 104 7.542 16.489 12.693 1.00 0.00 H new ATOM 0 HB2 ALA A 104 5.911 15.852 13.012 1.00 0.00 H new ATOM 0 HB3 ALA A 104 7.344 14.907 13.482 1.00 0.00 H new ATOM 1724 N GLY A 105 8.497 13.644 10.020 1.00 0.00 N ATOM 1725 CA GLY A 105 9.812 13.270 9.532 1.00 0.00 C ATOM 1726 C GLY A 105 10.019 13.646 8.078 1.00 0.00 C ATOM 1727 O GLY A 105 10.486 12.834 7.281 1.00 0.00 O ATOM 0 H GLY A 105 7.723 13.123 9.608 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.574 13.755 10.142 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.947 12.195 9.649 1.00 0.00 H new ATOM 1731 N ALA A 106 9.669 14.881 7.732 1.00 0.00 N ATOM 1732 CA ALA A 106 9.819 15.362 6.365 1.00 0.00 C ATOM 1733 C ALA A 106 11.202 15.966 6.144 1.00 0.00 C ATOM 1734 O ALA A 106 11.477 17.085 6.578 1.00 0.00 O ATOM 1735 CB ALA A 106 8.738 16.383 6.043 1.00 0.00 C ATOM 0 H ALA A 106 9.280 15.566 8.380 1.00 0.00 H new ATOM 0 HA ALA A 106 9.711 14.511 5.693 1.00 0.00 H new ATOM 0 HB1 ALA A 106 8.862 16.734 5.019 1.00 0.00 H new ATOM 0 HB2 ALA A 106 7.757 15.921 6.152 1.00 0.00 H new ATOM 0 HB3 ALA A 106 8.819 17.227 6.728 1.00 0.00 H new ATOM 1741 N ASP A 107 12.068 15.219 5.469 1.00 0.00 N ATOM 1742 CA ASP A 107 13.423 15.681 5.191 1.00 0.00 C ATOM 1743 C ASP A 107 13.544 16.175 3.753 1.00 0.00 C ATOM 1744 O ASP A 107 12.782 15.763 2.878 1.00 0.00 O ATOM 1745 CB ASP A 107 14.430 14.558 5.444 1.00 0.00 C ATOM 1746 CG ASP A 107 14.426 14.091 6.886 1.00 0.00 C ATOM 1747 OD1 ASP A 107 14.446 14.954 7.789 1.00 0.00 O ATOM 1748 OD2 ASP A 107 14.403 12.863 7.112 1.00 0.00 O ATOM 0 H ASP A 107 11.856 14.290 5.104 1.00 0.00 H new ATOM 0 HA ASP A 107 13.642 16.512 5.862 1.00 0.00 H new ATOM 0 HB2 ASP A 107 14.201 13.715 4.792 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.429 14.904 5.180 1.00 0.00 H new ATOM 1753 N ALA A 108 14.505 17.062 3.516 1.00 0.00 N ATOM 1754 CA ALA A 108 14.726 17.612 2.184 1.00 0.00 C ATOM 1755 C ALA A 108 16.123 18.211 2.063 1.00 0.00 C ATOM 1756 O ALA A 108 16.707 18.657 3.052 1.00 0.00 O ATOM 1757 CB ALA A 108 13.670 18.660 1.864 1.00 0.00 C ATOM 0 H ALA A 108 15.143 17.415 4.229 1.00 0.00 H new ATOM 0 HA ALA A 108 14.644 16.798 1.463 1.00 0.00 H new ATOM 0 HB1 ALA A 108 13.847 19.062 0.867 1.00 0.00 H new ATOM 0 HB2 ALA A 108 12.681 18.203 1.901 1.00 0.00 H new ATOM 0 HB3 ALA A 108 13.724 19.466 2.595 1.00 0.00 H new ATOM 1763 N LEU A 109 16.655 18.218 0.845 1.00 0.00 N ATOM 1764 CA LEU A 109 17.985 18.762 0.595 1.00 0.00 C ATOM 1765 C LEU A 109 18.013 19.550 -0.711 1.00 0.00 C ATOM 1766 O LEU A 109 17.532 19.081 -1.743 1.00 0.00 O ATOM 1767 CB LEU A 109 19.018 17.635 0.546 1.00 0.00 C ATOM 1768 CG LEU A 109 19.084 16.732 1.778 1.00 0.00 C ATOM 1769 CD1 LEU A 109 19.522 15.329 1.388 1.00 0.00 C ATOM 1770 CD2 LEU A 109 20.028 17.317 2.819 1.00 0.00 C ATOM 0 H LEU A 109 16.186 17.853 0.016 1.00 0.00 H new ATOM 0 HA LEU A 109 18.234 19.439 1.412 1.00 0.00 H new ATOM 0 HB2 LEU A 109 18.807 17.014 -0.324 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.002 18.077 0.391 1.00 0.00 H new ATOM 0 HG LEU A 109 18.087 16.672 2.214 1.00 0.00 H new ATOM 0 HD11 LEU