USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=27 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 80 LYS NZ :NH3+ 173:sc= -1.08 (180deg=-1.01) USER MOD Set 1.2: A 82 ASN : amide:sc= -0.463 K(o=-1.5,f=-1) USER MOD Single : A 1 GLY N :NH3+ -174:sc= 0.463 (180deg=0.442) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.712 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 133:sc= 0.282 USER MOD Single : A 10 GLN : amide:sc= -1.34 X(o=-1.3,f=-1.4) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.209 X(o=-0.21,f=-0.41) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0.614 K(o=0.61,f=-5.9!) USER MOD Single : A 38 ASN : amide:sc= -2.82 K(o=-2.8,f=-6.7!) USER MOD Single : A 39 MET CE :methyl -173:sc= -3.95 (180deg=-4.23) USER MOD Single : A 43 HIS : no HD1:sc= -0.238 X(o=-0.24,f=-0.065) USER MOD Single : A 45 SER OG : rot 180:sc= 0.923 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -140:sc= -3.71! USER MOD Single : A 55 HIS : no HD1:sc= -0.652 K(o=-0.65,f=-0.003) USER MOD Single : A 63 SER OG : rot 170:sc= 0.038 USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.209 USER MOD Single : A 66 GLN : amide:sc= 0.0339 X(o=0.034,f=0) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 CYS SG : rot 180:sc= -0.381 USER MOD Single : A 75 ASN : amide:sc= -0.866 K(o=-0.87,f=-11!) USER MOD Single : A 77 LYS NZ :NH3+ -159:sc= 0.239 (180deg=-0.0415) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -1.16 K(o=-1.2,f=-0.11) 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+ 177:sc= -0.0472 (180deg=-0.0747) USER MOD Single : A 100 GLN : amide:sc= -0.0988 K(o=-0.099,f=-1.6!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ -161:sc= -0.111 (180deg=-0.581) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 38:sc= 0.453 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 152:sc= -0.119 (180deg=-0.598) USER MOD Single : A 124 GLN : amide:sc= -0.976 X(o=-0.98,f=-0.95) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.051 X(o=-0.051,f=-0.1) USER MOD Single : A 134 ASN : amide:sc= -0.252 X(o=-0.25,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.208 0.130 -1.167 1.00 0.00 N ATOM 2 CA GLY A 1 1.210 0.256 -0.883 1.00 0.00 C ATOM 3 C GLY A 1 1.956 -1.051 -1.066 1.00 0.00 C ATOM 4 O GLY A 1 2.384 -1.671 -0.092 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.655 1.068 -1.127 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.337 -0.275 -2.116 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.649 -0.494 -0.462 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.643 1.013 -1.538 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.343 0.606 0.141 1.00 0.00 H new ATOM 8 N ILE A 2 2.111 -1.471 -2.317 1.00 0.00 N ATOM 9 CA ILE A 2 2.810 -2.713 -2.625 1.00 0.00 C ATOM 10 C ILE A 2 3.805 -2.517 -3.764 1.00 0.00 C ATOM 11 O ILE A 2 3.421 -2.212 -4.893 1.00 0.00 O ATOM 12 CB ILE A 2 1.825 -3.834 -3.006 1.00 0.00 C ATOM 13 CG1 ILE A 2 0.659 -3.876 -2.016 1.00 0.00 C ATOM 14 CG2 ILE A 2 2.540 -5.176 -3.048 1.00 0.00 C ATOM 15 CD1 ILE A 2 -0.395 -4.903 -2.367 1.00 0.00 C ATOM 0 H ILE A 2 1.762 -0.970 -3.134 1.00 0.00 H new ATOM 0 HA ILE A 2 3.348 -3.004 -1.723 1.00 0.00 H new ATOM 0 HB ILE A 2 1.427 -3.626 -3.999 1.00 0.00 H new ATOM 0 HG12 ILE A 2 1.046 -4.090 -1.020 1.00 0.00 H new ATOM 0 HG13 ILE A 2 0.195 -2.891 -1.972 1.00 0.00 H new ATOM 0 HG21 ILE A 2 1.831 -5.958 -3.319 1.00 0.00 H new ATOM 0 HG22 ILE A 2 3.339 -5.139 -3.788 1.00 0.00 H new ATOM 0 HG23 ILE A 2 2.963 -5.394 -2.067 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -1.191 -4.877 -1.622 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -0.810 -4.677 -3.349 1.00 0.00 H new ATOM 0 HD13 ILE A 2 0.055 -5.896 -2.382 1.00 0.00 H new ATOM 27 N THR A 3 5.087 -2.695 -3.460 1.00 0.00 N ATOM 28 CA THR A 3 6.137 -2.539 -4.458 1.00 0.00 C ATOM 29 C THR A 3 7.519 -2.623 -3.819 1.00 0.00 C ATOM 30 O THR A 3 7.732 -2.196 -2.684 1.00 0.00 O ATOM 31 CB THR A 3 6.009 -1.197 -5.203 1.00 0.00 C ATOM 32 OG1 THR A 3 7.237 -0.889 -5.873 1.00 0.00 O ATOM 33 CG2 THR A 3 5.657 -0.074 -4.239 1.00 0.00 C ATOM 0 H THR A 3 5.423 -2.947 -2.530 1.00 0.00 H new ATOM 0 HA THR A 3 6.019 -3.355 -5.171 1.00 0.00 H new ATOM 0 HB THR A 3 5.208 -1.290 -5.937 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.147 -0.035 -6.346 1.00 0.00 H new ATOM 0 HG21 THR A 3 5.572 0.864 -4.788 1.00 0.00 H new ATOM 0 HG22 THR A 3 4.708 -0.297 -3.752 1.00 0.00 H new ATOM 0 HG23 THR A 3 6.439 0.017 -3.485 1.00 0.00 H new ATOM 41 N PRO A 4 8.483 -3.185 -4.564 1.00 0.00 N ATOM 42 CA PRO A 4 9.862 -3.336 -4.090 1.00 0.00 C ATOM 43 C PRO A 4 10.588 -2.000 -3.983 1.00 0.00 C ATOM 44 O PRO A 4 11.173 -1.682 -2.947 1.00 0.00 O ATOM 45 CB PRO A 4 10.511 -4.213 -5.164 1.00 0.00 C ATOM 46 CG PRO A 4 9.708 -3.964 -6.393 1.00 0.00 C ATOM 47 CD PRO A 4 8.301 -3.715 -5.925 1.00 0.00 C ATOM 0 HA PRO A 4 9.904 -3.763 -3.088 1.00 0.00 H new ATOM 0 HB2 PRO A 4 11.557 -3.946 -5.314 1.00 0.00 H new ATOM 0 HB3 PRO A 4 10.488 -5.266 -4.883 1.00 0.00 H new ATOM 0 HG2 PRO A 4 10.094 -3.106 -6.944 1.00 0.00 H new ATOM 0 HG3 PRO A 4 9.750 -4.820 -7.066 1.00 0.00 H new ATOM 0 HD2 PRO A 4 7.784 -3.003 -6.568 1.00 0.00 H new ATOM 0 HD3 PRO A 4 7.710 -4.631 -5.924 1.00 0.00 H new ATOM 55 N ARG A 5 10.546 -1.221 -5.059 1.00 0.00 N ATOM 56 CA ARG A 5 11.201 0.081 -5.085 1.00 0.00 C ATOM 57 C ARG A 5 10.602 0.969 -6.171 1.00 0.00 C ATOM 58 O ARG A 5 10.155 0.482 -7.210 1.00 0.00 O ATOM 59 CB ARG A 5 12.704 -0.085 -5.318 1.00 0.00 C ATOM 60 CG ARG A 5 13.513 -0.184 -4.035 1.00 0.00 C ATOM 61 CD ARG A 5 14.090 -1.578 -3.846 1.00 0.00 C ATOM 62 NE ARG A 5 15.141 -1.603 -2.833 1.00 0.00 N ATOM 63 CZ ARG A 5 15.961 -2.632 -2.650 1.00 0.00 C ATOM 64 NH1 ARG A 5 15.851 -3.714 -3.407 1.00 0.00 N ATOM 65 NH2 ARG A 5 16.893 -2.579 -1.707 1.00 0.00 N ATOM 0 H ARG A 5 10.065 -1.469 -5.924 1.00 0.00 H new ATOM 0 HA ARG A 5 11.041 0.560 -4.119 1.00 0.00 H new ATOM 0 HB2 ARG A 5 12.874 -0.982 -5.914 1.00 0.00 H new ATOM 0 HB3 ARG A 5 13.068 0.760 -5.902 1.00 0.00 H new ATOM 0 HG2 ARG A 5 14.322 0.546 -4.057 1.00 0.00 H new ATOM 0 HG3 ARG A 5 12.880 0.067 -3.184 1.00 0.00 H new ATOM 0 HD2 ARG A 5 13.293 -2.264 -3.559 1.00 0.00 H new ATOM 0 HD3 ARG A 5 14.492 -1.935 -4.794 1.00 0.00 H new ATOM 0 HE ARG A 5 15.252 -0.786 -2.233 1.00 0.00 H new ATOM 0 HH11 ARG A 5 15.135 -3.758 -4.132 1.00 0.00 H new ATOM 0 HH12 ARG A 5 16.482 -4.503 -3.264 1.00 0.00 H new ATOM 0 HH21 ARG A 5 16.980 -1.748 -1.122 1.00 0.00 H new ATOM 0 HH22 ARG A 5 17.522 -3.369 -1.567 1.00 0.00 H new ATOM 79 N PHE A 6 10.596 2.275 -5.924 1.00 0.00 N ATOM 80 CA PHE A 6 10.050 3.232 -6.880 1.00 0.00 C ATOM 81 C PHE A 6 10.511 4.649 -6.554 1.00 0.00 C ATOM 82 O PHE A 6 10.549 5.049 -5.390 1.00 0.00 O ATOM 83 CB PHE A 6 8.522 3.167 -6.882 1.00 0.00 C ATOM 84 CG PHE A 6 7.894 3.794 -5.670 1.00 0.00 C ATOM 85 CD1 PHE A 6 7.592 5.146 -5.650 1.00 0.00 C ATOM 86 CD2 PHE A 6 7.604 3.030 -4.551 1.00 0.00 C ATOM 87 CE1 PHE A 6 7.015 5.725 -4.536 1.00 0.00 C ATOM 88 CE2 PHE A 6 7.027 3.603 -3.434 1.00 0.00 C ATOM 89 CZ PHE A 6 6.731 4.952 -3.427 1.00 0.00 C ATOM 0 H PHE A 6 10.963 2.695 -5.070 1.00 0.00 H new ATOM 0 HA PHE A 6 10.419 2.969 -7.871 1.00 0.00 H new ATOM 0 HB2 PHE A 6 8.146 3.666 -7.775 1.00 0.00 H new ATOM 0 HB3 PHE A 6 8.211 2.124 -6.944 1.00 0.00 H new ATOM 0 HD1 PHE A 6 7.810 5.754 -6.515 1.00 0.00 H new ATOM 0 HD2 PHE A 6 7.832 1.974 -4.552 1.00 0.00 H new ATOM 0 HE1 PHE A 6 6.786 6.781 -4.532 1.00 0.00 H new ATOM 0 HE2 PHE A 6 6.808 2.997 -2.567 1.00 0.00 H new ATOM 0 HZ PHE A 6 6.278 5.402 -2.556 1.00 0.00 H new ATOM 99 N SER A 7 10.860 5.405 -7.590 1.00 0.00 N ATOM 100 CA SER A 7 11.322 6.777 -7.415 1.00 0.00 C ATOM 101 C SER A 7 10.473 7.745 -8.234 1.00 0.00 C ATOM 102 O SER A 7 10.036 7.422 -9.339 1.00 0.00 O ATOM 103 CB SER A 7 12.791 6.899 -7.823 1.00 0.00 C ATOM 104 OG SER A 7 13.649 6.543 -6.752 1.00 0.00 O ATOM 0 H SER A 7 10.832 5.090 -8.560 1.00 0.00 H new ATOM 0 HA SER A 7 11.222 7.036 -6.361 1.00 0.00 H new ATOM 0 HB2 SER A 7 12.988 6.256 -8.680 1.00 0.00 H new ATOM 0 HB3 SER A 7 13.001 7.922 -8.137 1.00 0.00 H new ATOM 0 HG SER A 7 14.582 6.628 -7.039 1.00 0.00 H new ATOM 110 N ILE A 8 10.244 8.932 -7.683 1.00 0.00 N ATOM 111 CA ILE A 8 9.449 9.948 -8.362 1.00 0.00 C ATOM 112 C ILE A 8 10.310 11.139 -8.769 1.00 0.00 C ATOM 113 O ILE A 8 11.221 11.539 -8.043 1.00 0.00 O ATOM 114 CB ILE A 8 8.293 10.445 -7.474 1.00 0.00 C ATOM 115 CG1 ILE A 8 7.765 9.304 -6.601 1.00 0.00 C ATOM 116 CG2 ILE A 8 7.178 11.024 -8.331 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.570 9.692 -5.758 1.00 0.00 C ATOM 0 H ILE A 8 10.597 9.214 -6.769 1.00 0.00 H new ATOM 0 HA ILE A 8 9.035 9.480 -9.255 1.00 0.00 H new ATOM 0 HB ILE A 8 8.668 11.233 -6.821 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.491 8.465 -7.240 1.00 0.00 H new ATOM 0 HG13 ILE A 8 8.565 8.958 -5.946 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.368 11.371 -7.689 1.00 0.00 H new ATOM 0 HG22 ILE A 8 7.564 11.861 -8.913 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.802 10.256 -9.006 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.249 8.835 -5.165 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.844 10.511 -5.093 1.00 0.00 H new ATOM 0 HD13 ILE A 8 5.754 10.010 -6.407 1.00 0.00 H new ATOM 129 N THR A 9 10.015 11.704 -9.936 1.00 0.00 N ATOM 130 CA THR A 9 10.761 12.849 -10.441 1.00 0.00 C ATOM 131 C THR A 9 9.824 13.984 -10.838 1.00 0.00 C ATOM 132 O THR A 9 8.715 13.746 -11.314 1.00 0.00 O ATOM 133 CB THR A 9 11.627 12.465 -11.656 1.00 0.00 C ATOM 134 OG1 THR A 9 12.042 11.099 -11.549 1.00 0.00 O ATOM 135 CG2 THR A 9 12.850 13.365 -11.755 1.00 0.00 C ATOM 0 H THR A 9 9.264 11.386 -10.549 1.00 0.00 H new ATOM 0 HA THR A 9 11.411 13.184 -9.632 1.00 0.00 H new ATOM 0 HB THR A 9 11.027 12.593 -12.557 1.00 0.00 H new ATOM 0 HG1 THR A 9 11.887 10.642 -12.402 1.00 0.00 H new ATOM 0 HG21 THR A 9 13.446 13.075 -12.620 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.531 14.401 -11.865 1.00 0.00 H new ATOM 0 HG23 THR A 9 13.450 13.264 -10.851 1.00 0.00 H new ATOM 143 N GLN A 10 10.279 15.217 -10.640 1.00 0.00 N ATOM 144 CA GLN A 10 9.479 16.389 -10.978 1.00 0.00 C ATOM 145 C GLN A 10 10.111 17.166 -12.128 1.00 0.00 C ATOM 146 O GLN A 10 11.335 17.244 -12.239 1.00 0.00 O ATOM 147 CB GLN A 10 9.326 17.298 -9.757 1.00 0.00 C ATOM 148 CG GLN A 10 10.646 17.836 -9.230 1.00 0.00 C ATOM 149 CD GLN A 10 11.357 16.853 -8.321 1.00 0.00 C ATOM 150 OE1 GLN A 10 12.460 16.397 -8.623 1.00 0.00 O ATOM 151 NE2 GLN A 10 10.727 16.520 -7.201 1.00 0.00 N ATOM 0 H GLN A 10 11.196 15.430 -10.248 1.00 0.00 H new ATOM 0 HA GLN A 10 8.493 16.046 -11.293 1.00 0.00 H new ATOM 0 HB2 GLN A 10 8.680 18.136 -10.017 1.00 0.00 H new ATOM 0 HB3 GLN A 10 8.826 16.744 -8.963 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.295 18.082 -10.071 1.00 0.00 H new ATOM 0 HG3 GLN A 10 10.465 18.763 -8.685 1.00 0.00 H new ATOM 0 HE21 GLN A 10 9.814 16.922 -6.991 1.00 0.00 H new ATOM 0 HE22 GLN A 10 11.156 15.862 -6.551 1.00 0.00 H new ATOM 160 N ASP A 11 9.270 17.738 -12.982 1.00 0.00 N ATOM 161 CA ASP A 11 9.746 18.509 -14.124 1.00 0.00 C ATOM 162 C ASP A 11 9.018 19.846 -14.219 1.00 0.00 C ATOM 163 O ASP A 11 8.089 20.113 -13.456 1.00 0.00 O ATOM 164 CB ASP A 11 9.553 17.717 -15.418 1.00 0.00 C ATOM 165 CG ASP A 11 9.811 16.234 -15.234 1.00 0.00 C ATOM 166 OD1 ASP A 11 10.784 15.884 -14.533 1.00 0.00 O ATOM 167 OD2 ASP A 11 9.040 15.425 -15.789 1.00 0.00 O ATOM 0 H ASP A 11 8.254 17.682 -12.905 1.00 0.00 H new ATOM 0 HA ASP A 11 10.809 18.704 -13.981 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.536 17.863 -15.782 1.00 0.00 H new ATOM 0 HB3 ASP A 11 10.224 18.107 -16.183 1.00 0.00 H new ATOM 172 N GLU A 12 9.447 20.683 -15.158 1.00 0.00 N ATOM 173 CA GLU A 12 8.837 21.994 -15.350 1.00 0.00 C ATOM 174 C GLU A 12 7.677 21.914 -16.338 1.00 0.00 C ATOM 175 O GLU A 12 7.130 22.936 -16.751 1.00 0.00 O ATOM 176 CB GLU A 12 9.878 22.998 -15.848 1.00 0.00 C ATOM 177 CG GLU A 12 10.457 22.650 -17.208 1.00 0.00 C ATOM 178 CD GLU A 12 11.739 21.846 -17.108 1.00 0.00 C ATOM 179 OE1 GLU A 12 12.716 22.356 -16.522 1.00 0.00 O ATOM 180 OE2 GLU A 12 11.764 20.706 -17.618 1.00 0.00 O ATOM 0 H GLU A 12 10.214 20.477 -15.798 1.00 0.00 H