A 109 19.563 14.700 2.277 1.00 0.00 H new ATOM 0 HD12 LEU A 109 18.808 14.909 0.679 1.00 0.00 H new ATOM 0 HD13 LEU A 109 20.509 15.371 0.927 1.00 0.00 H new ATOM 0 HD21 LEU A 109 20.062 16.661 3.689 1.00 0.00 H new ATOM 0 HD22 LEU A 109 21.027 17.408 2.394 1.00 0.00 H new ATOM 0 HD23 LEU A 109 19.671 18.302 3.121 1.00 0.00 H new ATOM 1782 N THR A 110 18.583 20.750 -0.660 1.00 0.00 N ATOM 1783 CA THR A 110 18.676 21.603 -1.838 1.00 0.00 C ATOM 1784 C THR A 110 19.813 22.608 -1.701 1.00 0.00 C ATOM 1785 O THR A 110 19.744 23.530 -0.889 1.00 0.00 O ATOM 1786 CB THR A 110 17.360 22.365 -2.085 1.00 0.00 C ATOM 1787 OG1 THR A 110 17.556 23.370 -3.086 1.00 0.00 O ATOM 1788 CG2 THR A 110 16.859 23.010 -0.802 1.00 0.00 C ATOM 0 H THR A 110 18.987 21.153 0.185 1.00 0.00 H new ATOM 0 HA THR A 110 18.874 20.948 -2.687 1.00 0.00 H new ATOM 0 HB THR A 110 16.612 21.651 -2.430 1.00 0.00 H new ATOM 0 HG1 THR A 110 16.714 23.849 -3.238 1.00 0.00 H new ATOM 0 HG21 THR A 110 15.929 23.542 -1.001 1.00 0.00 H new ATOM 0 HG22 THR A 110 16.682 22.239 -0.052 1.00 0.00 H new ATOM 0 HG23 THR A 110 17.606 23.712 -0.432 1.00 0.00 H new ATOM 1796 N GLU A 111 20.859 22.424 -2.501 1.00 0.00 N ATOM 1797 CA GLU A 111 22.012 23.317 -2.467 1.00 0.00 C ATOM 1798 C GLU A 111 22.455 23.687 -3.880 1.00 0.00 C ATOM 1799 O GLU A 111 22.671 22.816 -4.722 1.00 0.00 O ATOM 1800 CB GLU A 111 23.171 22.661 -1.713 1.00 0.00 C ATOM 1801 CG GLU A 111 24.121 23.658 -1.072 1.00 0.00 C ATOM 1802 CD GLU A 111 23.452 24.496 0.001 1.00 0.00 C ATOM 1803 OE1 GLU A 111 22.893 23.907 0.950 1.00 0.00 O ATOM 1804 OE2 GLU A 111 23.487 25.739 -0.109 1.00 0.00 O ATOM 0 H GLU A 111 20.932 21.666 -3.180 1.00 0.00 H new ATOM 0 HA GLU A 111 21.718 24.228 -1.946 1.00 0.00 H new ATOM 0 HB2 GLU A 111 22.767 22.008 -0.940 1.00 0.00 H new ATOM 0 HB3 GLU A 111 23.731 22.030 -2.403 1.00 0.00 H new ATOM 0 HG2 GLU A 111 24.964 23.122 -0.636 1.00 0.00 H new ATOM 0 HG3 GLU A 111 24.525 24.316 -1.842 1.00 0.00 H new ATOM 1811 N ASN A 112 22.588 24.985 -4.131 1.00 0.00 N ATOM 1812 CA ASN A 112 23.004 25.471 -5.442 1.00 0.00 C ATOM 1813 C ASN A 112 24.501 25.264 -5.648 1.00 0.00 C ATOM 1814 O ASN A 112 25.289 25.366 -4.708 1.00 0.00 O ATOM 1815 CB ASN A 112 22.657 26.954 -5.592 1.00 0.00 C ATOM 1816 CG ASN A 112 22.564 27.381 -7.044 1.00 0.00 C ATOM 1817 OD1 ASN A 112 21.878 26.748 -7.847 1.00 0.00 O ATOM 1818 ND2 ASN A 112 23.255 28.461 -7.388 1.00 0.00 N ATOM 0 H ASN A 112 22.414 25.719 -3.445 1.00 0.00 H new ATOM 0 HA ASN A 112 22.469 24.901 -6.201 1.00 0.00 H new ATOM 0 HB2 ASN A 112 21.708 27.154 -5.096 1.00 0.00 H new ATOM 0 HB3 ASN A 112 23.414 27.554 -5.087 1.00 0.00 H new ATOM 0 HD21 ASN A 112 23.230 28.797 -8.351 1.00 0.00 H new ATOM 0 HD22 ASN A 112 23.810 28.955 -6.690 1.00 0.00 H new ATOM 1825 N THR A 113 24.887 24.974 -6.887 1.00 0.00 N ATOM 1826 CA THR A 113 26.289 24.752 -7.218 1.00 0.00 C ATOM 1827 C THR A 113 26.839 25.888 -8.073 1.00 0.00 C ATOM 1828 O THR A 113 26.172 26.903 -8.277 1.00 0.00 O ATOM 1829 CB THR A 113 26.485 23.420 -7.966 1.00 0.00 C ATOM 1830 OG1 THR A 113 26.130 23.575 -9.344 1.00 0.00 