new ATOM 0 HA GLU A 12 8.450 22.331 -14.388 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.422 23.987 -15.899 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.689 23.058 -15.122 1.00 0.00 H new ATOM 0 HG2 GLU A 12 9.721 22.083 -17.778 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.651 23.568 -17.762 1.00 0.00 H new ATOM 187 N GLU A 13 7.309 20.693 -16.713 1.00 0.00 N ATOM 188 CA GLU A 13 6.216 20.480 -17.655 1.00 0.00 C ATOM 189 C GLU A 13 5.225 19.453 -17.115 1.00 0.00 C ATOM 190 O GLU A 13 4.015 19.583 -17.303 1.00 0.00 O ATOM 191 CB GLU A 13 6.761 20.018 -19.007 1.00 0.00 C ATOM 192 CG GLU A 13 8.004 19.151 -18.898 1.00 0.00 C ATOM 193 CD GLU A 13 8.524 18.704 -20.251 1.00 0.00 C ATOM 194 OE1 GLU A 13 7.930 19.101 -21.275 1.00 0.00 O ATOM 195 OE2 GLU A 13 9.525 17.958 -20.286 1.00 0.00 O ATOM 0 H GLU A 13 7.751 19.837 -16.379 1.00 0.00 H new ATOM 0 HA GLU A 13 5.694 21.428 -17.787 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.984 19.461 -19.531 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.991 20.893 -19.615 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.785 19.706 -18.378 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.779 18.274 -18.292 1.00 0.00 H new ATOM 202 N PHE A 14 5.747 18.432 -16.443 1.00 0.00 N ATOM 203 CA PHE A 14 4.910 17.381 -15.877 1.00 0.00 C ATOM 204 C PHE A 14 5.690 16.553 -14.860 1.00 0.00 C ATOM 205 O PHE A 14 6.841 16.858 -14.547 1.00 0.00 O ATOM 206 CB PHE A 14 4.372 16.475 -16.986 1.00 0.00 C ATOM 207 CG PHE A 14 5.448 15.882 -17.850 1.00 0.00 C ATOM 208 CD1 PHE A 14 5.928 16.571 -18.952 1.00 0.00 C ATOM 209 CD2 PHE A 14 5.981 14.637 -17.559 1.00 0.00 C ATOM 210 CE1 PHE A 14 6.917 16.027 -19.750 1.00 0.00 C ATOM 211 CE2 PHE A 14 6.971 14.088 -18.353 1.00 0.00 C ATOM 212 CZ PHE A 14 7.441 14.785 -19.449 1.00 0.00 C ATOM 0 H PHE A 14 6.746 18.310 -16.277 1.00 0.00 H new ATOM 0 HA PHE A 14 4.071 17.854 -15.366 1.00 0.00 H new ATOM 0 HB2 PHE A 14 3.793 15.669 -16.536 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.688 17.048 -17.613 1.00 0.00 H new ATOM 0 HD1 PHE A 14 5.525 17.544 -19.190 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.619 14.089 -16.702 1.00 0.00 H new ATOM 0 HE1 PHE A 14 7.280 16.573 -20.608 1.00 0.00 H new ATOM 0 HE2 PHE A 14 7.376 13.115 -18.116 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.216 14.360 -20.069 1.00 0.00 H new ATOM 222 N ILE A 15 5.055 15.503 -14.349 1.00 0.00 N ATOM 223 CA ILE A 15 5.689 14.630 -13.369 1.00 0.00 C ATOM 224 C ILE A 15 6.106 13.307 -14.001 1.00 0.00 C ATOM 225 O ILE A 15 5.392 12.753 -14.837 1.00 0.00 O ATOM 226 CB ILE A 15 4.754 14.346 -12.180 1.00 0.00 C ATOM 227 CG1 ILE A 15 4.792 15.507 -11.184 1.00 0.00 C ATOM 228 CG2 ILE A 15 5.144 13.043 -11.498 1.00 0.00 C ATOM 229 CD1 ILE A 15 6.105 15.622 -10.440 1.00 0.00 C ATOM 0 H ILE A 15 4.102 15.237 -14.598 1.00 0.00 H new ATOM 0 HA ILE A 15 6.575 15.152 -13.007 1.00 0.00 H new ATOM 0 HB ILE A 15 3.735 14.246 -12.554 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.603 16.439 -11.717 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.984 15.383 -10.463 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.473 12.856 -10.659 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.070 12.222 -12.212 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.169 13.115 -11.134 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.060 16.466 -9.752 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.287 14.705 -9.879 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.915 15.778 -11.153 1.00 0.00 H new ATOM 241 N PHE A 16 7.267 12.803 -13.595 1.00 0.00 N ATOM 242 CA PHE A 16 7.780 11.543 -14.121 1.00 0.00 C ATOM 243 C PHE A 16 8.052 10.554 -12.991 1.00 0.00 C ATOM 244 O PHE A 16 9.068 10.646 -12.301 1.00 0.00 O ATOM 245 CB PHE A 16 9.060 11.784 -14.923 1.00 0.00 C ATOM 246 CG PHE A 16 9.852 10.533 -15.178 1.00 0.00 C ATOM 247 CD1 PHE A 16 9.278 9.455 -15.831 1.00 0.00 C ATOM 248 CD2 PHE A 16 11.171 10.436 -14.764 1.00 0.00 C ATOM 249 CE1 PHE A 16 10.004 8.303 -16.067 1.00 0.00 C ATOM 250 CE2 PHE A 16 11.902 9.286 -14.997 1.00 0.00 C ATOM 251 CZ PHE A 16 11.318 8.219 -15.650 1.00 0.00 C ATOM 0 H PHE A 16 7.870 13.248 -12.903 1.00 0.00 H new ATOM 0 HA PHE A 16 7.023 11.117 -14.779 1.00 0.00 H new ATOM 0 HB2 PHE A 16 8.800 12.241 -15.878 1.00 0.00 H new ATOM 0 HB3 PHE A 16 9.686 12.498 -14.388 1.00 0.00 H new ATOM 0 HD1 PHE A 16 8.251 9.515 -16.160 1.00 0.00 H new ATOM 0 HD2 PHE A 16 11.633 11.268 -14.254 1.00 0.00 H new ATOM 0 HE1 PHE A 16 9.544 7.469 -16.577 1.00 0.00 H new ATOM 0 HE2 PHE A 16 12.929 9.222 -14.669 1.00 0.00 H new ATOM 0 HZ PHE A 16 11.888 7.320 -15.834 1.00 0.00 H new ATOM 261 N LEU A 17 7.138 9.607 -12.809 1.00 0.00 N ATOM 262 CA LEU A 17 7.278 8.600 -11.763 1.00 0.00 C ATOM 263 C LEU A 17 7.813 7.291 -12.336 1.00 0.00 C ATOM 264 O LEU A 17 7.228 6.718 -13.256 1.00 0.00 O ATOM 265 CB LEU A 17 5.932 8.357 -11.078 1.00 0.00 C ATOM 266 CG LEU A 17 5.867 7.159 -10.131 1.00 0.00 C ATOM 267 CD1 LEU A 17 5.633 5.874 -10.910 1.00 0.00 C ATOM 268 CD2 LEU A 17 7.143 7.061 -9.307 1.00 0.00 C ATOM 0 H LEU A 17 6.292 9.516 -13.372 1.00 0.00 H new ATOM 0 HA LEU A 17 7.991 8.972 -11.028 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.666 9.253 -10.517 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.173 8.226 -11.849 1.00 0.00 H new ATOM 0 HG LEU A 17 5.028 7.304 -9.450 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.590 5.032 -10.219 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.692 5.945 -11.455 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.450 5.722 -11.616 1.00 0.00 H new ATOM 0 HD21 LEU A 17 7.079 6.203 -8.638 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.998 6.940 -9.973 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.267 7.970 -8.719 1.00 0.00 H new ATOM 280 N LYS A 18 8.927 6.822 -11.785 1.00 0.00 N ATOM 281 CA LYS A 18 9.540 5.579 -12.237 1.00 0.00 C ATOM 282 C LYS A 18 9.394 4.485 -11.184 1.00 0.00 C ATOM 283 O LYS A 18 9.504 4.746 -9.986 1.00 0.00 O ATOM 284 CB LYS A 18 11.021 5.802 -12.553 1.00 0.00 C ATOM 285 CG LYS A 18 11.927 5.675 -11.341 1.00 0.00 C ATOM 286 CD LYS A 18 13.374 5.981 -11.692 1.00 0.00 C ATOM 287 CE LYS A 18 13.550 7.431 -12.115 1.00 0.00 C ATOM 288 NZ LYS A 18 14.890 7.960 -11.738 1.00 0.00 N ATOM 0 H LYS A 18 9.424 7.285 -11.024 1.00 0.00 H new ATOM 0 HA LYS A 18 9.025 5.258 -13.143 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.335 5.082 -13.308 1.00 0.00 H new ATOM 0 HB3 LYS A 18 11.146 6.794 -12.987 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.589 6.356 -10.560 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.855 4.665 -10.936 1.00 0.00 H new ATOM 0 HD2 LYS A 18 14.010 5.772 -10.832 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.701 5.324 -12.498 1.00 0.00 H new ATOM 0 HE2 LYS A 18 13.417 7.513 -13.194 1.00 0.00 H new ATOM 0 HE3 LYS A 18 12.775 8.041 -11.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 14.971 8.951 -12.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 15.007 7.905 -10.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 15.630 7.394 -12.201 1.00 0.00 H new ATOM 302 N ILE A 19 9.146 3.262 -11.639 1.00 0.00 N ATOM 303 CA ILE A 19 8.987 2.129 -10.736 1.00 0.00 C ATOM 304 C ILE A 19 9.969 1.013 -11.076 1.00 0.00 C ATOM 305 O ILE A 19 10.061 0.580 -12.225 1.00 0.00 O ATOM 306 CB ILE A 19 7.554 1.568 -10.783 1.00 0.00 C ATOM 307 CG1 ILE A 19 6.535 2.709 -10.744 1.00 0.00 C ATOM 308 CG2 ILE A 19 7.323 0.605 -9.628 1.00 0.00 C ATOM 309 CD1 ILE A 19 5.847 2.950 -12.070 1.00 0.00 C ATOM 0 H ILE A 19 9.051 3.030 -12.628 1.00 0.00 H new ATOM 0 HA ILE A 19 9.192 2.496 -9.730 1.00 0.00 H new ATOM 0 HB ILE A 19 7.424 1.021 -11.717 1.00 0.00 H new ATOM 0 HG12 ILE A 19 5.782 2.487 -9.988 1.00 0.00 H new ATOM 0 HG13 ILE A 19 7.038 3.625 -10.433 1.00 0.00 H new ATOM 0 HG21 ILE A 19 6.305 0.217 -9.676 1.00 0.00 H new ATOM 0 HG22 ILE A 19 8.030 -0.222 -9.697 1.00 0.00 H new ATOM 0 HG23 ILE A 19 7.468 1.129 -8.683 1.00 0.00 H new ATOM 0 HD11 ILE A 19 5.139 3.772 -11.968 1.00 0.00 H new ATOM 0 HD12 ILE A 19 6.591 3.203 -12.825 1.00 0.00 H new ATOM 0 HD13 ILE A 19 5.315 2.048 -12.373 1.00 0.00 H new ATOM 321 N PHE A 20 10.701 0.549 -10.068 1.00 0.00 N ATOM 322 CA PHE A 20 11.677 -0.518 -10.259 1.00 0.00 C ATOM 323 C PHE A 20 11.040 -1.885 -10.027 1.00 0.00 C ATOM 324 O PHE A 20 10.554 -2.178 -8.934 1.00 0.00 O ATOM 325 CB PHE A 20 12.863 -0.328 -9.312 1.00 0.00 C ATOM 326 CG PHE A 20 13.464 1.047 -9.371 1.00 0.00 C ATOM 327 CD1 PHE A 20 14.292 1.412 -10.421 1.00 0.00 C ATOM 328 CD2 PHE A 20 13.200 1.975 -8.377 1.00 0.00 C ATOM 329 CE1 PHE A 20 14.846 2.677 -10.478 1.00 0.00 C ATOM 330 CE2 PHE A 20 13.751 3.242 -8.429 1.00 0.00 C ATOM 331 CZ PHE A 20 14.575 3.593 -9.480 1.00 0.00 C ATOM 0 H PHE A 20 10.637 0.895 -9.111 1.00 0.00 H new ATOM 0 HA PHE A 20 12.032 -0.472 -11.289 1.00 0.00 H new ATOM 0 HB2 PHE A 20 12.538 -0.530 -8.291 1.00 0.00 H new ATOM 0 HB3 PHE A 20 13.632 -1.062 -9.554 1.00 0.00 H new ATOM 0 HD1 PHE A 20 14.507 0.700 -11.204 1.00 0.00 H new ATOM 0 HD2 PHE A 20 12.557 1.706 -7.552 1.00 0.00 H new ATOM 0 HE1 PHE A 20 15.490 2.949 -11.301 1.00 0.00 H new ATOM 0 HE2 PHE A 20 13.537 3.957 -7.648 1.00 0.00 H new ATOM 0 HZ PHE A 20 15.007 4.582 -9.522 1.00 0.00 H new ATOM 341 N ILE A 21 11.045 -2.717 -11.063 1.00 0.00 N ATOM 342 CA ILE A 21 10.469 -4.053 -10.973 1.00 0.00 C ATOM 343 C ILE A 21 11.170 -5.019 -11.922 1.00 0.00 C ATOM 344 O ILE A 21 12.011 -4.616 -12.725 1.00 0.00 O ATOM 345 CB ILE A 21 8.962 -4.038 -11.293 1.00 0.00 C ATOM 346 CG1 ILE A 21 8.717 -3.417 -12.669 1.00 0.00 C ATOM 347 CG2 ILE A 21 8.200 -3.278 -10.218 1.00 0.00 C ATOM 348 CD1 ILE A 21 7.655 -4.132 -13.474 1.00 0.00 C ATOM 0 H ILE A 21 11.442 -2.489 -11.975 1.00 0.00 H new ATOM 0 HA ILE A 21 10.611 -4.390 -9.946 1.00 0.00 H new ATOM 0 HB ILE A 21 8.598 -5.065 -11.310 1.00 0.00 H new ATOM 0 HG12 ILE A 21 8.424 -2.375 -12.541 1.00 0.00 H new ATOM 0 HG13 ILE A 21 9.651 -3.419 -13.231 1.00 0.00 H new ATOM 0 HG21 ILE A 21 7.137 -3.276 -10.458 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.353 -3.761 -9.253 1.00 0.00 H new ATOM 0 HG23 ILE A 21 8.563 -2.251 -10.171 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.534 -3.637 -14.438 1.00 0.00 H new ATOM 0 HD12 ILE A 21 7.955 -5.168 -13.633 1.00 0.00 H new ATOM 0 HD13 ILE A 21 6.709 -4.107 -12.932 1.00 0.00 H new ATOM 360 N SER A 22 10.815 -6.296 -11.825 1.00 0.00 N ATOM 361 CA SER A 22 11.411 -7.322 -12.673 1.00 0.00 C ATOM 362 C SER A 22 10.350 -7.998 -13.535 1.00 0.00 C ATOM 363 O SER A 22 9.179 -7.622 -13.506 1.00 0.00 O ATOM 364 CB SER A 22 12.132 -8.366 -11.818 1.00 0.00 C ATOM 365 OG SER A 22 13.441 -7.937 -11.485 1.00 0.00 O ATOM 0 H SER A 22 10.118 -6.645 -11.168 1.00 0.00 H new ATOM 0 HA SER A 22 12.135 -6.840 -13.330 1.00 0.00 H new ATOM 0 HB2 SER A 22 11.563 -8.550 -10.906 1.00 0.00 H new ATOM 0 HB3 SER A 22 12.182 -9.311 -12.358 1.00 0.00 H new ATOM 0 HG SER A 22 13.880 -8.621 -10.937 1.00 0.00 H new ATOM 371 N ASN A 23 10.769 -9.000 -14.301 1.00 0.00 N ATOM 372 CA ASN A 23 9.855 -9.730 -15.172 1.00 0.00 C ATOM 373 C ASN A 23 9.153 -10.849 -14.409 1.00 0.00 C ATOM 374 O ASN A 23 8.429 -11.655 -14.995 1.00 0.00 O ATOM 375 CB ASN A 23 10.612 -10.311 -16.368 1.00 0.00 C ATOM 376 CG ASN A 23 11.844 -11.092 -15.949 1.00 0.00 C ATOM 377 OD1 ASN A 23 11.742 -12.217 -15.460 1.00 0.00 O ATOM 378 ND2 ASN A 23 13.015 -10.495 -16.139 1.00 0.00 N ATOM 0 H ASN A 23 11.735 -9.325 -14.336 1.00 0.00 H new ATOM 0 HA ASN A 23 9.100 -9.031 -15.532 1.00 0.00 H new ATOM 0 HB2 ASN A 23 9.947 -10.963 -16.934 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.908 -9.502 -17.035 1.00 0.00 H new ATOM 0 HD21 ASN A 23 13.878 -10.970 -15.876 1.00 0.00 H new ATOM 0 HD22 ASN A 23 13.051 -9.561 -16.548 1.00 0.00 H new ATOM 385 N ILE A 24 9.371 -10.892 -13.099 1.00 0.00 N ATOM 386 CA ILE A 24 8.758 -11.910 -12.255 1.00 0.00 C ATOM 387 C ILE A 24 7.251 -11.976 -12.480 1.00 0.00 C ATOM 388 O ILE A 24 6.672 -13.059 -12.560 1.00 0.00 O ATOM 389 CB ILE A 24 9.032 -11.644 -10.763 1.00 0.00 C ATOM 390 CG1 ILE A 24 8.855 -10.158 -10.446 1.00 0.00 C ATOM 391 CG2 ILE A 24 10.432 -12.108 -10.391 1.00 0.00 C ATOM 392 CD1 ILE A 24 7.876 -9.891 -9.324 1.00 0.00 C ATOM 0 H ILE A 24 9.968 -10.233 -12.599 1.00 0.00 H new ATOM 0 HA ILE A 24 9.207 -12.863 -12.534 1.00 0.00 H new ATOM 0 HB ILE A 24 8.313 -12.210 -10.170 1.00 0.00 H new ATOM 0 HG12 ILE A 24 9.823 -9.734 -10.181 1.00 0.00 H new ATOM 0 HG13 ILE A 24 8.516 -9.641 -11.344 1.00 0.00 H new ATOM 0 HG21 ILE A 24 10.611 -11.913 -9.334 1.00 0.00 H new ATOM 0 HG22 ILE A 24 10.524 -13.177 -10.584 1.00 0.00 H new ATOM 0 HG23 ILE A 24 11.165 -11.567 -10.989 1.00 0.00 H new ATOM 0 HD11 ILE A 24 7.801 -8.817 -9.154 1.00 0.00 H new ATOM 0 HD12 ILE A 24 6.896 -10.285 -9.595 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.224 -10.379 -8.413 1.00 0.00 H new ATOM 404 N ARG A 25 6.622 -10.809 -12.584 1.00 0.00 N ATOM 405 CA ARG A 25 5.183 -10.734 -12.800 1.00 0.00 C ATOM 406 C ARG A 25 4.837 -9.604 -13.766 1.00 0.00 C ATOM 407 O ARG A 25 4.792 -8.436 -13.380 1.00 0.00 O ATOM 408 CB ARG A 25 4.456 -10.524 -11.471 1.00 0.00 C ATOM 409 CG ARG A 25 4.933 -11.449 -10.363 1.00 0.00 C ATOM 410 CD ARG A 25 4.565 -12.896 -10.648 1.00 0.00 C ATOM 411 NE ARG A 25 3.665 -13.442 -9.635 1.00 0.00 N ATOM 412 CZ ARG A 25 3.365 -14.732 -9.537 1.00 0.00 C ATOM 413 NH1 ARG A 25 3.892 -15.605 -10.384 1.00 0.00 N ATOM 414 NH2 ARG A 25 2.538 -15.152 -8.588 1.00 0.00 N ATOM 0 H ARG A 25 7.087 -9.903 -12.522 1.00 0.00 H new ATOM 0 HA ARG A 25 4.857 -11.677 -13.239 1.00 0.00 H new ATOM 0 HB2 ARG A 25 4.590 -9.490 -11.153 1.00 0.00 H new ATOM 0 HB3 ARG A 25 3.387 -10.674 -11.623 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.014 -11.362 -10.255 1.00 0.00 H new ATOM 0 HG3 ARG A 25 4.492 -11.140 -9.415 1.00 0.00 H new ATOM 0 HD2 ARG A 25 4.092 -12.963 -11.628 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.472 -13.499 -10.690 1.00 0.00 H new ATOM 0 HE ARG A 25 3.244 -12.797 -8.966 1.00 0.00 H new ATOM 0 HH11 ARG A 25 4.530 -15.287 -11.114 1.00 0.00 H new ATOM 0 HH12 ARG A 25 3.660 -16.595 -10.306 1.00 0.00 H new ATOM 0 HH21 ARG A 25 2.132 -14.484 -7.933 1.00 0.00 H new ATOM 0 HH22 ARG A 25 2.308 -16.143 -8.514 1.00 0.00 H new ATOM 428 N PHE A 26 4.593 -9.961 -15.023 1.00 0.00 N ATOM 429 CA PHE A 26 4.253 -8.977 -16.044 1.00 0.00 C ATOM 430 C PHE A 26 3.463 -9.623 -17.179 1.00 0.00 C ATOM 431 O PHE A 26 4.041 -10.162 -18.123 1.00 0.00 O ATOM 432 CB PHE A 26 5.521 -8.324 -16.597 1.00 0.00 C ATOM 433 CG PHE A 26 5.319 -6.905 -17.046 1.00 0.00 C ATOM 434 CD1 PHE A 26 5.189 -5.883 -16.119 1.00 0.00 C ATOM 435 CD2 PHE A 26 5.258 -6.593 -18.394 1.00 0.00 C ATOM 436 CE1 PHE A 26 5.002 -4.577 -16.529 1.00 0.00 C ATOM 437 CE2 PHE A 26 5.072 -5.288 -18.810 1.00 0.00 C ATOM 438 CZ PHE A 26 4.943 -4.279 -17.876 1.00 0.00 C ATOM 0 H PHE A 26 4.624 -10.924 -15.359 1.00 0.00 H new ATOM 0 HA PHE A 26 3.631 -8.210 -15.582 1.00 0.00 H new ATOM 0 HB2 PHE A 26 6.296 -8.347 -15.830 1.00 0.00 H new ATOM 0 HB3 PHE A 26 5.887 -8.914 -17.438 1.00 0.00 H new ATOM 0 HD1 PHE A 26 5.234 -6.110 -15.064 1.00 0.00 H new ATOM 0 HD2 PHE A 26 5.357 -7.378 -19.129 1.00 0.00 H new ATOM 0 HE1 PHE A 26 4.902 -3.790 -15.796 1.00 0.00 H new ATOM 0 HE2 PHE A 26 5.028 -5.058 -19.864 1.00 0.00 H new ATOM 0 HZ PHE A 26 4.796 -3.259 -18.198 1.00 0.00 H new ATOM 448 N SER A 27 2.139 -9.564 -17.080 1.00 0.00 N ATOM 449 CA SER A 27 1.270 -10.146 -18.095 1.00 0.00 C ATOM 450 C SER A 27 0.841 -9.093 -19.112 1.00 0.00 C ATOM 451 O SER A 27 0.376 -9.420 -20.203 1.00 0.00 O ATOM 452 CB SER A 27 0.036 -10.773 -17.442 1.00 0.00 C ATOM 453 OG SER A 27 0.405 -11.790 -16.527 1.00 0.00 O ATOM 0 H SER A 27 1.645 -9.119 -16.307 1.00 0.00 H new ATOM 0 HA SER A 27 1.831 -10.922 -18.616 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.536 -10.003 -16.924 1.00 0.00 H new ATOM 0 HB3 SER A 27 -0.614 -11.190 -18.211 1.00 0.00 H new ATOM 0 HG SER A 27 -0.401 -12.174 -16.122 1.00 0.00 H new ATOM 459 N ALA A 28 1.001 -7.825 -18.745 1.00 0.00 N ATOM 460 CA ALA A 28 0.633 -6.723 -19.624 1.00 0.00 C ATOM 461 C ALA A 28 -0.851 -6.771 -19.973 1.00 0.00 C ATOM 462 O ALA A 28 -1.273 -6.257 -21.009 1.00 0.00 O ATOM 463 CB ALA A 28 1.475 -6.754 -20.891 1.00 0.00 C ATOM 0 H ALA A 28 1.383 -7.536 -17.844 1.00 0.00 H new ATOM 0 HA ALA A 28 0.826 -5.790 -19.095 1.00 0.00 H new ATOM 0 HB1 ALA A 28 1.189 -5.925 -21.538 1.00 0.00 H new ATOM 0 HB2 ALA A 28 2.529 -6.663 -20.630 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.311 -7.696 -21.414 1.00 0.00 H new ATOM 469 N VAL A 29 -1.640 -7.392 -19.101 1.00 0.00 N ATOM 470 CA VAL A 29 -3.077 -7.506 -19.317 1.00 0.00 C ATOM 471 C VAL A 29 -3.856 -6.792 -18.218 1.00 0.00 C ATOM 472 O VAL A 29 -5.084 -6.852 -18.174 1.00 0.00 O ATOM 473 CB VAL A 29 -3.521 -8.980 -19.370 1.00 0.00 C ATOM 474 CG1 VAL A 29 -2.940 -9.669 -20.596 1.00 0.00 C ATOM 475 CG2 VAL A 29 -3.112 -9.706 -18.097 1.00 0.00 C ATOM 0 H VAL A 29 -1.308 -7.824 -18.239 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.291 -7.034 -20.276 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.608 -9.011 -19.446 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.264 -10.709 -20.617 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -3.287 -9.163 -21.497 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -1.852 -9.629 -20.554 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.434 -10.746 -18.152 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -2.028 -9.667 -17.988 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.581 -9.226 -17.238 1.00 0.00 H new ATOM 485 N GLY A 30 -3.133 -6.114 -17.332 1.00 0.00 N ATOM 486 CA GLY A 30 -3.773 -5.397 -16.245 1.00 0.00 C ATOM 487 C GLY A 30 -3.176 -4.021 -16.027 1.00 0.00 C ATOM 488 O GLY A 30 -3.527 -3.328 -15.071 1.00 0.00 O ATOM 0 H GLY A 30 -2.115 -6.049 -17.348 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -4.838 -5.298 -16.456 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -3.683 -5.978 -15.327 1.00 0.00 H new ATOM 492 N LEU A 31 -2.269 -3.625 -16.913 1.00 0.00 N ATOM 493 CA LEU A 31 -1.619 -2.322 -16.812 1.00 0.00 C ATOM 494 C LEU A 31 -2.606 -1.197 -17.107 1.00 0.00 C ATOM 495 O LEU A 31 -3.101 -1.071 -18.227 1.00 0.00 O ATOM 496 CB LEU A 31 -0.436 -2.245 -17.779 1.00 0.00 C ATOM 497 CG LEU A 31 0.387 -3.524 -17.937 1.00 0.00 C ATOM 498 CD1 LEU A 31 1.596 -3.274 -18.825 1.00 0.00 C ATOM 499 CD2 LEU A 31 0.822 -4.049 -16.576 1.00 0.00 C ATOM 0 H LEU A 31 -1.967 -4.187 -17.709 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.255 -2.202 -15.792 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.813 -1.956 -18.760 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.229 -1.448 -17.445 1.00 0.00 H new ATOM 0 HG LEU A 31 -0.238 -4.280 -18.413 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.170 -4.195 -18.926 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.263 -2.944 -19.809 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.223 -2.503 -18.377 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.407 -4.960 -16.707 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.430 -3.297 -16.073 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.059 -4.267 -15.972 1.00 0.00 H new ATOM 511 N GLU A 32 -2.886 -0.382 -16.095 1.00 0.00 N ATOM 512 CA GLU A 32 -3.813 0.734 -16.247 1.00 0.00 C ATOM 513 C GLU A 32 -3.698 1.700 -15.072 1.00 0.00 C ATOM 514 O GLU A 32 -4.448 1.604 -14.100 1.00 0.00 O ATOM 515 CB GLU A 32 -5.249 0.220 -16.361 1.00 0.00 C ATOM 516 CG GLU A 32 -6.178 1.169 -17.100 1.00 0.00 C ATOM 517 CD GLU A 32 -7.614 0.680 -17.122 1.00 0.00 C ATOM 518 OE1 GLU A 32 -8.364 1.001 -16.177 1.00 0.00 O ATOM 519 OE2 GLU A 32 -7.986 -0.022 -18.085 1.00 0.00 O ATOM 0 H GLU A 32 -2.485 -0.473 -15.162 1.00 0.00 H new ATOM 0 HA GLU A 32 -3.553 1.268 -17.161 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -5.242 -0.742 -16.874 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -5.644 0.044 -15.360 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -6.139 2.151 -16.628 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -5.825 1.294 -18.124 1.00 0.00 H new ATOM 526 N ILE A 33 -2.754 2.630 -15.169 1.00 0.00 N ATOM 527 CA ILE A 33 -2.541 3.614 -14.115 1.00 0.00 C ATOM 528 C ILE A 33 -3.377 4.867 -14.355 1.00 0.00 C ATOM 529 O ILE A 33 -3.374 5.426 -15.453 1.00 0.00 O ATOM 530 CB ILE A 33 -1.057 4.014 -14.008 1.00 0.00 C ATOM 531 CG1 ILE A 33 -0.201 2.792 -13.669 1.00 0.00 C ATOM 532 CG2 ILE A 33 -0.876 5.102 -12.961 1.00 0.00 C ATOM 533 CD1 ILE A 33 1.285 3.073 -13.681 1.00 0.00 C ATOM 0 H ILE A 33 -2.125 2.723 -15.966 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.851 3.146 -13.181 1.00 0.00 H new ATOM 0 HB ILE A 33 -0.731 4.407 -14.971 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.485 2.422 -12.684 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.418 1.997 -14.383 1.00 0.00 H new ATOM 0 HG21 ILE A 33 0.178 5.374 -12.897 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.460 5.978 -13.242 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -1.215 4.735 -11.992 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.830 2.162 -13.432 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.583 3.414 -14.672 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.515 3.845 -12.947 1.00 0.00 H new ATOM 545 N ILE A 34 -4.089 5.304 -13.322 1.00 0.00 N ATOM 546 CA ILE A 34 -4.927 6.492 -13.421 1.00 0.00 C ATOM 547 C ILE A 34 -4.594 7.493 -12.319 1.00 0.00 C ATOM 548 O ILE A 34 -4.126 7.115 -11.245 1.00 0.00 O ATOM 549 CB ILE A 34 -6.423 6.135 -13.339 1.00 0.00 C ATOM 550 CG1 ILE A 34 -6.784 5.678 -11.924 1.00 0.00 C ATOM 551 CG2 ILE A 34 -6.766 5.054 -14.354 1.00 0.00 C ATOM 552 CD1 ILE A 34 -7.562 6.710 -11.137 1.00 0.00 C ATOM 0 H ILE A 34 -4.102 4.853 -12.407 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.722 6.942 -14.392 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.007 7.025 -13.573 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.371 4.761 -11.985 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -5.869 5.435 -11.384 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.827 4.812 -14.284 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.541 5.413 -15.358 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -6.176 4.161 -14.148 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.784 6.319 -10.144 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.969 7.620 -11.045 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.494 6.935 -11.655 1.00 0.00 H new ATOM 564 N ILE A 35 -4.841 8.769 -12.593 1.00 0.00 N ATOM 565 CA ILE A 35 -4.570 9.824 -11.623 1.00 0.00 C ATOM 566 C ILE A 35 -5.863 10.356 -11.014 1.00 0.00 C ATOM 567 O ILE A 35 -6.806 10.690 -11.731 1.00 0.00 O ATOM 568 CB ILE A 35 -3.798 10.993 -12.264 1.00 0.00 C ATOM 569 CG1 ILE A 35 -2.498 10.489 -12.895 1.00 0.00 C ATOM 570 CG2 ILE A 35 -3.509 12.068 -11.227 1.00 0.00 C ATOM 571 CD1 ILE A 35 -2.495 10.555 -14.406 1.00 0.00 C ATOM 0 H ILE A 35 -5.228 9.098 -13.478 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.957 9.381 -10.838 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.415 11.430 -13.049 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.665 11.079 -12.512 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.328 9.458 -12.584 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -2.963 12.887 -11.695 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.448 12.443 -10.820 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.908 11.645 -10.422 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.543 10.182 -14.785 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -3.307 9.942 -14.799 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.633 11.588 -14.725 1.00 0.00 H new ATOM 583 N GLN A 36 -5.897 10.433 -9.688 1.00 0.00 N ATOM 584 CA GLN A 36 -7.074 10.926 -8.982 1.00 0.00 C ATOM 585 C GLN A 36 -7.170 12.445 -9.078 1.00 0.00 C ATOM 586 O GLN A 36 -6.409 13.079 -9.809 1.00 0.00 O ATOM 587 CB GLN A 36 -7.032 10.498 -7.514 1.00 0.00 C ATOM 588 CG GLN A 36 -8.105 9.487 -7.144 1.00 0.00 C ATOM 589 CD GLN A 36 -9.507 10.014 -7.374 1.00 0.00 C ATOM 590 OE1 GLN A 36 -9.794 11.184 -7.114 1.00 0.00 O ATOM 591 NE2 GLN A 36 -10.392 9.153 -7.863 1.00 0.00 N ATOM 0 H GLN A 36 -5.124 10.161 -9.081 1.00 0.00 H new ATOM 0 HA GLN A 36 -7.956 10.494 -9.454 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -6.053 10.072 -7.296 