O ATOM 1831 CG2 THR A 113 25.643 22.318 -7.341 1.00 0.00 C ATOM 0 H THR A 113 24.248 24.887 -7.677 1.00 0.00 H new ATOM 0 HA THR A 113 26.834 24.714 -6.275 1.00 0.00 H new ATOM 0 HB THR A 113 27.535 23.139 -7.891 1.00 0.00 H new ATOM 0 HG1 THR A 113 26.259 22.724 -9.813 1.00 0.00 H new ATOM 0 HG21 THR A 113 25.799 21.387 -7.887 1.00 0.00 H new ATOM 0 HG22 THR A 113 25.937 22.182 -6.300 1.00 0.00 H new ATOM 0 HG23 THR A 113 24.590 22.594 -7.388 1.00 0.00 H new ATOM 1839 N ASP A 114 28.057 25.710 -8.572 1.00 0.00 N ATOM 1840 CA ASP A 114 28.696 26.720 -9.407 1.00 0.00 C ATOM 1841 C ASP A 114 28.917 28.012 -8.626 1.00 0.00 C ATOM 1842 O ASP A 114 28.283 28.241 -7.596 1.00 0.00 O ATOM 1843 CB ASP A 114 27.845 27.000 -10.647 1.00 0.00 C ATOM 1844 CG ASP A 114 27.392 28.444 -10.725 1.00 0.00 C ATOM 1845 OD1 ASP A 114 26.392 28.789 -10.061 1.00 0.00 O ATOM 1846 OD2 ASP A 114 28.037 29.230 -11.450 1.00 0.00 O ATOM 0 H ASP A 114 28.622 24.876 -8.413 1.00 0.00 H new ATOM 0 HA ASP A 114 29.667 26.335 -9.720 1.00 0.00 H new ATOM 0 HB2 ASP A 114 28.418 26.754 -11.541 1.00 0.00 H new ATOM 0 HB3 ASP A 114 26.971 26.348 -10.639 1.00 0.00 H new ATOM 1851 N ALA A 115 29.820 28.851 -9.122 1.00 0.00 N ATOM 1852 CA ALA A 115 30.124 30.119 -8.471 1.00 0.00 C ATOM 1853 C ALA A 115 30.754 29.895 -7.100 1.00 0.00 C ATOM 1854 O ALA A 115 30.303 30.453 -6.099 1.00 0.00 O ATOM 1855 CB ALA A 115 28.863 30.962 -8.343 1.00 0.00 C ATOM 0 H ALA A 115 30.354 28.675 -9.973 1.00 0.00 H new ATOM 0 HA ALA A 115 30.844 30.654 -9.090 1.00 0.00 H new ATOM 0 HB1 ALA A 115 29.105 31.906 -7.855 1.00 0.00 H new ATOM 0 HB2 ALA A 115 28.455 31.160 -9.334 1.00 0.00 H new ATOM 0 HB3 ALA A 115 28.125 30.424 -7.748 1.00 0.00 H new ATOM 1861 N LYS A 116 31.799 29.075 -7.062 1.00 0.00 N ATOM 1862 CA LYS A 116 32.493 28.777 -5.814 1.00 0.00 C ATOM 1863 C LYS A 116 33.957 28.437 -6.074 1.00 0.00 C ATOM 1864 O LYS A 116 34.380 28.306 -7.222 1.00 0.00 O ATOM 1865 CB LYS A 116 31.808 27.615 -5.091 1.00 0.00 C ATOM 1866 CG LYS A 116 30.619 28.039 -4.247 1.00 0.00 C ATOM 1867 CD LYS A 116 31.038 28.971 -3.122 1.00 0.00 C ATOM 1868 CE LYS A 116 30.050 28.928 -1.966 1.00 0.00 C ATOM 1869 NZ LYS A 116 28.656 29.196 -2.417 1.00 0.00 N ATOM 0 H LYS A 116 32.184 28.605 -7.881 1.00 0.00 H new ATOM 0 HA LYS A 116 32.451 29.664 -5.182 1.00 0.00 H new ATOM 0 HB2 LYS A 116 31.477 26.884 -5.829 1.00 0.00 H new ATOM 0 HB3 LYS A 116 32.537 27.116 -4.452 1.00 0.00 H new ATOM 0 HG2 LYS A 116 29.883 28.537 -4.878 1.00 0.00 H new ATOM 0 HG3 LYS A 116 30.135 27.156 -3.828 1.00 0.00 H new ATOM 0 HD2 LYS A 116 32.029 28.690 -2.766 1.00 0.00 H new ATOM 0 HD3 LYS A 116 31.112 29.990 -3.501 1.00 0.00 H new ATOM 0 HE2 LYS A 116 30.095 27.950 -1.486 1.00 0.00 H new ATOM 0 HE3 LYS A 116 30.337 29.665 -1.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 28.052 29.376 -1.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 28.647 30.028 -3.