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.143 11.380 -6.884 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -7.961 8.579 -7.730 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -7.992 9.210 -6.096 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -10.112 8.193 -8.064 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -11.352 9.452 -8.037 1.00 0.00 H new ATOM 600 N GLU A 37 -8.109 13.022 -8.336 1.00 0.00 N ATOM 601 CA GLU A 37 -8.305 14.467 -8.340 1.00 0.00 C ATOM 602 C GLU A 37 -6.982 15.196 -8.119 1.00 0.00 C ATOM 603 O GLU A 37 -6.750 16.266 -8.678 1.00 0.00 O ATOM 604 CB GLU A 37 -9.308 14.872 -7.258 1.00 0.00 C ATOM 605 CG GLU A 37 -9.091 14.164 -5.931 1.00 0.00 C ATOM 606 CD GLU A 37 -9.430 15.040 -4.740 1.00 0.00 C ATOM 607 OE1 GLU A 37 -10.017 16.123 -4.949 1.00 0.00 O ATOM 608 OE2 GLU A 37 -9.108 14.644 -3.601 1.00 0.00 O ATOM 0 H GLU A 37 -8.746 12.511 -7.724 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.699 14.751 -9.316 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -9.245 15.949 -7.100 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -10.317 14.661 -7.612 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.703 13.263 -5.900 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -8.051 13.846 -5.859 1.00 0.00 H new ATOM 615 N ASN A 38 -6.118 14.606 -7.299 1.00 0.00 N ATOM 616 CA ASN A 38 -4.818 15.198 -7.003 1.00 0.00 C ATOM 617 C ASN A 38 -3.737 14.125 -6.924 1.00 0.00 C ATOM 618 O ASN A 38 -2.694 14.233 -7.568 1.00 0.00 O ATOM 619 CB ASN A 38 -4.877 15.976 -5.687 1.00 0.00 C ATOM 620 CG ASN A 38 -5.422 15.141 -4.545 1.00 0.00 C ATOM 621 OD1 ASN A 38 -6.631 14.941 -4.429 1.00 0.00 O ATOM 622 ND2 ASN A 38 -4.529 14.648 -3.695 1.00 0.00 N ATOM 0 H ASN A 38 -6.294 13.719 -6.828 1.00 0.00 H new ATOM 0 HA ASN A 38 -4.566 15.884 -7.812 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -3.878 16.328 -5.431 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -5.502 16.859 -5.818 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -4.836 14.078 -2.907 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -3.536 14.840 -3.830 1.00 0.00 H new ATOM 629 N MET A 39 -3.994 13.090 -6.131 1.00 0.00 N ATOM 630 CA MET A 39 -3.043 11.997 -5.969 1.00 0.00 C ATOM 631 C MET A 39 -3.050 11.086 -7.193 1.00 0.00 C ATOM 632 O MET A 39 -3.869 11.251 -8.097 1.00 0.00 O ATOM 633 CB MET A 39 -3.373 11.187 -4.714 1.00 0.00 C ATOM 634 CG MET A 39 -4.221 9.956 -4.991 1.00 0.00 C ATOM 635 SD MET A 39 -4.902 9.230 -3.487 1.00 0.00 S ATOM 636 CE MET A 39 -3.435 9.130 -2.464 1.00 0.00 C ATOM 0 H MET A 39 -4.853 12.985 -5.591 1.00 0.00 H new ATOM 0 HA MET A 39 -2.047 12.427 -5.863 1.00 0.00 H new ATOM 0 HB2 MET A 39 -2.443 10.878 -4.236 1.00 0.00 H new ATOM 0 HB3 MET A 39 -3.898 11.828 -4.005 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.037 10.225 -5.662 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.616 9.211 -5.508 1.00 0.00 H new ATOM 0 HE1 MET A 39 -3.667 8.588 -1.547 1.00 0.00 H new ATOM 0 HE2 MET A 39 -2.648 8.606 -3.006 1.00 0.00 H new ATOM 0 HE3 MET A 39 -3.096 10.136 -2.215 1.00 0.00 H new ATOM 646 N ILE A 40 -2.132 10.125 -7.214 1.00 0.00 N ATOM 647 CA ILE A 40 -2.034 9.188 -8.326 1.00 0.00 C ATOM 648 C ILE A 40 -2.241 7.752 -7.856 1.00 0.00 C ATOM 649 O ILE A 40 -1.734 7.353 -6.807 1.00 0.00 O ATOM 650 CB ILE A 40 -0.669 9.293 -9.032 1.00 0.00 C ATOM 651 CG1 ILE A 40 -0.468 10.701 -9.595 1.00 0.00 C ATOM 652 CG2 ILE A 40 -0.564 8.254 -10.139 1.00 0.00 C ATOM 653 CD1 ILE A 40 0.793 10.850 -10.416 1.00 0.00 C ATOM 0 H ILE A 40 -1.446 9.975 -6.474 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.821 9.454 -9.032 1.00 0.00 H new ATOM 0 HB ILE A 40 0.117 9.099 -8.302 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -1.327 10.962 -10.213 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.441 11.413 -8.770 1.00 0.00 H new ATOM 0 HG21 ILE A 40 0.406 8.341 -10.629 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.667 7.256 -9.713 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.355 8.420 -10.870 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.870 11.874 -10.783 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.660 10.621 -9.796 1.00 0.00 H new ATOM 0 HD13 ILE A 40 0.760 10.163 -11.262 1.00 0.00 H new ATOM 665 N ILE A 41 -2.987 6.981 -8.639 1.00 0.00 N ATOM 666 CA ILE A 41 -3.259 5.588 -8.304 1.00 0.00 C ATOM 667 C ILE A 41 -2.490 4.642 -9.220 1.00 0.00 C ATOM 668 O ILE A 41 -2.670 4.657 -10.438 1.00 0.00 O ATOM 669 CB ILE A 41 -4.762 5.269 -8.400 1.00 0.00 C ATOM 670 CG1 ILE A 41 -5.561 6.184 -7.471 1.00 0.00 C ATOM 671 CG2 ILE A 41 -5.016 3.808 -8.060 1.00 0.00 C ATOM 672 CD1 ILE A 41 -5.119 6.112 -6.026 1.00 0.00 C ATOM 0 H ILE A 41 -3.414 7.297 -9.510 1.00 0.00 H new ATOM 0 HA ILE A 41 -2.930 5.441 -7.275 1.00 0.00 H new ATOM 0 HB ILE A 41 -5.091 5.446 -9.424 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -5.469 7.213 -7.820 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -6.617 5.919 -7.533 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -6.083 3.598 -8.132 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -4.473 3.172 -8.759 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -4.674 3.606 -7.045 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -5.729 6.786 -5.425 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -5.237 5.092 -5.660 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.072 6.405 -5.951 1.00 0.00 H new ATOM 684 N PHE A 42 -1.632 3.819 -8.626 1.00 0.00 N ATOM 685 CA PHE A 42 -0.835 2.865 -9.388 1.00 0.00 C ATOM 686 C PHE A 42 -1.468 1.477 -9.352 1.00 0.00 C ATOM 687 O PHE A 42 -1.381 0.768 -8.348 1.00 0.00 O ATOM 688 CB PHE A 42 0.590 2.802 -8.835 1.00 0.00 C ATOM 689 CG PHE A 42 1.427 1.720 -9.456 1.00 0.00 C ATOM 690 CD1 PHE A 42 2.119 1.951 -10.633 1.00 0.00 C ATOM 691 CD2 PHE A 42 1.520 0.472 -8.861 1.00 0.00 C ATOM 692 CE1 PHE A 42 2.889 0.956 -11.206 1.00 0.00 C ATOM 693 CE2 PHE A 42 2.289 -0.526 -9.429 1.00 0.00 C ATOM 694 CZ PHE A 42 2.975 -0.284 -10.603 1.00 0.00 C ATOM 0 H PHE A 42 -1.471 3.794 -7.619 1.00 0.00 H new ATOM 0 HA PHE A 42 -0.801 3.203 -10.424 1.00 0.00 H new ATOM 0 HB2 PHE A 42 1.076 3.764 -8.996 1.00 0.00 H new ATOM 0 HB3 PHE A 42 0.546 2.643 -7.758 1.00 0.00 H new ATOM 0 HD1 PHE A 42 2.057 2.919 -11.108 1.00 0.00 H new ATOM 0 HD2 PHE A 42 0.985 0.277 -7.943 1.00 0.00 H new ATOM 0 HE1 PHE A 42 3.423 1.148 -12.125 1.00 0.00 H new ATOM 0 HE2 PHE A 42 2.353 -1.494 -8.955 1.00 0.00 H new ATOM 0 HZ PHE A 42 3.577 -1.062 -11.048 1.00 0.00 H new ATOM 704 N HIS A 43 -2.106 1.095 -10.454 1.00 0.00 N ATOM 705 CA HIS A 43 -2.754 -0.208 -10.549 1.00 0.00 C ATOM 706 C HIS A 43 -1.892 -1.186 -11.342 1.00 0.00 C ATOM 707 O HIS A 43 -2.082 -2.401 -11.264 1.00 0.00 O ATOM 708 CB HIS A 43 -4.127 -0.071 -11.207 1.00 0.00 C ATOM 709 CG HIS A 43 -5.166 -0.976 -10.619 1.00 0.00 C ATOM 710 ND1 HIS A 43 -6.509 -0.870 -10.911 1.00 0.00 N ATOM 711 CD2 HIS A 43 -5.051 -2.010 -9.753 1.00 0.00 C ATOM 712 CE1 HIS A 43 -7.177 -1.797 -10.248 1.00 0.00 C ATOM 713 NE2 HIS A 43 -6.315 -2.503 -9.538 1.00 0.00 N ATOM 0 H HIS A 43 -2.188 1.669 -11.293 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.881 -0.598 -9.539 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -4.463 0.962 -11.116 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.033 -0.283 -12.272 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.136 -2.379 -9.313 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.245 -1.951 -10.281 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -6.550 -3.287 -8.929 1.00 0.00 H new ATOM 721 N LEU A 44 -0.946 -0.650 -12.104 1.00 0.00 N ATOM 722 CA LEU A 44 -0.055 -1.476 -12.912 1.00 0.00 C ATOM 723 C LEU A 44 0.556 -2.596 -12.077 1.00 0.00 C ATOM 724 O LEU A 44 0.712 -2.464 -10.863 1.00 0.00 O ATOM 725 CB LEU A 44 1.053 -0.617 -13.524 1.00 0.00 C ATOM 726 CG LEU A 44 1.384 -0.893 -14.991 1.00 0.00 C ATOM 727 CD1 LEU A 44 1.655 0.408 -15.731 1.00 0.00 C ATOM 728 CD2 LEU A 44 2.577 -1.830 -15.102 1.00 0.00 C ATOM 0 H LEU A 44 -0.776 0.353 -12.180 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.642 -1.925 -13.713 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.768 0.431 -13.428 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.960 -0.756 -12.935 1.00 0.00 H new ATOM 0 HG LEU A 44 0.523 -1.377 -15.452 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.889 0.192 -16.773 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.772 1.045 -15.682 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.499 0.921 -15.269 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.798 -2.015 -16.153 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.444 -1.374 -14.624 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.345 -2.774 -14.608 1.00 0.00 H new ATOM 740 N SER A 45 0.903 -3.697 -12.735 1.00 0.00 N ATOM 741 CA SER A 45 1.496 -4.841 -12.053 1.00 0.00 C ATOM 742 C SER A 45 0.534 -5.414 -11.017 1.00 0.00 C ATOM 743 O SER A 45 -0.478 -4.806 -10.669 1.00 0.00 O ATOM 744 CB SER A 45 2.808 -4.436 -11.379 1.00 0.00 C ATOM 745 OG SER A 45 2.690 -4.477 -9.967 1.00 0.00 O ATOM 0 H SER A 45 0.784 -3.821 -13.740 1.00 0.00 H new ATOM 0 HA SER A 45 1.701 -5.610 -12.797 1.00 0.00 H new ATOM 0 HB2 SER A 45 3.607 -5.105 -11.700 1.00 0.00 H new ATOM 0 HB3 SER A 45 3.088 -3.431 -11.695 1.00 0.00 H new ATOM 0 HG SER A 45 3.542 -4.215 -9.560 1.00 0.00 H new ATOM 751 N PRO A 46 0.857 -6.613 -10.510 1.00 0.00 N ATOM 752 CA PRO A 46 0.036 -7.296 -9.506 1.00 0.00 C ATOM 753 C PRO A 46 0.083 -6.601 -8.149 1.00 0.00 C ATOM 754 O PRO A 46 -0.615 -6.995 -7.215 1.00 0.00 O ATOM 755 CB PRO A 46 0.669 -8.687 -9.416 1.00 0.00 C ATOM 756 CG PRO A 46 2.081 -8.489 -9.847 1.00 0.00 C ATOM 757 CD PRO A 46 2.050 -7.395 -10.878 1.00 0.00 C ATOM 0 HA PRO A 46 -1.018 -7.310 -9.783 1.00 0.00 H new ATOM 0 HB2 PRO A 46 0.616 -9.081 -8.401 1.00 0.00 H new ATOM 0 HB3 PRO A 46 0.154 -9.399 -10.061 1.00 0.00 H new ATOM 0 HG2 PRO A 46 2.711 -8.211 -9.002 1.00 0.00 H new ATOM 0 HG3 PRO A 46 2.494 -9.407 -10.265 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.954 -6.787 -10.846 1.00 0.00 H new ATOM 0 HD3 PRO A 46 1.971 -7.797 -11.888 1.00 0.00 H new ATOM 765 N TYR A 47 0.909 -5.565 -8.048 1.00 0.00 N ATOM 766 CA TYR A 47 1.048 -4.817 -6.805 1.00 0.00 C ATOM 767 C TYR A 47 0.420 -3.432 -6.930 1.00 0.00 C ATOM 768 O TYR A 47 0.712 -2.688 -7.866 1.00 0.00 O ATOM 769 CB TYR A 47 2.524 -4.688 -6.425 1.00 0.00 C ATOM 770 CG TYR A 47 3.260 -6.008 -6.399 1.00 0.00 C ATOM 771 CD1 TYR A 47 2.667 -7.146 -5.867 1.00 0.00 C ATOM 772 CD2 TYR A 47 4.549 -6.117 -6.906 1.00 0.00 C ATOM 773 CE1 TYR A 47 3.336 -8.355 -5.841 1.00 0.00 C ATOM 774 CE2 TYR A 47 5.225 -7.322 -6.885 1.00 0.00 C ATOM 775 CZ TYR A 47 4.615 -8.437 -6.351 1.00 0.00 C ATOM 776 OH TYR A 47 5.285 -9.639 -6.328 1.00 0.00 O ATOM 0 H TYR A 47 1.492 -5.225 -8.812 1.00 0.00 H new ATOM 0 HA TYR A 47 0.525 -5.364 -6.021 1.00 0.00 H new ATOM 0 HB2 TYR A 47 3.016 -4.021 -7.133 1.00 0.00 H new ATOM 0 HB3 TYR A 47 2.598 -4.221 -5.443 1.00 0.00 H new ATOM 0 HD1 TYR A 47 1.666 -7.085 -5.467 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.031 -5.245 -7.324 1.00 0.00 H new ATOM 0 HE1 TYR A 47 2.860 -9.230 -5.424 1.00 0.00 H new ATOM 0 HE2 TYR A 47 6.226 -7.390 -7.285 1.00 0.00 H new ATOM 0 HH TYR A 47 6.173 -9.526 -6.726 1.00 0.00 H new ATOM 786 N TYR A 48 -0.443 -3.093 -5.979 1.00 0.00 N ATOM 787 CA TYR A 48 -1.114 -1.799 -5.981 1.00 0.00 C ATOM 788 C TYR A 48 -0.370 -0.797 -5.104 1.00 0.00 C ATOM 789 O TYR A 48 -0.046 -1.084 -3.951 1.00 0.00 O ATOM 790 CB TYR A 48 -2.556 -1.947 -5.494 1.00 0.00 C ATOM 791 CG TYR A 48 -3.318 -0.642 -5.448 1.00 0.00 C ATOM 792 CD1 TYR A 48 -3.213 0.208 -4.353 1.00 0.00 C ATOM 793 CD2 TYR A 48 -4.141 -0.257 -6.499 1.00 0.00 C ATOM 794 CE1 TYR A 48 -3.907 1.401 -4.306 1.00 0.00 C ATOM 795 CE2 TYR A 48 -4.838 0.935 -6.461 1.00 0.00 C ATOM 796 CZ TYR A 48 -4.718 1.760 -5.363 1.00 0.00 C ATOM 797 OH TYR A 48 -5.410 2.949 -5.320 1.00 0.00 O ATOM 0 H TYR A 48 -0.694 -3.697 -5.196 1.00 0.00 H new ATOM 0 HA TYR A 48 -1.120 -1.424 -7.005 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -3.082 -2.642 -6.149 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -2.550 -2.390 -4.498 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -2.578 -0.069 -3.525 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -4.238 -0.901 -7.361 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -3.816 2.049 -3.447 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -5.473 1.219 -7.287 1.00 0.00 H new ATOM 0 HH TYR A 48 -6.308 2.818 -5.690 1.00 0.00 H new ATOM 807 N LEU A 49 -0.102 0.380 -5.658 1.00 0.00 N ATOM 808 CA LEU A 49 0.604 1.427 -4.927 1.00 0.00 C ATOM 809 C LEU A 49 -0.158 2.746 -4.994 1.00 0.00 C ATOM 810 O LEU A 49 -0.828 3.038 -5.984 1.00 0.00 O ATOM 811 CB LEU A 49 2.014 1.610 -5.493 1.00 0.00 C ATOM 812 CG LEU A 49 2.915 2.592 -4.744 1.00 0.00 C ATOM 813 CD1 LEU A 49 3.199 2.091 -3.337 1.00 0.00 C ATOM 814 CD2 LEU A 49 4.214 2.811 -5.507 1.00 0.00 C ATOM 0 H LEU A 49 -0.363 0.634 -6.611 1.00 0.00 H new ATOM 0 HA LEU A 49 0.675 1.122 -3.883 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.506 0.637 -5.511 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.928 1.943 -6.527 1.00 0.00 H new ATOM 0 HG LEU A 49 2.395 3.547 -4.668 1.00 0.00 H new ATOM 0 HD11 LEU A 49 3.842 2.803 -2.820 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.261 1.986 -2.792 1.00 0.00 H new ATOM 0 HD13 LEU A 49 3.698 1.123 -3.389 1.00 0.00 H new ATOM 0 HD21 LEU A 49 4.844 3.513 -4.960 1.00 0.00 H new ATOM 0 HD22 LEU A 49 4.738 1.861 -5.614 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.992 3.216 -6.494 1.00 0.00 H new ATOM 826 N ARG A 50 -0.049 3.541 -3.934 1.00 0.00 N ATOM 827 CA ARG A 50 -0.727 4.830 -3.873 1.00 0.00 C ATOM 828 C ARG A 50 0.275 5.962 -3.664 1.00 0.00 C ATOM 829 O ARG A 50 1.130 5.894 -2.779 1.00 0.00 O ATOM 830 CB ARG A 50 -1.760 4.834 -2.745 1.00 0.00 C ATOM 831 CG ARG A 50 -2.830 5.902 -2.902 1.00 0.00 C ATOM 832 CD ARG A 50 -4.225 5.322 -2.728 1.00 0.00 C ATOM 833 NE ARG A 50 -5.129 6.260 -2.067 1.00 0.00 N ATOM 834 CZ ARG A 50 -6.446 6.099 -2.015 1.00 0.00 C ATOM 835 NH1 ARG A 50 -7.011 5.042 -2.581 1.00 0.00 N ATOM 836 NH2 ARG A 50 -7.202 6.996 -1.395 1.00 0.00 N ATOM 0 H ARG A 50 0.502 3.315 -3.106 1.00 0.00 H new ATOM 0 HA ARG A 50 -1.236 4.990 -4.823 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -2.239 3.856 -2.699 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -1.247 4.983 -1.795 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -2.669 6.691 -2.168 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -2.746 6.361 -3.887 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -4.631 5.054 -3.704 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -4.166 4.403 -2.144 1.00 0.00 H new ATOM 0 HE ARG A 50 -4.726 7.084 -1.621 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.434 4.349 -3.058 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -8.023 4.921 -2.539 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -6.772 7.811 -0.957 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -8.214 6.871 -1.356 1.00 0.00 H new ATOM 850 N LEU A 51 0.164 7.002 -4.483 1.00 0.00 N ATOM 851 CA LEU A 51 1.060 8.149 -4.388 1.00 0.00 C ATOM 852 C LEU A 51 0.289 9.415 -4.028 1.00 0.00 C ATOM 853 O LEU A 51 -0.484 9.933 -4.835 1.00 0.00 O ATOM 854 CB LEU A 51 1.805 8.350 -5.709 1.00 0.00 C ATOM 855 CG LEU A 51 2.774 7.238 -6.109 1.00 0.00 C ATOM 856 CD1 LEU A 51 3.535 7.620 -7.369 1.00 0.00 C ATOM 857 CD2 LEU A 51 3.739 6.937 -4.972 1.00 0.00 C ATOM 0 H LEU A 51 -0.537 7.075 -5.220 1.00 0.00 H new ATOM 0 HA LEU A 51 1.783 7.949 -3.597 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.069 8.466 -6.504 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.361 9.286 -5.651 1.00 0.00 H new ATOM 0 HG LEU A 51 2.197 6.337 -6.317 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.220 6.816 -7.638 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.830 7.784 -8.184 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.101 8.534 -7.189 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.421 6.143 -5.275 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.310 7.834 -4.732 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.178 6.618 -4.093 1.00 0.00 H new ATOM 869 N ARG A 52 0.505 9.909 -2.814 1.00 0.00 N ATOM 870 CA ARG A 52 -0.169 11.115 -2.348 1.00 0.00 C ATOM 871 C ARG A 52 0.787 12.304 -2.339 1.00 0.00 C ATOM 872 O ARG A 52 1.649 12.415 -1.466 1.00 0.00 O ATOM 873 CB ARG A 52 -0.740 10.896 -0.946 1.00 0.00 C ATOM 874 CG ARG A 52 -1.919 11.798 -0.621 1.00 0.00 C ATOM 875 CD ARG A 52 -1.462 13.199 -0.247 1.00 0.00 C ATOM 876 NE ARG A 52 -2.555 14.006 0.290 1.00 0.00 N ATOM 877 CZ ARG A 52 -2.370 15.099 1.022 1.00 0.00 C ATOM 878 NH1 ARG A 52 -1.142 15.513 1.303 1.00 0.00 N ATOM 879 NH2 ARG A 52 -3.414 15.780 1.475 1.00 0.00 N ATOM 0 H ARG A 52 1.142 9.493 -2.135 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.986 11.333 -3.036 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -1.051 9.856 -0.848 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.048 11.063 -0.212 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -2.587 11.849 -1.481 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -2.491 11.369 0.202 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -0.662 13.135 0.491 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -1.046 13.691 -1.126 1.00 0.00 H new ATOM 0 HE ARG A 52 -3.512 13.714 0.092 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -0.336 14.992 0.957 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -1.003 16.353 1.865 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -4.360 15.465 1.261 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -3.271 16.619 2.037 1.00 0.00 H new ATOM 893 N PHE A 53 0.630 13.190 -3.317 1.00 0.00 N ATOM 894 CA PHE A 53 1.480 14.370 -3.423 1.00 0.00 C ATOM 895 C PHE A 53 0.811 15.582 -2.781 1.00 0.00 C ATOM 896 O PHE A 53 -0.412 15.659 -2.667 1.00 0.00 O ATOM 897 CB PHE A 53 1.797 14.666 -4.890 1.00 0.00 C ATOM 898 CG PHE A 53 2.415 13.505 -5.616 1.00 0.00 C ATOM 899 CD1 PHE A 53 3.184 12.575 -4.935 1.00 0.00 C ATOM 900 CD2 PHE A 53 2.226 13.343 -6.979 1.00 0.00 C ATOM 901 CE1 PHE A 53 3.754 11.506 -5.600 1.00 0.00 C ATOM 902 CE2 PHE A 53 2.792 12.275 -7.649 1.00 0.00 C ATOM 903 CZ PHE A 53 3.558 11.356 -6.959 1.00 0.00 C ATOM 0 H PHE A 53 -0.078 13.113 -4.047 1.00 0.00 H new ATOM 0 HA PHE A 53 2.410 14.166 -2.891 1.00 0.00 H new ATOM 0 HB2 PHE A 53 0.879 14.956 -5.400 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.474 15.519 -4.942 1.00 0.00 H new ATOM 0 HD1 PHE A 53 3.340 12.687 -3.872 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.630 14.060 -7.524 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.352 10.789 -5.058 1.00 0.00 H new ATOM 0 HE2 PHE A 53 2.635 12.159 -8.711 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.003 10.522 -7.481 1.00 0.00 H new ATOM 913 N PRO A 54 1.632 16.552 -2.351 1.00 0.00 N ATOM 914 CA PRO A 54 1.143 17.778 -1.713 1.00 0.00 C ATOM 915 C PRO A 54 0.418 18.692 -2.694 1.00 0.00 C ATOM 916 O PRO A 54 -0.187 19.689 -2.299 1.00 0.00 O ATOM 917 CB PRO A 54 2.422 18.447 -1.204 1.00 0.00 C ATOM 918 CG PRO A 54 3.500 17.930 -2.093 1.00 0.00 C ATOM 919 CD PRO A 54 3.101 16.526 -2.454 1.00 0.00 C ATOM 0 HA PRO A 54 0.415 17.568 -0.930 1.00 0.00 H new ATOM 0 HB2 PRO A 54 2.350 19.533 -1.260 1.00 0.00 H new ATOM 0 HB3 PRO A 54 2.613 18.194 -0.161 1.00 0.00 H new ATOM 0 HG2 PRO A 54 3.601 18.549 -2.985 1.00 0.00 H new ATOM 0 HG3 PRO A 54 4.464 17.943 -1.585 1.00 0.00 H new ATOM 0 HD2 PRO A 54 3.429 16.261 -3.459 1.00 0.00 H new ATOM 0 HD3 PRO A 54 3.539 15.796 -1.773 1.00 0.00 H new ATOM 927 N HIS A 55 0.481 18.346 -3.976 1.00 0.00 N ATOM 928 CA HIS A 55 -0.171 19.136 -5.015 1.00 0.00 C ATOM 929 C HIS A 55 -1.305 18.348 -5.665 1.00 0.00 C ATOM 930 O HIS A 55 -1.637 17.247 -5.228 1.00 0.00 O ATOM 931 CB HIS A 55 0.844 19.560 -6.076 1.00 0.00 C ATOM 932 CG HIS A 55 1.887 20.505 -5.562 1.00 0.00 C ATOM 933 ND1 HIS A 55 1.737 21.875 -5.582 1.00 0.00 N ATOM 934 CD2 HIS A 55 3.101 20.269 -5.011 1.00 0.00 C ATOM 935 CE1 HIS A 55 2.814 22.441 -5.067 1.00 0.00 C ATOM 936 NE2 HIS A 55 3.657 21.488 -4.712 1.00 0.00 N ATOM 0 H HIS A 55 0.977 17.524 -4.320 1.00 0.00 H new ATOM 0 HA HIS A 55 -0.591 20.027 -4.549 1.00 0.00 H new ATOM 0 HB2 HIS A 55 1.334 18.672 -6.474 1.00 0.00 H new ATOM 0 HB3 HIS A 55 0.316 20.031 -6.905 1.00 0.00 H new ATOM 0 HD2 HIS A 55 3.549 19.301 -4.839 1.00 0.00 H new ATOM 0 HE1 HIS A 55 2.977 23.503 -4.955 1.00 0.00 H new ATOM 0 HE2 HIS A 55 4.572 21.634 -4.285 1.00 0.00 H new ATOM 944 N GLU A 56 -1.894 18.921 -6.710 1.00 0.00 N ATOM 945 CA GLU A 56 -2.991 18.272 -7.418 1.00 0.00 C ATOM 946 C GLU A 56 -2.678 18.146 -8.906 1.00 0.00 C ATOM 947 O GLU A 56 -2.501 19.146 -9.602 1.00 0.00 O ATOM 948 CB GLU A 56 -4.289 19.058 -7.223 1.00 0.00 C ATOM 949 CG GLU A 56 -4.106 20.564 -7.304 1.00 0.00 C ATOM 950 CD GLU A 56 -5.426 21.310 -7.358 1.00 0.00 C ATOM 951 OE1 GLU A 56 -6.480 20.646 -7.437 1.00 0.00 O ATOM 952 OE2 GLU A 56 -5.403 22.558 -7.322 1.00 0.00 O ATOM 0 H GLU A 56 -1.630 19.832 -7.085 1.00 0.00 H new ATOM 0 HA GLU A 56 -3.116 17.271 -7.004 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.010 18.747 -7.979 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.716 18.804 -6.253 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -3.536 20.904 -6.439 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -3.519 20.808 -8.189 1.00 0.00 H new ATOM 959 N LEU A 57 -2.612 16.909 -9.388 1.00 0.00 N ATOM 960 CA LEU A 57 -2.320 16.650 -10.794 1.00 0.00 C ATOM 961 C LEU A 57 -3.607 16.469 -11.592 1.00 0.00 C ATOM 962 O LEU A 57 -4.706 16.631 -11.062 1.00 0.00 O ATOM 963 CB LEU A 57 -1.442 15.406 -10.932 1.00 0.00 C ATOM 964 CG LEU A 57 -0.224 15.339 -10.010 1.00 0.00 C ATOM 965 CD1 LEU A 57 0.024 13.908 -9.556 1.00 0.00 C ATOM 966 CD2 LEU A 57 1.006 15.899 -10.709 1.00 0.00 C ATOM 0 H LEU A 57 -2.757 16.070 -8.826 1.00 0.00 H new ATOM 0 HA LEU A 57 -1.784 17.511 -11.193 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.060 14.527 -10.749 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.096 15.343 -11.964 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.426 15.948 -9.129 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.895 13.880 -8.901 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.849 13.541 -9.016 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.204 13.276 -10.426 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.863 15.843 -10.038 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.210 15.317 -11.608 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.827 16.939 -10.983 1.00 0.00 H new ATOM 978 N ILE A 58 -3.462 16.132 -12.869 1.00 0.00 N ATOM 979 CA ILE A 58 -4.613 15.925 -13.740 1.00 0.00 C ATOM 980 C ILE A 58 -4.355 14.798 -14.734 1.00 0.00 C ATOM 981 O ILE A 58 -3.240 14.637 -15.230 1.00 0.00 O ATOM 982 CB ILE A 58 -4.969 17.207 -14.516 1.00 0.00 C ATOM 983 CG1 ILE A 58 -6.140 16.946 -15.465 1.00 0.00 C ATOM 984 CG2 ILE A 58 -3.759 17.713 -15.286 1.00 0.00 C ATOM 985 CD1 ILE A 58 -6.660 18.195 -16.141 1.00 0.00 C ATOM 0 H ILE A 58 -2.559 15.996 -13.324 1.00 0.00 H new ATOM 0 HA ILE A 58 -5.451 15.654 -13.097 1.00 0.00 H new ATOM 0 HB ILE A 58 -5.268 17.975 -13.802 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -5.827 16.233 -16.228 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -6.952 16.480 -14.907 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -4.026 18.619 -15.829 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -2.950 17.933 -14.589 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.432 16.950 -15.992 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -7.489 17.934 -16.799 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -7.004 18.901 -15.385 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -5.862 18.651 -16.727 1.00 0.00 H new ATOM 997 N ASP A 59 -5.394 14.021 -15.021 1.00 0.00 N ATOM 998 CA ASP A 59 -5.282 12.910 -15.958 1.00 0.00 C ATOM 999 C ASP A 59 -5.874 13.281 -17.314 1.00 0.00 C ATOM 1000 O ASP A 59 -7.093 13.306 -17.484 1.00 0.00 O ATOM 1001 CB ASP A 59 -5.986 11.672 -15.401 1.00 0.00 C ATOM 1002 CG ASP A 59 -6.486 10.748 -16.495 1.00 0.00 C ATOM 1003 OD1 ASP A 59 -5.657 10.293 -17.311 1.00 0.00 O ATOM 1004 OD2 ASP A 59 -7.705 10.482 -16.537 1.00 0.00 O ATOM 0 H ASP A 59 -6.323 14.140 -14.618 1.00 0.00 H new ATOM 0 HA ASP A 59 -4.224 12.686 -16.093 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -5.298 11.126 -14.755 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -6.826 11.984 -14.781 1.00 0.00 H new ATOM 1009 N ASP A 60 -5.004 13.568 -18.275 1.00 0.00 N ATOM 1010 CA ASP A 60 -5.440 13.938 -19.617 1.00 0.00 C ATOM 1011 C ASP A 60 -4.957 12.921 -20.646 1.00 0.00 C ATOM 1012 O ASP A 60 -4.496 11.837 -20.290 1.00 0.00 O ATOM 1013 CB ASP A 60 -4.924 15.332 -19.978 1.00 0.00 C ATOM 1014 CG ASP A 60 -6.036 16.266 -20.415 1.00 0.00 C ATOM 1015 OD1 ASP A 60 -7.017 15.780 -21.017 1.00 0.00 O ATOM 1016 OD2 ASP A 60 -5.925 17.482 -20.156 1.00 0.00 O ATOM 0 H ASP A 60 -3.992 13.552 -18.150 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.530 13.948 -19.628 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -4.411 15.761 -19.117 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.189 15.248 -20.778 1.00 0.00 H new ATOM 1021 N GLU A 61 -5.067 13.279 -21.921 1.00 0.00 N ATOM 1022 CA GLU A 61 -4.643 12.395 -23.001 1.00 0.00 C ATOM 1023 C GLU A 61 -3.125 12.236 -23.010 1.00 0.00 C ATOM 1024 O GLU A 61 -2.603 11.185 -23.379 1.00 0.00 O ATOM 1025 CB GLU A 61 -5.118 12.938 -24.350 1.00 0.00 C ATOM 1026 CG GLU A 61 -6.514 13.536 -24.309 1.00 0.00 C ATOM 1027 CD GLU A 61 -7.092 13.765 -25.692 1.00 0.00 C ATOM 1028 OE1 GLU A 61 -6.404 14.387 -26.528 1.00 0.00 O ATOM 1029 OE2 GLU A 61 -8.233 13.320 -25.938 1.00 0.00 O ATOM 0 H GLU A 61 -5.446 14.174 -22.232 1.00 0.00 H new ATOM 0 HA GLU A 61 -5.092 11.416 -22.833 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.416 13.698 -24.693 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -5.099 12.132 -25.084 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -7.173 12.872 -23.749 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -6.484 14.483 -23.771 1.00 0.00 H new ATOM 1036 N ARG A 62 -2.424 13.289 -22.601 1.00 0.00 N ATOM 1037 CA ARG A 62 -0.967 13.268 -22.563 1.00 0.00 C ATOM 1038 C ARG A 62 -0.465 12.316 -21.481 1.00 0.00 C ATOM 1039 O ARG A 62 0.555 11.648 -21.652 1.00 0.00 O ATOM 1040 CB ARG A 62 -0.422 14.675 -22.312 1.00 0.00 C ATOM 1041 CG ARG A 62 -1.109 15.399 -21.165 1.00 0.00 C ATOM 1042 CD ARG A 62 -1.913 16.590 -21.661 1.00 0.00 C ATOM 1043 NE ARG A 62 -1.178 17.844 -21.518 1.00 0.00 N ATOM 1044 CZ ARG A 62 -0.495 18.412 -22.506 1.00 0.00 C ATOM 1045 NH1 ARG A 62 -0.453 17.841 -23.702 1.00 0.00 N ATOM 1046 NH2 ARG A 62 0.149 19.554 -22.298 1.00 0.00 N ATOM 0 H ARG A 62 -2.842 14.167 -22.292 1.00 0.00 H new ATOM 0 HA ARG A 62 -0.608 12.914 -23.529 1.00 0.00 H new ATOM 0 HB2 ARG A 62 0.646 14.610 -22.102 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -0.532 15.266 -23.221 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -1.767 14.708 -20.639 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -0.362 15.737 -20.447 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -2.174 16.440 -22.709 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -2.849 16.653 -21.105 1.00 0.00 H new ATOM 0 HE ARG A 62 -1.190 18.309 -20.610 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -0.946 16.963 -23.866 1.00 0.00 H new ATOM 0 HH12 ARG A 62 0.072 18.280 -24.458 1.00 0.00 H new ATOM 0 HH21 ARG A 62 0.120 19.996 -21.379 1.00 0.00 H new ATOM 0 HH22 ARG A 62 0.673 19.989 -23.057 1.00 0.00 H new ATOM 1060 N SER A 63 -1.188 12.260 -20.367 1.00 0.00 N ATOM 1061 CA SER A 63 -0.814 11.393 -19.256 1.00 0.00 C ATOM 1062 C SER A 63 -0.885 9.925 -19.664 1.00 0.00 C ATOM 1063 O SER A 63 -1.870 9.478 -20.252 1.00 0.00 O ATOM 1064 CB SER A 63 -1.728 11.645 -18.055 1.00 0.00 C ATOM 1065 OG SER A 63 -1.511 12.935 -17.510 1.00 0.00 O ATOM 0 H SER A 63 -2.036 12.805 -20.210 1.00 0.00 H new ATOM 0 HA SER A 63 0.214 11.625 -18.977 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.770 11.546 -18.360 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.547 10.889 -17.291 1.00 0.00 H new ATOM 0 HG SER A 63 -2.213 13.137 -16.857 1.00 0.00 H new ATOM 1071 N THR A 64 0.169 9.178 -19.348 1.00 0.00 N ATOM 1072 CA THR A 64 0.228 7.760 -19.682 1.00 0.00 C ATOM 1073 C THR A 64 1.522 7.130 -19.178 1.00 0.00 C ATOM 1074 O THR A 64 2.477 7.832 -18.848 1.00 0.00 O ATOM 1075 CB THR A 64 0.120 7.536 -21.202 1.00 0.00 C ATOM 1076 OG1 THR A 64 0.205 6.138 -21.499 1.00 0.00 O ATOM 1077 CG2 THR A 64 1.221 8.284 -21.939 1.00 0.00 C ATOM 0 H THR A 64 0.993 9.531 -18.861 1.00 0.00 H new ATOM 0 HA THR A 64 -0.621 7.284 -19.191 1.00 0.00 H new ATOM 0 HB THR A 64 -0.844 7.920 -21.535 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.134 6.004 -22.467 1.00 0.00 H new ATOM 0 HG21 THR A 64 1.124 8.111 -23.011 1.00 0.00 H new ATOM 0 HG22 THR A 64 1.135 9.351 -21.735 1.00 0.00 H new ATOM 0 HG23 THR A 64 2.193 7.927 -21.600 1.00 0.00 H new ATOM 1085 N ALA A 65 1.545 5.803 -19.121 1.00 0.00 N ATOM 1086 CA ALA A 65 2.723 5.079 -18.660 1.00 0.00 C ATOM 1087 C ALA A 65 3.158 4.031 -19.679 1.00 0.00 C ATOM 1088 O ALA A 65 2.324 3.383 -20.311 1.00 0.00 O ATOM 1089 CB ALA A 65 2.447 4.425 -17.314 1.00 0.00 C ATOM 0 H ALA A 65 0.761 5.207 -19.388 1.00 0.00 H new ATOM 0 HA ALA A 65 3.536 5.795 -18.545 1.00 0.00 H new ATOM 0 HB1 ALA A 65 3.335 3.888 -16.982 1.00 0.00 H new ATOM 0 HB2 ALA A 65 2.192 5.192 -16.582 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.616 3.726 -17.412 1.00 0.00 H new ATOM 1095 N GLN A 66 4.468 3.873 -19.835 1.00 0.00 N ATOM 1096 CA GLN A 66 5.013 2.904 -20.780 1.00 0.00 C ATOM 1097 C GLN A 66 5.946 1.924 -20.077 1.00 0.00 C ATOM 1098 O GLN A 66 6.595 2.268 -19.089 1.00 0.00 O ATOM 1099 CB GLN A 66 5.762 3.623 -21.904 1.00 0.00 C ATOM 1100 CG GLN A 66 4.937 4.696 -22.595 1.00 0.00 C ATOM 1101 CD GLN A 66 3.960 4.123 -23.603 1.00 0.00 C ATOM 1102 OE1 GLN A 66 4.350 3.697 -24.690 1.00 0.00 O ATOM 1103 NE2 GLN A 66 2.681 4.109 -23.245 1.00 0.00 N ATOM 0 H GLN A 66 5.172 4.402 -19.320 1.00 0.00 H new ATOM 0 HA GLN A 66 4.182 2.343 -21.207 1.00 0.00 H new ATOM 0 HB2 GLN A 66 6.665 4.077 -21.495 1.00 0.00 H new ATOM 0 HB3 GLN A 66 6.081 2.889 -22.644 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.387 5.265 -21.845 1.00 0.00 H new ATOM 0 HG3 GLN A 66 5.605 5.394 -23.099 1.00 0.00 H new ATOM 0 HE21 GLN A 66 2.402 4.473 -22.334 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.977 3.735 -23.881 1.00 0.00 H new ATOM 1112 N TYR A 67 6.007 0.701 -20.593 1.00 0.00 N ATOM 1113 CA TYR A 67 6.859 -0.331 -20.013 1.00 0.00 C ATOM 1114 C TYR A 67 8.264 -0.274 -20.604 1.00 0.00 C ATOM 1115 O TYR A 67 8.438 -0.289 -21.823 1.00 0.00 O ATOM 1116 CB TYR A 67 6.250 -1.715 -20.248 1.00 0.00 C ATOM 1117 CG TYR A 67 7.192 -2.853 -19.926 1.00 0.00 C ATOM 1118 CD1 TYR A 67 8.019 -2.802 -18.810 1.00 0.00 C ATOM 1119 CD2 TYR A 67 7.255 -3.980 -20.737 1.00 0.00 C ATOM 1120 CE1 TYR A 67 8.882 -3.839 -18.513 1.00 0.00 C ATOM 1121 CE2 TYR A 67 8.113 -5.022 -20.446 1.00 0.00 C ATOM 1122 CZ TYR A 67 8.925 -4.947 -19.333 1.00 0.00 C ATOM 1123 OH TYR A 67 9.782 -5.983 -19.040 1.00 0.00 O ATOM 0 H TYR A 67 5.477 0.400 -21.411 1.00 0.00 H new ATOM 0 HA TYR A 67 6.929 -0.149 -18.941 1.00 0.00 H new ATOM 0 HB2 TYR A 67 5.351 -1.815 -19.640 1.00 0.00 H new ATOM 0 HB3 TYR A 67 5.940 -1.794 -21.290 1.00 0.00 H new ATOM 0 HD1 TYR A 67 7.986 -1.937 -18.164 1.00 0.00 H new ATOM 0 HD2 TYR A 67 6.622 -4.042 -21.610 1.00 0.00 H new ATOM 0 HE1 TYR A 67 9.520 -3.782 -17.643 1.00 0.00 H new ATOM 0 HE2 TYR A 67 8.148 -5.891 -21.086 1.00 0.00 H new ATOM 0 HH TYR A 67 9.688 -6.686 -19.716 1.00 0.00 H new ATOM 1133 N ASP A 68 9.263 -0.209 -19.732 1.00 0.00 N ATOM 1134 CA ASP A 68 10.654 -0.151 -20.165 1.00 0.00 C ATOM 1135 C ASP A 68 11.329 -1.510 -20.009 1.00 0.00 C ATOM 1136 O ASP A 68 11.440 -2.036 -18.901 1.00 0.00 O ATOM 1137 CB ASP A 68 11.417 0.906 -19.365 1.00 0.00 C ATOM 1138 CG ASP A 68 11.465 2.245 -20.073 1.00 0.00 C ATOM 1139 OD1 ASP A 68 11.498 2.255 -21.321 1.00 0.00 O ATOM 1140 OD2 ASP A 68 11.470 3.284 -19.379 1.00 0.00 O ATOM 0 H ASP A 68 9.136 -0.195 -18.720 1.00 0.00 H new ATOM 0 HA ASP A 68 10.669 0.123 -21.220 1.00 0.00 H new ATOM 0 HB2 ASP A 68 10.945 1.030 -18.390 1.00 0.00 H new ATOM 0 HB3 ASP A 68 12.434 0.557 -19.185 1.00 0.00 H new ATOM 1145 N SER A 69 11.777 -2.075 -21.126 1.00 0.00 N ATOM 1146 CA SER A 69 12.437 -3.375 -21.113 1.00 0.00 C ATOM 1147 C SER A 69 13.936 -3.222 -20.872 1.00 0.00 C ATOM 1148 O SER A 69 14.569 -4.081 -20.259 1.00 0.00 O ATOM 1149 CB SER A 69 12.193 -4.107 -22.435 1.00 0.00 C ATOM 1150 OG SER A 69 12.880 -3.475 -23.502 1.00 0.00 O ATOM 0 H SER A 69 11.695 -1.653 -22.051 1.00 0.00 H new ATOM 0 HA SER A 69 12.014 -3.961 -20.297 1.00 0.00 H new ATOM 0 HB2 SER A 69 12.524 -5.142 -22.348 1.00 0.00 H new ATOM 0 HB3 SER A 69 11.125 -4.131 -22.649 1.00 0.00 H new ATOM 0 HG SER A 69 12.710 -3.962 -24.335 1.00 0.00 H new ATOM 1156 N LYS A 70 14.497 -2.122 -21.360 1.00 0.00 N ATOM 1157 CA LYS A 70 15.921 -1.852 -21.198 1.00 0.00 C ATOM 1158 C LYS A 70 16.330 -1.948 -19.732 1.00 0.00 C ATOM 1159 O LYS A 70 17.473 -2.279 -19.416 1.00 0.00 O ATOM 1160 CB LYS A 70 16.264 -0.464 -21.744 1.00 0.00 C ATOM 1161 CG LYS A 70 15.442 0.653 -21.126 1.00 0.00 C ATOM 1162 CD LYS A 70 16.186 1.328 -19.986 1.00 0.00 C ATOM 1163 CE LYS A 70 15.233 2.066 -19.059 1.00 0.00 C ATOM 1164 NZ LYS A 70 14.956 3.450 -19.535 1.00 0.00 N ATOM 0 H LYS A 70 13.987 -1.402 -21.872 1.00 0.00 H new ATOM 0 HA LYS A 70 16.474 -2.604 -21.761 1.00 0.00 H new ATOM 0 HB2 LYS A 70 17.321 -0.265 -21.569 1.00 0.00 H new ATOM 0 HB3 LYS A 70 16.113 -0.460 -22.824 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.198 1.391 -21.890 1.00 0.00 H new ATOM 0 HG3 LYS A 70 14.498 0.251 -20.758 1.00 0.00 H new ATOM 0 HD2 LYS A 70 16.741 0.580 -19.419 1.00 0.00 H new ATOM 0 HD3 LYS A 70 16.917 2.028 -20.391 1.00 0.00 H new ATOM 0 HE2 LYS A 70 14.297 1.513 -18.986 1.00 0.00 H new ATOM 0 HE3 LYS A 70 15.659 2.105 -18.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 14.303 3.919 -18.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 15.846 3.986 -19.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 14.526 3.412 -20.481 1.00 0.00 H new ATOM 1178 N ASP A 71 15.389 -1.658 -18.840 1.00 0.00 N ATOM 1179 CA ASP A 71 15.650 -1.714 -17.407 1.00 0.00 C ATOM 1180 C ASP A 71 14.546 -2.477 -16.682 1.00 0.00 C ATOM 1181 O ASP A 71 14.518 -2.528 -15.453 1.00 0.00 O ATOM 1182 CB ASP A 71 15.772 -0.301 -16.833 1.00 0.00 C ATOM 1183 CG ASP A 71 16.210 -0.302 -15.382 1.00 0.00 C ATOM 1184 OD1 ASP A 71 17.237 -0.941 -15.072 1.00 0.00 O ATOM 1185 OD2 ASP A 71 15.527 0.339 -14.556 1.00 0.00 O ATOM 0 H ASP A 71 14.438 -1.382 -19.085 1.00 0.00 H new ATOM 0 HA ASP A 71 16.591 -2.242 -17.255 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.488 0.268 -17.425 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.812 0.207 -16.919 1.00 0.00 H new ATOM 1190 N GLU A 72 13.637 -3.067 -17.453 1.00 0.00 N ATOM 1191 CA GLU A 72 12.530 -3.826 -16.883 1.00 0.00 C ATOM 1192 C GLU A 72 11.766 -2.989 -15.861 1.00 0.00 C ATOM 1193 O GLU A 72 11.180 -3.524 -14.919 1.00 0.00 O ATOM 1194 CB GLU A 72 13.045 -5.108 -16.226 1.00 0.00 C ATOM 1195 CG GLU A 72 13.926 -5.947 -17.137 1.00 0.00 C ATOM 1196 CD GLU A 72 14.684 -7.024 -16.385 1.00 0.00 C ATOM 1197 OE1 GLU A 72 14.316 -7.308 -15.226 1.00 0.00 O ATOM 1198 OE2 GLU A 72 15.645 -7.582 -16.955 1.00 0.00 O ATOM 0 H GLU A 72 13.646 -3.034 -18.472 1.00 0.00 H new ATOM 0 HA GLU A 72 11.850 -4.090 -17.693 1.00 0.00 H new ATOM 0 HB2 GLU A 72 13.608 -4.846 -15.330 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.194 -5.708 -15.904 1.00 0.00 H new ATOM 0 HG2 GLU A 72 13.309 -6.412 -17.906 1.00 0.00 H new ATOM 0 HG3 GLU A 72 14.637 -5.297 -17.648 1.00 0.00 H new ATOM 1205 N CYS A 73 11.779 -1.675 -16.053 1.00 0.00 N ATOM 1206 CA CYS A 73 11.089 -0.763 -15.148 1.00 0.00 C ATOM 1207 C CYS A 73 9.858 -0.159 -15.817 1.00 0.00 C ATOM 1208 O CYS A 73 9.674 -0.286 -17.028 1.00 0.00 O ATOM 1209 CB CYS A 73 12.034 0.350 -14.693 1.00 0.00 C ATOM 1210 SG CYS A 73 12.507 1.499 -16.006 1.00 0.00 S ATOM 0 H CYS A 73 12.260 -1.217 -16.827 1.00 0.00 H new ATOM 0 HA CYS A 73 10.764 -1.333 -14.277 1.00 0.00 H new ATOM 0 HB2 CYS A 73 11.557 0.910 -13.889 1.00 0.00 H new ATOM 0 HB3 CYS A 73 12.935 -0.101 -14.277 1.00 0.00 H new ATOM 0 HG CYS A 73 13.305 2.405 -15.523 1.00 0.00 H new ATOM 1216 N ILE