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 28.294 28.371 -2.936 1.00 0.00 H new ATOM 1883 N LYS A 117 34.726 28.295 -4.999 1.00 0.00 N ATOM 1884 CA LYS A 117 36.142 27.968 -5.110 1.00 0.00 C ATOM 1885 C LYS A 117 36.374 26.475 -4.898 1.00 0.00 C ATOM 1886 O LYS A 117 37.504 26.035 -4.686 1.00 0.00 O ATOM 1887 CB LYS A 117 36.953 28.770 -4.090 1.00 0.00 C ATOM 1888 CG LYS A 117 38.384 29.037 -4.524 1.00 0.00 C ATOM 1889 CD LYS A 117 38.982 30.219 -3.779 1.00 0.00 C ATOM 1890 CE LYS A 117 38.463 31.541 -4.323 1.00 0.00 C ATOM 1891 NZ LYS A 117 39.126 32.706 -3.675 1.00 0.00 N ATOM 0 H LYS A 117 34.392 28.401 -4.041 1.00 0.00 H new ATOM 0 HA LYS A 117 36.472 28.230 -6.115 1.00 0.00 H new ATOM 0 HB2 LYS A 117 36.454 29.722 -3.909 1.00 0.00 H new ATOM 0 HB3 LYS A 117 36.964 28.231 -3.143 1.00 0.00 H new ATOM 0 HG2 LYS A 117 38.991 28.149 -4.346 1.00 0.00 H new ATOM 0 HG3 LYS A 117 38.410 29.231 -5.596 1.00 0.00 H new ATOM 0 HD2 LYS A 117 38.742 30.141 -2.719 1.00 0.00 H new ATOM 0 HD3 LYS A 117 40.068 30.191 -3.863 1.00 0.00 H new ATOM 0 HE2 LYS A 117 38.629 31.581 -5.399 1.00 0.00 H new ATOM 0 HE3 LYS A 117 37.386 31.601 -4.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 38.745 33.588 -4.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 38.946 32.682 -2.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 40.151 32.663 -3.848 1.00 0.00 H new ATOM 1905 N THR A 118 35.296 25.699 -4.959 1.00 0.00 N ATOM 1906 CA THR A 118 35.382 24.256 -4.774 1.00 0.00 C ATOM 1907 C THR A 118 36.417 23.898 -3.714 1.00 0.00 C ATOM 1908 O THR A 118 37.208 22.972 -3.895 1.00 0.00 O ATOM 1909 CB THR A 118 35.742 23.542 -6.090 1.00 0.00 C ATOM 1910 OG1 THR A 118 35.792 22.126 -5.882 1.00 0.00 O ATOM 1911 CG2 THR A 118 37.082 24.029 -6.621 1.00 0.00 C ATOM 0 H THR A 118 34.353 26.046 -5.135 1.00 0.00 H new ATOM 0 HA THR A 118 34.399 23.920 -4.445 1.00 0.00 H new ATOM 0 HB THR A 118 34.972 23.774 -6.825 1.00 0.00 H new ATOM 0 HG1 THR A 118 36.327 21.931 -5.084 1.00 0.00 H new ATOM 0 HG21 THR A 118 37.315 23.510 -7.551 1.00 0.00 H new ATOM 0 HG22 THR A 118 37.032 25.102 -6.806 1.00 0.00 H new ATOM 0 HG23 THR A 118 37.861 23.824 -5.886 1.00 0.00 H new ATOM 1919 N GLN A 119 36.407 24.637 -2.610 1.00 0.00 N ATOM 1920 CA GLN A 119 37.347 24.396 -1.521 1.00 0.00 C ATOM 1921 C GLN A 119 36.614 23.959 -0.257 1.00 0.00 C ATOM 1922 O GLN A 119 35.805 24.705 0.294 1.00 0.00 O ATOM 1923 CB GLN A 119 38.168 25.656 -1.240 1.00 0.00 C ATOM 1924 CG GLN A 119 37.321 26.869 -0.891 1.00 0.00 C ATOM 1925 CD GLN A 119 38.114 28.160 -0.912 1.00 0.00 C ATOM 1926 OE1 GLN A 119 39.324 28.155 -1.140 1.00 0.00 O ATOM 1927 NE2 GLN A 119 37.435 29.276 -0.673 1.00 0.00 N ATOM 0 H GLN A 119 35.759 25.407 -2.445 1.00 0.00 H new ATOM 0 HA GLN A 119 38.019 23.594 -1.825 1.00 0.00 H new ATOM 0 HB2 GLN A 119 38.856 25.455 -0.419 1.00 0.00 H new ATOM 0 HB3 GLN A 119 38.775 25.887 -2.115 1.00 0.00 H new ATOM 0 HG2 GLN A 119 36.493 26.944 -1.596 1.00 0.00 H new ATOM 0 HG3 GLN A 119 36.885 26.731 0.099 1.00 0.00 H new ATOM 0 HE21 GLN A 119 36.433 29.234 -0.489 1.00 0.00 H new ATOM 0 HE22 GLN A 119 37.916 30.176 -0.674 1.00 0.00 H new ATOM 1936 N LYS A 120 36.903 22.745 0.198 1.00 0.00 N ATOM 1937 CA LYS A 120 36.274 22.207 1.399 1.00 0.00 C ATOM 1938 C LYS A 120 36.940 20.903 