A 74 9.020 0.495 -15.021 1.00 0.00 N ATOM 1217 CA ILE A 74 7.807 1.118 -15.537 1.00 0.00 C ATOM 1218 C ILE A 74 7.852 2.632 -15.369 1.00 0.00 C ATOM 1219 O ILE A 74 8.181 3.138 -14.297 1.00 0.00 O ATOM 1220 CB ILE A 74 6.550 0.571 -14.834 1.00 0.00 C ATOM 1221 CG1 ILE A 74 6.531 -0.958 -14.893 1.00 0.00 C ATOM 1222 CG2 ILE A 74 5.294 1.147 -15.469 1.00 0.00 C ATOM 1223 CD1 ILE A 74 6.292 -1.506 -16.282 1.00 0.00 C ATOM 0 H ILE A 74 9.158 0.608 -14.017 1.00 0.00 H new ATOM 0 HA ILE A 74 7.754 0.875 -16.598 1.00 0.00 H new ATOM 0 HB ILE A 74 6.576 0.875 -13.788 1.00 0.00 H new ATOM 0 HG12 ILE A 74 7.481 -1.340 -14.519 1.00 0.00 H new ATOM 0 HG13 ILE A 74 5.753 -1.330 -14.226 1.00 0.00 H new ATOM 0 HG21 ILE A 74 4.415 0.751 -14.961 1.00 0.00 H new ATOM 0 HG22 ILE A 74 5.306 2.233 -15.379 1.00 0.00 H new ATOM 0 HG23 ILE A 74 5.259 0.871 -16.523 1.00 0.00 H new ATOM 0 HD11 ILE A 74 6.291 -2.595 -16.248 1.00 0.00 H new ATOM 0 HD12 ILE A 74 5.329 -1.154 -16.651 1.00 0.00 H new ATOM 0 HD13 ILE A 74 7.083 -1.164 -16.949 1.00 0.00 H new ATOM 1235 N ASN A 75 7.516 3.351 -16.435 1.00 0.00 N ATOM 1236 CA ASN A 75 7.516 4.809 -16.405 1.00 0.00 C ATOM 1237 C ASN A 75 6.093 5.356 -16.473 1.00 0.00 C ATOM 1238 O ASN A 75 5.336 5.034 -17.389 1.00 0.00 O ATOM 1239 CB ASN A 75 8.343 5.364 -17.566 1.00 0.00 C ATOM 1240 CG ASN A 75 7.947 4.759 -18.899 1.00 0.00 C ATOM 1241 OD1 ASN A 75 6.898 5.086 -19.454 1.00 0.00 O ATOM 1242 ND2 ASN A 75 8.786 3.871 -19.419 1.00 0.00 N ATOM 0 H ASN A 75 7.240 2.948 -17.330 1.00 0.00 H new ATOM 0 HA ASN A 75 7.964 5.127 -15.463 1.00 0.00 H new ATOM 0 HB2 ASN A 75 8.221 6.446 -17.611 1.00 0.00 H new ATOM 0 HB3 ASN A 75 9.400 5.170 -17.381 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.572 3.430 -20.313 1.00 0.00 H new ATOM 0 HD22 ASN A 75 9.645 3.630 -18.924 1.00 0.00 H new ATOM 1249 N VAL A 76 5.736 6.185 -15.497 1.00 0.00 N ATOM 1250 CA VAL A 76 4.405 6.778 -15.447 1.00 0.00 C ATOM 1251 C VAL A 76 4.470 8.289 -15.634 1.00 0.00 C ATOM 1252 O VAL A 76 5.190 8.985 -14.918 1.00 0.00 O ATOM 1253 CB VAL A 76 3.702 6.466 -14.112 1.00 0.00 C ATOM 1254 CG1 VAL A 76 2.247 6.906 -14.159 1.00 0.00 C ATOM 1255 CG2 VAL A 76 3.809 4.984 -13.787 1.00 0.00 C ATOM 0 H VAL A 76 6.350 6.461 -14.731 1.00 0.00 H new ATOM 0 HA VAL A 76 3.831 6.338 -16.263 1.00 0.00 H new ATOM 0 HB VAL A 76 4.200 7.025 -13.320 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.767 6.678 -13.207 1.00 0.00 H new ATOM 0 HG12 VAL A 76 2.197 7.979 -14.342 1.00 0.00 H new ATOM 0 HG13 VAL A 76 1.733 6.377 -14.961 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.307 4.782 -12.841 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.337 4.403 -14.579 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.859 4.704 -13.708 1.00 0.00 H new ATOM 1265 N LYS A 77 3.711 8.793 -16.602 1.00 0.00 N ATOM 1266 CA LYS A 77 3.679 10.223 -16.884 1.00 0.00 C ATOM 1267 C LYS A 77 2.330 10.823 -16.500 1.00 0.00 C ATOM 1268 O LYS A 77 1.283 10.212 -16.716 1.00 0.00 O ATOM 1269 CB LYS A 77 3.959 10.477 -18.367 1.00 0.00 C ATOM 1270 CG LYS A 77 4.433 11.890 -18.662 1.00 0.00 C ATOM 1271 CD LYS A 77 3.282 12.787 -19.085 1.00 0.00 C ATOM 1272 CE LYS A 77 3.284 13.027 -20.587 1.00 0.00 C ATOM 1273 NZ LYS A 77 3.336 11.750 -21.351 1.00 0.00 N ATOM 0 H LYS A 77 3.110 8.231 -17.205 1.00 0.00 H new ATOM 0 HA LYS A 77 4.454 10.704 -16.287 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.713 9.770 -18.712 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.052 10.280 -18.939 1.00 0.00 H new ATOM 0 HG2 LYS A 77 4.913 12.306 -17.776 1.00 0.00 H new ATOM 0 HG3 LYS A 77 5.185 11.865 -19.451 1.00 0.00 H new ATOM 0 HD2 LYS A 77 2.337 12.331 -18.790 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.352 13.741 -18.563 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.389 13.582 -20.868 1.00 0.00 H new ATOM 0 HE3 LYS A 77 4.140 13.646 -20.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 3.688 11.935 -22.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.974 11.084 -20.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.382 11.338 -21.405 1.00 0.00 H new ATOM 1287 N VAL A 78 2.362 12.024 -15.931 1.00 0.00 N ATOM 1288 CA VAL A 78 1.141 12.708 -15.520 1.00 0.00 C ATOM 1289 C VAL A 78 1.303 14.221 -15.611 1.00 0.00 C ATOM 1290 O VAL A 78 2.252 14.788 -15.071 1.00 0.00 O ATOM 1291 CB VAL A 78 0.744 12.330 -14.081 1.00 0.00 C ATOM 1292 CG1 VAL A 78 1.922 12.511 -13.136 1.00 0.00 C ATOM 1293 CG2 VAL A 78 -0.448 13.157 -13.624 1.00 0.00 C ATOM 0 H VAL A 78 3.220 12.543 -15.744 1.00 0.00 H new ATOM 0 HA VAL A 78 0.353 12.388 -16.202 1.00 0.00 H new ATOM 0 HB VAL A 78 0.456 11.279 -14.066 1.00 0.00 H new ATOM 0 HG11 VAL A 78 1.622 12.239 -12.124 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.745 11.872 -13.454 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.244 13.552 -13.151 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.716 12.877 -12.605 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.189 14.215 -13.654 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -1.294 12.972 -14.285 1.00 0.00 H new ATOM 1303 N ALA A 79 0.368 14.870 -16.297 1.00 0.00 N ATOM 1304 CA ALA A 79 0.404 16.319 -16.456 1.00 0.00 C ATOM 1305 C ALA A 79 0.087 17.024 -15.142 1.00 0.00 C ATOM 1306 O ALA A 79 -0.667 16.509 -14.315 1.00 0.00 O ATOM 1307 CB ALA A 79 -0.570 16.755 -17.540 1.00 0.00 C ATOM 0 H ALA A 79 -0.424 14.415 -16.752 1.00 0.00 H new ATOM 0 HA ALA A 79 1.413 16.602 -16.755 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.533 17.839 -17.648 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -0.296 16.286 -18.485 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.580 16.452 -17.265 1.00 0.00 H new ATOM 1313 N LYS A 80 0.667 18.204 -14.954 1.00 0.00 N ATOM 1314 CA LYS A 80 0.446 18.981 -13.740 1.00 0.00 C ATOM 1315 C LYS A 80 -0.439 20.191 -14.022 1.00 0.00 C ATOM 1316 O LYS A 80 -0.307 20.841 -15.060 1.00 0.00 O ATOM 1317 CB LYS A 80 1.783 19.439 -13.152 1.00 0.00 C ATOM 1318 CG LYS A 80 1.641 20.235 -11.866 1.00 0.00 C ATOM 1319 CD LYS A 80 1.189 19.355 -10.713 1.00 0.00 C ATOM 1320 CE LYS A 80 0.210 20.084 -9.806 1.00 0.00 C ATOM 1321 NZ LYS A 80 0.788 21.347 -9.268 1.00 0.00 N ATOM 0 H LYS A 80 1.294 18.644 -15.627 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.062 18.342 -13.017 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.405 18.565 -12.961 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.306 20.047 -13.890 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.595 20.700 -11.618 1.00 0.00 H new ATOM 0 HG3 LYS A 80 0.922 21.041 -12.013 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.720 18.452 -11.105 1.00 0.00 H new ATOM 0 HD3 LYS A 80 2.056 19.038 -10.134 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.701 20.309 -10.361 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -0.073 19.433 -8.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.054 21.873 -8.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 1.571 21.123 -8.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 1.143 21.929 -10.054 1.00 0.00 H new ATOM 1335 N LEU A 81 -1.339 20.489 -13.092 1.00 0.00 N ATOM 1336 CA LEU A 81 -2.245 21.623 -13.240 1.00 0.00 C ATOM 1337 C LEU A 81 -1.474 22.897 -13.568 1.00 0.00 C ATOM 1338 O LEU A 81 -1.829 23.630 -14.490 1.00 0.00 O ATOM 1339 CB LEU A 81 -3.059 21.821 -11.961 1.00 0.00 C ATOM 1340 CG LEU A 81 -4.095 20.740 -11.650 1.00 0.00 C ATOM 1341 CD1 LEU A 81 -4.892 21.105 -10.407 1.00 0.00 C ATOM 1342 CD2 LEU A 81 -5.022 20.532 -12.838 1.00 0.00 C ATOM 0 H LEU A 81 -1.461 19.962 -12.228 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.924 21.409 -14.066 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.368 21.886 -11.121 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.573 22.780 -12.026 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.569 19.805 -11.457 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.624 20.324 -10.202 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.216 21.202 -9.557 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.407 22.051 -10.570 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.753 19.759 -12.599 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.540 21.464 -13.063 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.438 20.223 -13.705 1.00 0.00 H new ATOM 1354 N ASN A 82 -0.414 23.154 -12.808 1.00 0.00 N ATOM 1355 CA ASN A 82 0.409 24.339 -13.018 1.00 0.00 C ATOM 1356 C ASN A 82 1.784 23.957 -13.560 1.00 0.00 C ATOM 1357 O ASN A 82 2.543 23.240 -12.908 1.00 0.00 O ATOM 1358 CB ASN A 82 0.562 25.118 -11.711 1.00 0.00 C ATOM 1359 CG ASN A 82 -0.719 25.145 -10.901 1.00 0.00 C ATOM 1360 OD1 ASN A 82 -1.476 26.115 -10.948 1.00 0.00 O ATOM 1361 ND2 ASN A 82 -0.968 24.078 -10.151 1.00 0.00 N ATOM 0 H ASN A 82 -0.105 22.557 -12.041 1.00 0.00 H new ATOM 0 HA ASN A 82 -0.089 24.971 -13.753 1.00 0.00 H new ATOM 0 HB2 ASN A 82 1.356 24.669 -11.115 1.00 0.00 H new ATOM 0 HB3 ASN A 82 0.869 26.140 -11.934 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -1.815 24.040 -9.583 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -0.313 23.296 -10.142 1.00 0.00 H new ATOM 1368 N LYS A 83 2.097 24.442 -14.756 1.00 0.00 N ATOM 1369 CA LYS A 83 3.381 24.155 -15.387 1.00 0.00 C ATOM 1370 C LYS A 83 4.525 24.792 -14.605 1.00 0.00 C ATOM 1371 O LYS A 83 4.320 25.740 -13.849 1.00 0.00 O ATOM 1372 CB LYS A 83 3.389 24.664 -16.830 1.00 0.00 C ATOM 1373 CG LYS A 83 4.564 24.156 -17.647 1.00 0.00 C ATOM 1374 CD LYS A 83 4.260 24.179 -19.135 1.00 0.00 C ATOM 1375 CE LYS A 83 4.981 23.058 -19.869 1.00 0.00 C ATOM 1376 NZ LYS A 83 5.276 23.421 -21.283 1.00 0.00 N ATOM 0 H LYS A 83 1.479 25.036 -15.309 1.00 0.00 H new ATOM 0 HA LYS A 83 3.523 23.074 -15.389 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.461 24.364 -17.317 1.00 0.00 H new ATOM 0 HB3 LYS A 83 3.407 25.754 -16.822 1.00 0.00 H new ATOM 0 HG2 LYS A 83 5.442 24.770 -17.445 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.809 23.139 -17.340 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.185 24.084 -19.289 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.558 25.140 -19.554 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.912 22.825 -19.352 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.369 22.156 -19.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.767 22.632 -21.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.386 23.619 -21.