1.825 1.00 0.00 C ATOM 1939 O LYS A 120 36.343 19.827 1.776 1.00 0.00 O ATOM 1940 CB LYS A 120 34.781 21.973 1.155 1.00 0.00 C ATOM 1941 CG LYS A 120 34.486 21.200 -0.118 1.00 0.00 C ATOM 1942 CD LYS A 120 34.321 22.129 -1.309 1.00 0.00 C ATOM 1943 CE LYS A 120 33.421 21.519 -2.372 1.00 0.00 C ATOM 1944 NZ LYS A 120 31.981 21.774 -2.094 1.00 0.00 N ATOM 0 H LYS A 120 37.570 22.114 -0.247 1.00 0.00 H new ATOM 0 HA LYS A 120 36.396 22.935 2.201 1.00 0.00 H new ATOM 0 HB2 LYS A 120 34.363 21.431 2.004 1.00 0.00 H new ATOM 0 HB3 LYS A 120 34.273 22.937 1.111 1.00 0.00 H new ATOM 0 HG2 LYS A 120 35.295 20.497 -0.313 1.00 0.00 H new ATOM 0 HG3 LYS A 120 33.578 20.612 0.014 1.00 0.00 H new ATOM 0 HD2 LYS A 120 33.901 23.078 -0.976 1.00 0.00 H new ATOM 0 HD3 LYS A 120 35.298 22.347 -1.740 1.00 0.00 H new ATOM 0 HE2 LYS A 120 33.681 21.931 -3.347 1.00 0.00 H new ATOM 0 HE3 LYS A 120 33.596 20.444 -2.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 31.401 21.342 -2.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 31.726 21.359 -1.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 31.808 22.799 -2.071 1.00 0.00 H new ATOM 1958 N PRO A 121 38.207 20.998 2.256 1.00 0.00 N ATOM 1959 CA PRO A 121 38.981 19.835 2.701 1.00 0.00 C ATOM 1960 C PRO A 121 38.471 19.271 4.023 1.00 0.00 C ATOM 1961 O PRO A 121 38.628 19.890 5.076 1.00 0.00 O ATOM 1962 CB PRO A 121 40.396 20.394 2.869 1.00 0.00 C ATOM 1963 CG PRO A 121 40.201 21.849 3.125 1.00 0.00 C ATOM 1964 CD PRO A 121 38.981 22.247 2.341 1.00 0.00 C ATOM 0 HA PRO A 121 38.916 19.007 1.995 1.00 0.00 H new ATOM 0 HB2 PRO A 121 40.916 19.913 3.697 1.00 0.00 H new ATOM 0 HB3 PRO A 121 40.997 20.226 1.975 1.00 0.00 H new ATOM 0 HG2 PRO A 121 40.062 22.043 4.189 1.00 0.00 H new ATOM 0 HG3 PRO A 121 41.073 22.421 2.808 1.00 0.00 H new ATOM 0 HD2 PRO A 121 38.419 23.034 2.844 1.00 0.00 H new ATOM 0 HD3 PRO A 121 39.244 22.625 1.353 1.00 0.00 H new ATOM 1972 N LEU A 122 37.860 18.093 3.961 1.00 0.00 N ATOM 1973 CA LEU A 122 37.326 17.445 5.154 1.00 0.00 C ATOM 1974 C LEU A 122 37.275 15.931 4.974 1.00 0.00 C ATOM 1975 O LEU A 122 36.399 15.408 4.284 1.00 0.00 O ATOM 1976 CB LEU A 122 35.928 17.980 5.468 1.00 0.00 C ATOM 1977 CG LEU A 122 35.527 17.987 6.943 1.00 0.00 C ATOM 1978 CD1 LEU A 122 35.486 16.568 7.491 1.00 0.00 C ATOM 1979 CD2 LEU A 122 36.488 18.845 7.753 1.00 0.00 C ATOM 0 H LEU A 122 37.722 17.567 3.098 1.00 0.00 H new ATOM 0 HA LEU A 122 37.990 17.672 5.988 1.00 0.00 H new ATOM 0 HB2 LEU A 122 35.857 18.999 5.088 1.00 0.00 H new ATOM 0 HB3 LEU A 122 35.201 17.384 4.917 1.00 0.00 H new ATOM 0 HG LEU A 122 34.529 18.417 7.027 1.00 0.00 H new ATOM 0 HD11 LEU A 122 35.199 16.592 8.542 1.00 0.00 H new ATOM 0 HD12 LEU A 122 34.759 15.982 6.929 1.00 0.00 H new ATOM 0 HD13 LEU A 122 36.471 16.112 7.394 1.00 0.00 H new ATOM 0 HD21 LEU A 122 36.187 18.838 8.801 1.00 0.00 H new ATOM 0 HD22 LEU A 122 37.498 18.444 7.663 1.00 0.00 H new ATOM 0 HD23 LEU A 122 36.468 19.868 7.376 1.00 0.00 H new ATOM 1991 N ILE A 123 38.216 15.233 5.600 1.00 0.00 N ATOM 1992 CA ILE A 123 38.276 13.780 5.511 1.00 0.00 C ATOM 1993 C ILE A 123 37.332 13.129 6.517 1.00 0.00 C ATOM 1994 O ILE A 123 37.548 13.208 7.726 1.00 0.00 O ATOM 1995 CB ILE A 123 39.705 13.259 5.753 1.00 0.00 C ATOM 1996 CG1 ILE A 123 40.688 13.941 4.800 1.00 0.00 C ATOM 1997 CG2 ILE A 123 39.754 11.748 5.582 1.00 0.00 C ATOM 1998 CD1 ILE A 123 42.130 13.548 5.036 1.00 0.00 C ATOM 0 H ILE A 123 38.948 15.651 6.175 1.00 0.00 H new ATOM 0 HA ILE A 123 37.968 13.513 4.500 1.00 0.00 H new ATOM 0 HB ILE A 123 39.995 13.499 6.776 1.00 0.00 H new ATOM 0 HG12 ILE A 123 40.416 13.695 3.773 1.00 0.00 H new ATOM 0 HG13 ILE A 123 40.593 15.022 4.905 1.00 0.00 H new ATOM 0 HG21 ILE A 123 40.770 11.395 5.756 1.00 0.00 H new ATOM 0 HG22 ILE A 123 39.079 11.279 6.298 1.00 0.00 H new ATOM 0 HG23 ILE A 123 39.448 11.486 4.569 1.00 0.00 H new ATOM 0 HD11 ILE A 123 42.770 14.069 4.325 1.00 0.00 H new ATOM 0 HD12 ILE A 123 42.419 13.819 6.051 1.00 0.00 H new ATOM 0 HD13 ILE A 123 42.240 12.472 4.902 1.00 0.00 H new ATOM 2010 N GLN A 124 36.288 12.483 6.008 1.00 0.00 N ATOM 2011 CA GLN A 124 35.312 11.817 6.862 1.00 0.00 C ATOM 2012 C GLN A 124 34.728 10.591 6.168 1.00 0.00 C ATOM 2013 O GLN A 124 34.382 10.641 4.989 1.00 0.00 O ATOM 2014 CB GLN A 124 34.190 12.786 7.242 1.00 0.00 C ATOM 2015 CG GLN A 124 33.054 12.129 8.009 1.00 0.00 C ATOM 2016 CD GLN A 124 31.947 13.104 8.361 1.00 0.00 C ATOM 2017 OE1 GLN A 124 31.366 13.745 7.485 1.00 0.00 O ATOM 2018 NE2 GLN A 124 31.650 13.222 9.650 1.00 0.00 N ATOM 0 H GLN A 124 36.096 12.407 5.009 1.00 0.00 H new ATOM 0 HA GLN A 124 35.822 11.490 7.768 1.00 0.00 H new ATOM 0 HB2 GLN A 124 34.606 13.592 7.846 1.00 0.00 H new ATOM 0 HB3 GLN A 124 33.790 13.240 6.335 1.00 0.00 H new ATOM 0 HG2 GLN A 124 32.641 11.316 7.413 1.00 0.00 H new ATOM 0 HG3 GLN A 124 33.447 11.686 8.924 1.00 0.00 H new ATOM 0 HE21 GLN A 124 32.157 12.671 10.343 1.00 0.00 H new ATOM 0 HE22 GLN A 124 30.915 13.863 9.947 1.00 0.00 H new ATOM 2027 N GLU A 125 34.622 9.492 6.909 1.00 0.00 N ATOM 2028 CA GLU A 125 34.081 8.253 6.363 1.00 0.00 C ATOM 2029 C GLU A 125 32.768 7.885 7.048 1.00 0.00 C ATOM 2030 O GLU A 125 32.720 7.697 8.263 1.00 0.00 O ATOM 2031 CB GLU A 125 35.090 7.115 6.525 1.00 0.00 C ATOM 2032 CG GLU A 125 36.158 7.089 5.444 1.00 0.00 C ATOM 2033 CD GLU A 125 35.601 6.716 4.083 1.00 0.00 C ATOM 2034 OE1 GLU A 125 34.979 7.585 3.438 1.00 0.00 O ATOM 2035 OE2 GLU A 125 35.789 5.555 3.665 1.00 0.00 O ATOM 0 H GLU A 125 34.903 9.435 7.888 1.00 0.00 H new ATOM 0 HA GLU A 125 33.887 8.408 5.302 1.00 0.00 H new ATOM 0 HB2 GLU A 125 35.572 7.204 7.498 1.00 0.00 H new ATOM 0 HB3 GLU A 125 34.557 6.164 6.520 1.00 0.00 H new ATOM 0 HG2 GLU A 125 36.632 8.069 5.383 1.00 0.00 H new ATOM 0 HG3 GLU A 125 36.934 6.377 5.722 1.00 0.00 H new ATOM 2042 N VAL A 126 31.703 7.783 6.258 1.00 0.00 N ATOM 2043 CA VAL A 126 30.390 7.436 6.786 1.00 0.00 C ATOM 2044 C VAL A 126 29.585 6.629 5.773 1.00 0.00 C ATOM 2045 O VAL A 126 29.548 6.962 4.589 1.00 0.00 O ATOM 2046 CB VAL A 126 29.591 8.695 7.174 1.00 0.00 C ATOM 2047 CG1 VAL A 126 30.296 9.453 8.288 1.00 0.00 C ATOM 2048 CG2 VAL A 126 29.382 9.588 5.960 1.00 0.00 C ATOM 0 H VAL A 126 31.725 7.936 5.250 1.00 0.00 H new ATOM 0 HA VAL A 126 30.557 6.831 7.677 1.00 0.00 H new ATOM 0 HB VAL A 126 28.613 8.384 7.541 1.00 0.00 H new ATOM 0 HG11 VAL A 126 29.717 10.339 8.548 1.00 0.00 H new ATOM 0 HG12 VAL A 126 30.389 8.810 9.163 1.00 0.00 H new ATOM 0 HG13 VAL A 126 31.288 9.754 7.952 1.00 0.00 H new ATOM 0 HG21 VAL A 126 28.816 10.473 6.252 1.00 0.00 H new ATOM 0 HG22 VAL A 126 30.350 9.892 5.561 1.00 0.00 H new ATOM 0 HG23 VAL A 126 28.830 9.040 5.196 1.00 0.00 H new ATOM 2058 N GLU A 127 28.942 5.567 6.248 1.00 0.00 N ATOM 2059 CA GLU A 127 28.138 4.711 5.383 1.00 0.00 C ATOM 2060 C GLU A 127 26.650 4.983 5.581 1.00 0.00 C ATOM 2061 O GLU A 127 26.110 4.786 6.670 1.00 0.00 O ATOM 2062 CB GLU A 127 28.441 3.238 5.662 1.00 0.00 C ATOM 2063 CG GLU A 127 27.773 2.284 4.685 1.00 0.00 C ATOM 2064 CD GLU A 127 28.386 2.345 3.299 1.00 0.00 C ATOM 2065 OE1 GLU A 127 29.631 2.324 3.200 1.00 0.00 O ATOM 2066 OE2 GLU A 127 27.621 2.414 2.315 1.00 0.00 O ATOM 0 H GLU A 127 28.962 5.279 7.226 1.00 0.00 H new ATOM 0 HA GLU A 127 28.396 4.937 4.348 1.00 0.00 H new ATOM 0 HB2 GLU A 127 29.520 3.085 5.627 1.00 0.00 H new ATOM 0 HB3 GLU A 127 28.117 2.994 6.674 1.00 0.00 H new ATOM 0 HG2 GLU A 127 27.849 1.266 5.067 1.00 0.00 H new ATOM 0 HG3 GLU A 127 26.711 2.521 4.619 1.00 0.00 H new ATOM 2073 N THR A 128 25.991 5.437 4.519 1.00 0.00 N ATOM 2074 CA THR A 128 24.566 5.738 4.575 1.00 0.00 C ATOM 2075 C THR A 128 23.743 4.621 3.943 1.00 0.00 C ATOM 2076 O THR A 128 24.142 4.038 2.935 1.00 0.00 O ATOM 2077 CB THR A 128 24.243 7.064 3.863 1.00 0.00 C ATOM 2078 OG1 THR A 128 25.288 8.014 4.099 1.00 0.00 O ATOM 2079 CG2 THR A 128 22.917 7.630 4.348 1.00 0.00 C ATOM 0 H THR A 128 26.422 5.604 3.610 1.00 0.00 H new ATOM 0 HA THR A 128 24.303 5.828 5.629 1.00 0.00 H new ATOM 0 HB THR A 128 24.166 6.867 2.794 1.00 0.00 H new ATOM 0 HG1 THR A 128 25.076 8.854 3.641 1.00 0.00 H new ATOM 0 HG21 THR A 128 22.710 8.567 3.831 1.00 0.00 H new ATOM 0 HG22 THR A 128 22.119 6.917 4.140 1.00 0.00 H new ATOM 0 HG23 THR A 128 22.970 7.812 5.421 1.00 0.00 H new ATOM 2087 N ASP A 129 22.593 4.329 4.540 1.00 0.00 N ATOM 2088 CA ASP A 129 21.713 3.282 4.033 1.00 0.00 C ATOM 2089 C ASP A 129 20.255 3.593 4.360 1.00 0.00 C ATOM 2090 O ASP A 129 19.956 4.579 5.032 1.00 0.00 O ATOM 2091 CB ASP A 129 22.103 1.927 4.626 1.00 0.00 C ATOM 2092 CG ASP A 129 21.947 1.887 6.133 1.00 0.00 C ATOM 2093 OD1 ASP A 129 22.661 2.645 6.823 1.00 0.00 O ATOM 2094 OD2 ASP A 129 21.112 1.098 6.623 1.00 0.00 O ATOM 0 H ASP A 129 22.248 4.802 5.375 1.00 0.00 H new ATOM 0 HA ASP A 129 21.824 3.241 2.949 1.00 0.00 H new ATOM 0 HB2 ASP A 129 21.486 1.147 4.179 1.00 0.00 H new ATOM 0 HB3 ASP A 129 23.137 1.704 4.365 1.00 0.00 H new ATOM 2099 N GLY A 130 19.352 2.745 3.877 1.00 0.00 N ATOM 2100 CA GLY A 130 17.937 2.947 4.126 1.00 0.00 C ATOM 2101 C GLY A 130 17.079 1.855 3.519 1.00 0.00 C ATOM 2102 O GLY A 130 16.772 1.888 2.327 1.00 0.00 O ATOM 0 H GLY A 130 19.575 1.922 3.318 1.00 0.00 H new ATOM 0 HA2 GLY A 130 17.763 2.986 5.201 1.00 0.00 H new ATOM 0 HA3 GLY A 130 17.634 3.911 3.719 1.00 0.00 H new ATOM 2106 N VAL A 131 16.692 0.883 4.339 1.00 0.00 N ATOM 2107 CA VAL A 131 15.865 -0.224 3.875 1.00 0.00 C ATOM 2108 C VAL A 131 14.382 0.099 4.020 1.00 0.00 C ATOM 2109 O VAL A 131 13.990 0.895 4.873 1.00 0.00 O ATOM 2110 CB VAL A 131 16.175 -1.519 4.650 1.00 0.00 C ATOM 2111 CG1 VAL A 131 17.647 -1.880 4.520 1.00 0.00 C ATOM 2112 CG2 VAL A 131 15.782 -1.371 6.112 1.00 0.00 C ATOM 0 H VAL A 131 16.938 0.840 5.328 1.00 0.00 H new ATOM 0 HA VAL A 131 16.100 -0.374 2.821 1.00 0.00 H new ATOM 0 HB VAL A 131 15.587 -2.329 4.219 1.00 0.00 H new ATOM 0 HG11 VAL A 131 17.847 -2.797 5.074 1.00 0.00 H new ATOM 0 HG12 VAL A 131 17.893 -2.030 3.469 1.00 0.00 H new ATOM 0 HG13 VAL A 131 18.257 -1.072 4.924 1.00 0.00 H new ATOM 0 HG21 VAL A 131 16.008 -2.295 6.645 1.00 0.00 H new ATOM 0 HG22 VAL A 131 16.342 -0.549 6.558 1.00 0.00 H new ATOM 0 HG23 VAL A 131 14.714 -1.163 6.183 1.00 0.00 H new ATOM 2122 N SER A 132 13.562 -0.525 3.181 1.00 0.00 N ATOM 2123 CA SER A 132 12.121 -0.301 3.213 1.00 0.00 C ATOM 2124 C SER A 132 11.384 -1.567 3.642 1.00 0.00 C ATOM 2125 O SER A 132 10.285 -1.502 4.190 1.00 0.00 O ATOM 2126 CB SER A 132 11.623 0.151 1.838 1.00 0.00 C ATOM 2127 OG SER A 132 10.211 0.272 1.822 1.00 0.00 O ATOM 0 H SER A 132 13.870 -1.189 2.471 1.00 0.00 H new ATOM 0 HA SER A 132 11.916 0.483 3.942 1.00 0.00 H new ATOM 0 HB2 SER A 132 12.076 1.108 1.580 1.00 0.00 H new ATOM 0 HB3 SER A 132 11.938 -0.566 1.080 1.00 0.00 H new ATOM 0 HG SER A 132 9.950 0.969 1.184 1.00 0.00 H new ATOM 2133 N ASN A 133 12.000 -2.717 3.388 1.00 0.00 N ATOM 2134 CA ASN A 133 11.403 -3.998 3.748 1.00 0.00 C ATOM 2135 C ASN A 133 10.101 -4.225 2.986 1.00 0.00 C ATOM 2136 O ASN A 133 9.150 -4.795 3.519 1.00 0.00 O ATOM 2137 CB ASN A 133 11.144 -4.059 5.254 1.00 0.00 C ATOM 2138 CG ASN A 133 11.192 -5.476 5.793 1.00 0.00 C ATOM 2139 OD1 ASN A 133 11.416 -6.429 5.045 1.00 0.00 O ATOM 2140 ND2 ASN A 133 10.982 -5.621 7.096 1.00 0.00 N ATOM 0 H ASN A 133 12.911 -2.788 2.935 1.00 0.00 H new ATOM 0 HA ASN A 133 12.104 -4.787 3.475 1.00 0.00 H new ATOM 0 HB2 ASN A 133 11.886 -3.451 5.772 1.00 0.00 H new ATOM 0 HB3 ASN A 133 10.168 -3.624 5.470 1.00 0.00 H new ATOM 0 HD21 ASN A 133 11.003 -6.550 7.516 1.00 0.00 H new ATOM 0 HD22 ASN A 133 10.800 -4.803 7.677 1.00 0.00 H new ATOM 2147 N ASN A 134 10.066 -3.773 1.737 1.00 0.00 N ATOM 2148 CA ASN A 134 8.880 -3.926 0.901 1.00 0.00 C ATOM 2149 C ASN A 134 8.910 -5.255 0.153 1.00 0.00 C ATOM 2150 O ASN A 134 7.895 -5.698 -0.385 1.00 0.00 O ATOM 2151 CB ASN A 134 8.781 -2.769 -0.095 1.00 0.00 C ATOM 2152 CG ASN A 134 8.239 -1.504 0.541 1.00 0.00 C ATOM 2153 OD1 ASN A 134 7.781 -1.517 1.683 1.00 0.00 O ATOM 2154 ND2 ASN A 134 8.289 -0.402 -0.199 1.00 0.00 N ATOM 0 H ASN A 134 10.845 -3.298 1.281 1.00 0.00 H new ATOM 0 HA ASN A 134 8.004 -3.914 1.550 1.00 0.00 H new ATOM 0 HB2 ASN A 134 9.767 -2.568 -0.514 1.00 0.00 H new ATOM 0 HB3 ASN A 134 8.136 -3.061 -0.924 1.00 0.00 H new ATOM 0 HD21 ASN A 134 7.939 0.480 0.175 1.00 0.00 H new ATOM 0 HD22 ASN A 134 8.677 -0.438 -1.141 1.00 0.00 H new TER 2161 ASN A 134