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.881 24.267 -21.305 1.00 0.00 H new ATOM 1390 N ASN A 84 5.731 24.265 -14.795 1.00 0.00 N ATOM 1391 CA ASN A 84 6.908 24.784 -14.109 1.00 0.00 C ATOM 1392 C ASN A 84 6.781 24.606 -12.599 1.00 0.00 C ATOM 1393 O ASN A 84 7.508 25.229 -11.827 1.00 0.00 O ATOM 1394 CB ASN A 84 7.109 26.263 -14.444 1.00 0.00 C ATOM 1395 CG ASN A 84 8.156 26.475 -15.520 1.00 0.00 C ATOM 1396 OD1 ASN A 84 9.126 27.208 -15.323 1.00 0.00 O ATOM 1397 ND2 ASN A 84 7.964 25.833 -16.667 1.00 0.00 N ATOM 0 H ASN A 84 5.918 23.479 -15.418 1.00 0.00 H new ATOM 0 HA ASN A 84 7.775 24.220 -14.452 1.00 0.00 H new ATOM 0 HB2 ASN A 84 6.162 26.690 -14.773 1.00 0.00 H new ATOM 0 HB3 ASN A 84 7.404 26.800 -13.543 1.00 0.00 H new ATOM 0 HD21 ASN A 84 8.635 25.937 -17.428 1.00 0.00 H new ATOM 0 HD22 ASN A 84 7.146 25.236 -16.786 1.00 0.00 H new ATOM 1404 N GLU A 85 5.851 23.750 -12.186 1.00 0.00 N ATOM 1405 CA GLU A 85 5.628 23.490 -10.769 1.00 0.00 C ATOM 1406 C GLU A 85 6.461 22.303 -10.296 1.00 0.00 C ATOM 1407 O GLU A 85 6.585 21.298 -10.997 1.00 0.00 O ATOM 1408 CB GLU A 85 4.145 23.224 -10.503 1.00 0.00 C ATOM 1409 CG GLU A 85 3.794 23.152 -9.027 1.00 0.00 C ATOM 1410 CD GLU A 85 3.371 24.494 -8.461 1.00 0.00 C ATOM 1411 OE1 GLU A 85 4.136 25.469 -8.615 1.00 0.00 O ATOM 1412 OE2 GLU A 85 2.276 24.569 -7.865 1.00 0.00 O ATOM 0 H GLU A 85 5.241 23.225 -12.812 1.00 0.00 H new ATOM 0 HA GLU A 85 5.937 24.374 -10.211 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.554 24.012 -10.970 1.00 0.00 H new ATOM 0 HB3 GLU A 85 3.861 22.286 -10.981 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.989 22.432 -8.884 1.00 0.00 H new ATOM 0 HG3 GLU A 85 4.655 22.782 -8.470 1.00 0.00 H new ATOM 1419 N TYR A 86 7.031 22.426 -9.102 1.00 0.00 N ATOM 1420 CA TYR A 86 7.855 21.365 -8.536 1.00 0.00 C ATOM 1421 C TYR A 86 7.195 20.764 -7.299 1.00 0.00 C ATOM 1422 O TYR A 86 6.068 21.114 -6.950 1.00 0.00 O ATOM 1423 CB TYR A 86 9.241 21.903 -8.177 1.00 0.00 C ATOM 1424 CG TYR A 86 9.274 22.673 -6.876 1.00 0.00 C ATOM 1425 CD1 TYR A 86 8.687 23.928 -6.773 1.00 0.00 C ATOM 1426 CD2 TYR A 86 9.891 22.144 -5.749 1.00 0.00 C ATOM 1427 CE1 TYR A 86 8.715 24.635 -5.587 1.00 0.00 C ATOM 1428 CE2 TYR A 86 9.923 22.843 -4.558 1.00 0.00 C ATOM 1429 CZ TYR A 86 9.334 24.088 -4.482 1.00 0.00 C ATOM 1430 OH TYR A 86 9.363 24.788 -3.297 1.00 0.00 O ATOM 0 H TYR A 86 6.937 23.250 -8.508 1.00 0.00 H new ATOM 0 HA TYR A 86 7.960 20.582 -9.287 1.00 0.00 H new ATOM 0 HB2 TYR A 86 9.940 21.069 -8.114 1.00 0.00 H new ATOM 0 HB3 TYR A 86 9.590 22.551 -8.982 1.00 0.00 H new ATOM 0 HD1 TYR A 86 8.200 24.358 -7.636 1.00 0.00 H new ATOM 0 HD2 TYR A 86 10.353 21.170 -5.805 1.00 0.00 H new ATOM 0 HE1 TYR A 86 8.255 25.610 -5.525 1.00 0.00 H new ATOM 0 HE2 TYR A 86 10.406 22.417 -3.691 1.00 0.00 H new ATOM 0 HH TYR A 86 9.835 24.262 -2.618 1.00 0.00 H new ATOM 1440 N PHE A 87 7.907 19.856 -6.638 1.00 0.00 N ATOM 1441 CA PHE A 87 7.392 19.205 -5.440 1.00 0.00 C ATOM 1442 C PHE A 87 8.447 19.180 -4.338 1.00 0.00 C ATOM 1443 O PHE A 87 9.638 19.341 -4.602 1.00 0.00 O ATOM 1444 CB PHE A 87 6.941 17.779 -5.762 1.00 0.00 C ATOM 1445 CG PHE A 87 5.746 17.718 -6.670 1.00 0.00 C ATOM 1446 CD1 PHE A 87 5.856 18.073 -8.005 1.00 0.00 C ATOM 1447 CD2 PHE A 87 4.514 17.307 -6.189 1.00 0.00 C ATOM 1448 CE1 PHE A 87 4.759 18.019 -8.844 1.00 0.00 C ATOM 1449 CE2 PHE A 87 3.413 17.249 -7.023 1.00 0.00 C ATOM 1450 CZ PHE A 87 3.535 17.607 -8.352 1.00 0.00 C ATOM 0 H PHE A 87 8.842 19.555 -6.913 1.00 0.00 H new ATOM 0 HA PHE A 87 6.535 19.778 -5.086 1.00 0.00 H new ATOM 0 HB2 PHE A 87 7.768 17.241 -6.226 1.00 0.00 H new ATOM 0 HB3 PHE A 87 6.707 17.262 -4.832 1.00 0.00 H new ATOM 0 HD1 PHE A 87 6.810 18.396 -8.394 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.412 17.029 -5.150 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.858 18.298 -9.883 1.00 0.00 H new ATOM 0 HE2 PHE A 87 2.458 16.924 -6.636 1.00 0.00 H new ATOM 0 HZ PHE A 87 2.676 17.565 -9.005 1.00 0.00 H new ATOM 1460 N GLU A 88 7.999 18.978 -3.102 1.00 0.00 N ATOM 1461 CA GLU A 88 8.905 18.934 -1.960 1.00 0.00 C ATOM 1462 C GLU A 88 8.672 17.675 -1.130 1.00 0.00 C ATOM 1463 O GLU A 88 9.197 17.542 -0.024 1.00 0.00 O ATOM 1464 CB GLU A 88 8.720 20.176 -1.086 1.00 0.00 C ATOM 1465 CG GLU A 88 9.616 21.337 -1.482 1.00 0.00 C ATOM 1466 CD GLU A 88 9.990 22.214 -0.302 1.00 0.00 C ATOM 1467 OE1 GLU A 88 9.192 23.107 0.051 1.00 0.00 O ATOM 1468 OE2 GLU A 88 11.082 22.006 0.268 1.00 0.00 O ATOM 0 H GLU A 88 7.016 18.843 -2.867 1.00 0.00 H new ATOM 0 HA GLU A 88 9.927 18.915 -2.339 1.00 0.00 H new ATOM 0 HB2 GLU A 88 7.679 20.496 -1.140 1.00 0.00 H new ATOM 0 HB3 GLU A 88 8.919 19.912 -0.047 1.00 0.00 H new ATOM 0 HG2 GLU A 88 10.524 20.949 -1.944 1.00 0.00 H new ATOM 0 HG3 GLU A 88 9.109 21.942 -2.234 1.00 0.00 H new ATOM 1475 N ASP A 89 7.881 16.755 -1.670 1.00 0.00 N ATOM 1476 CA ASP A 89 7.578 15.506 -0.981 1.00 0.00 C ATOM 1477 C ASP A 89 8.102 14.309 -1.769 1.00 0.00 C ATOM 1478 O ASP A 89 8.391 13.256 -1.199 1.00 0.00 O ATOM 1479 CB ASP A 89 6.070 15.370 -0.766 1.00 0.00 C ATOM 1480 CG ASP A 89 5.525 16.413 0.189 1.00 0.00 C ATOM 1481 OD1 ASP A 89 6.231 17.411 0.444 1.00 0.00 O ATOM 1482 OD2 ASP A 89 4.392 16.232 0.681 1.00 0.00 O ATOM 0 H ASP A 89 7.438 16.851 -2.584 1.00 0.00 H new ATOM 0 HA ASP A 89 8.075 15.525 -0.011 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.560 15.458 -1.725 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.850 14.376 -0.378 1.00 0.00 H new ATOM 1487 N LEU A 90 8.222 14.478 -3.081 1.00 0.00 N ATOM 1488 CA LEU A 90 8.711 13.411 -3.948 1.00 0.00 C ATOM 1489 C LEU A 90 10.094 12.942 -3.508 1.00 0.00 C ATOM 1490 O LEU A 90 10.497 11.814 -3.791 1.00 0.00 O ATOM 1491 CB LEU A 90 8.760 13.890 -5.400 1.00 0.00 C ATOM 1492 CG LEU A 90 7.436 14.373 -5.993 1.00 0.00 C ATOM 1493 CD1 LEU A 90 7.621 14.789 -7.444 1.00 0.00 C ATOM 1494 CD2 LEU A 90 6.373 13.290 -5.878 1.00 0.00 C ATOM 0 H LEU A 90 7.988 15.343 -3.568 1.00 0.00 H new ATOM 0 HA LEU A 90 8.022 12.570 -3.872 1.00 0.00 H new ATOM 0 HB2 LEU A 90 9.484 14.702 -5.469 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.136 13.075 -6.018 1.00 0.00 H new ATOM 0 HG LEU A 90 7.103 15.243 -5.427 1.00 0.00 H new ATOM 0 HD11 LEU A 90 6.668 15.130 -7.849 1.00 0.00 H new ATOM 0 HD12 LEU A 90 8.349 15.598 -7.501 1.00 0.00 H new ATOM 0 HD13 LEU A 90 7.978 13.938 -8.024 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.438 13.652 -6.305 1.00 0.00 H new ATOM 0 HD22 LEU A 90 6.699 12.401 -6.418 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.220 13.040 -4.828 1.00 0.00 H new ATOM 1506 N ASP A 91 10.815 13.814 -2.812 1.00 0.00 N ATOM 1507 CA ASP A 91 12.152 13.489 -2.330 1.00 0.00 C ATOM 1508 C ASP A 91 12.098 12.369 -1.295 1.00 0.00 C ATOM 1509 O ASP A 91 13.087 11.669 -1.071 1.00 0.00 O ATOM 1510 CB ASP A 91 12.815 14.727 -1.725 1.00 0.00 C ATOM 1511 CG ASP A 91 13.359 15.668 -2.782 1.00 0.00 C ATOM 1512 OD1 ASP A 91 13.294 15.316 -3.979 1.00 0.00 O ATOM 1513 OD2 ASP A 91 13.851 16.755 -2.414 1.00 0.00 O ATOM 0 H ASP A 91 10.496 14.752 -2.569 1.00 0.00 H new ATOM 0 HA ASP A 91 12.745 13.148 -3.179 1.00 0.00 H new ATOM 0 HB2 ASP A 91 12.091 15.258 -1.108 1.00 0.00 H new ATOM 0 HB3 ASP A 91 13.627 14.416 -1.067 1.00 0.00 H new ATOM 1518 N LEU A 92 10.939 12.206 -0.667 1.00 0.00 N ATOM 1519 CA LEU A 92 10.757 11.171 0.345 1.00 0.00 C ATOM 1520 C LEU A 92 9.742 10.130 -0.117 1.00 0.00 C ATOM 1521 O LEU A 92 8.555 10.412 -0.276 1.00 0.00 O ATOM 1522 CB LEU A 92 10.298 11.796 1.664 1.00 0.00 C ATOM 1523 CG LEU A 92 11.110 12.994 2.157 1.00 0.00 C ATOM 1524 CD1 LEU A 92 12.591 12.783 1.887 1.00 0.00 C ATOM 1525 CD2 LEU A 92 10.623 14.276 1.496 1.00 0.00 C ATOM 0 H LEU A 92 10.112 12.777 -0.840 1.00 0.00 H new ATOM 0 HA LEU A 92 11.715 10.675 0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 92 9.259 12.107 1.553 1.00 0.00 H new ATOM 0 HB3 LEU A 92 10.320 11.026 2.435 1.00 0.00 H new ATOM 0 HG LEU A 92 10.968 13.086 3.234 1.00 0.00 H new ATOM 0 HD11 LEU A 92 13.153 13.646 2.245 1.00 0.00 H new ATOM 0 HD12 LEU A 92 12.932 11.888 2.407 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.752 12.664 0.816 1.00 0.00 H new ATOM 0 HD21 LEU A 92 11.212 15.119 1.858 1.00 0.00 H new ATOM 0 HD22 LEU A 92 10.735 14.193 0.415 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.573 14.435 1.741 1.00 0.00 H new ATOM 1537 N PRO A 93 10.219 8.896 -0.337 1.00 0.00 N ATOM 1538 CA PRO A 93 9.370 7.786 -0.781 1.00 0.00 C ATOM 1539 C PRO A 93 8.403 7.326 0.304 1.00 0.00 C ATOM 1540 O PRO A 93 7.505 6.522 0.051 1.00 0.00 O ATOM 1541 CB PRO A 93 10.375 6.679 -1.107 1.00 0.00 C ATOM 1542 CG PRO A 93 11.566 6.988 -0.267 1.00 0.00 C ATOM 1543 CD PRO A 93 11.624 8.488 -0.168 1.00 0.00 C ATOM 0 HA PRO A 93 8.738 8.068 -1.623 1.00 0.00 H new ATOM 0 HB2 PRO A 93 9.970 5.695 -0.872 1.00 0.00 H new ATOM 0 HB3 PRO A 93 10.629 6.675 -2.167 1.00 0.00 H new ATOM 0 HG2 PRO A 93 11.476 6.535 0.720 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.475 6.591 -0.718 1.00 0.00 H new ATOM 0 HD2 PRO A 93 12.024 8.812 0.793 1.00 0.00 H new ATOM 0 HD3 PRO A 93 12.263 8.917 -0.940 1.00 0.00 H new ATOM 1551 N THR A 94 8.591 7.841 1.515 1.00 0.00 N ATOM 1552 CA THR A 94 7.736 7.481 2.640 1.00 0.00 C ATOM 1553 C THR A 94 6.578 8.462 2.784 1.00 0.00 C ATOM 1554 O THR A 94 5.578 8.166 3.440 1.00 0.00 O ATOM 1555 CB THR A 94 8.530 7.444 3.959 1.00 0.00 C ATOM 1556 OG1 THR A 94 9.014 8.753 4.277 1.00 0.00 O ATOM 1557 CG2 THR A 94 9.699 6.476 3.860 1.00 0.00 C ATOM 0 H THR A 94 9.328 8.509 1.742 1.00 0.00 H new ATOM 0 HA THR A 94 7.343 6.486 2.434 1.00 0.00 H new ATOM 0 HB THR A 94 7.862 7.103 4.750 1.00 0.00 H new ATOM 0 HG1 THR A 94 9.516 8.721 5.118 1.00 0.00 H new ATOM 0 HG21 THR A 94 10.245 6.467 4.803 1.00 0.00 H new ATOM 0 HG22 THR A 94 9.325 5.474 3.648 1.00 0.00 H new ATOM 0 HG23 THR A 94 10.366 6.792 3.058 1.00 0.00 H new ATOM 1565 N LYS A 95 6.717 9.631 2.168 1.00 0.00 N ATOM 1566 CA LYS A 95 5.682 10.655 2.227 1.00 0.00 C ATOM 1567 C LYS A 95 4.466 10.247 1.401 1.00 0.00 C ATOM 1568 O LYS A 95 3.358 10.736 1.626 1.00 0.00 O ATOM 1569 CB LYS A 95 6.229 11.992 1.721 1.00 0.00 C ATOM 1570 CG LYS A 95 6.596 12.959 2.834 1.00 0.00 C ATOM 1571 CD LYS A 95 7.610 12.351 3.789 1.00 0.00 C ATOM 1572 CE LYS A 95 8.486 13.419 4.425 1.00 0.00 C ATOM 1573 NZ LYS A 95 9.453 12.836 5.396 1.00 0.00 N ATOM 0 H LYS A 95 7.538 9.893 1.622 1.00 0.00 H new ATOM 0 HA LYS A 95 5.374 10.765 3.267 1.00 0.00 H new ATOM 0 HB2 LYS A 95 7.110 11.806 1.108 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.485 12.459 1.076 1.00 0.00 H new ATOM 0 HG2 LYS A 95 7.003 13.874 2.403 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.698 13.239 3.385 1.00 0.00 H new ATOM 0 HD2 LYS A 95 7.089 11.794 4.568 1.00 0.00 H new ATOM 0 HD3 LYS A 95 8.236 11.638 3.252 1.00 0.00 H new ATOM 0 HE2 LYS A 95 9.030 13.953 3.646 1.00 0.00 H new ATOM 0 HE3 LYS A 95 7.857 14.150 4.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 10.066 13.589 5.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 8.933 12.391 6.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 10.037 12.120 4.918 1.00 0.00 H new ATOM 1587 N LEU A 96 4.679 9.348 0.447 1.00 0.00 N ATOM 1588 CA LEU A 96 3.599 8.873 -0.412 1.00 0.00 C ATOM 1589 C LEU A 96 2.851 7.717 0.244 1.00 0.00 C ATOM 1590 O LEU A 96 1.621 7.712 0.302 1.00 0.00 O ATOM 1591 CB LEU A 96 4.155 8.432 -1.767 1.00 0.00 C ATOM 1592 CG LEU A 96 4.985 9.471 -2.522 1.00 0.00 C ATOM 1593 CD1 LEU A 96 4.378 10.857 -2.362 1.00 0.00 C ATOM 1594 CD2 LEU A 96 6.427 9.458 -2.036 1.00 0.00 C ATOM 0 H LEU A 96 5.589 8.933 0.248 1.00 0.00 H new ATOM 0 HA LEU A 96 2.900 9.695 -0.564 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.771 7.546 -1.614 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.320 8.134 -2.400 1.00 0.00 H new ATOM 0 HG LEU A 96 4.978 9.214 -3.581 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.982 11.584 -2.906 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.363 10.858 -2.760 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.354 11.124 -1.305 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.003 10.204 -2.584 1.00 0.00 H new ATOM 0 HD22 LEU A 96 6.454 9.690 -0.971 1.00 0.00 H new ATOM 0 HD23 LEU A 96 6.859 8.471 -2.204 1.00 0.00 H new ATOM 1606 N LEU A 97 3.602 6.738 0.739 1.00 0.00 N ATOM 1607 CA LEU A 97 3.010 5.577 1.394 1.00 0.00 C ATOM 1608 C LEU A 97 2.430 5.954 2.754 1.00 0.00 C ATOM 1609 O LEU A 97 1.242 5.759 3.009 1.00 0.00 O ATOM 1610 CB LEU A 97 4.056 4.473 1.562 1.00 0.00 C ATOM 1611 CG LEU A 97 5.004 4.262 0.381 1.00 0.00 C ATOM 1612 CD1 LEU A 97 5.973 3.127 0.671 1.00 0.00 C ATOM 1613 CD2 LEU A 97 4.217 3.983 -0.892 1.00 0.00 C ATOM 0 H LEU A 97 4.621 6.726 0.699 1.00 0.00 H new ATOM 0 HA LEU A 97 2.200 5.210 0.764 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.653 4.697 2.446 1.00 0.00 H new ATOM 0 HB3 LEU A 97 3.537 3.535 1.758 1.00 0.00 H new ATOM 0 HG LEU A 97 5.580 5.176 0.235 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.640 2.991 -0.181 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.560 3.368 1.557 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.415 2.207 0.845 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.908 3.835 -1.722 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.614 3.085 -0.758 1.00 0.00 H new ATOM 0 HD23 LEU A 97 3.565 4.829 -1.109 1.00 0.00 H new ATOM 1625 N ALA A 98 3.277 6.498 3.622 1.00 0.00 N ATOM 1626 CA ALA A 98 2.848 6.908 4.953 1.00 0.00 C ATOM 1627 C ALA A 98 2.407 5.705 5.782 1.00 0.00 C ATOM 1628 O ALA A 98 1.250 5.613 6.191 1.00 0.00 O ATOM 1629 CB ALA A 98 1.721 7.925 4.855 1.00 0.00 C ATOM 0 H ALA A 98 4.264 6.665 3.427 1.00 0.00 H new ATOM 0 HA ALA A 98 3.697 7.371 5.455 1.00 0.00 H new ATOM 0 HB1 ALA A 98 1.411 8.222 5.857 1.00 0.00 H new ATOM 0 HB2 ALA A 98 2.068 8.801 4.308 1.00 0.00 H new ATOM 0 HB3 ALA A 98 0.875 7.481 4.330 1.00 0.00 H new ATOM 1635 N ARG A 99 3.337 4.787 6.024 1.00 0.00 N ATOM 1636 CA ARG A 99 3.043 3.590 6.802 1.00 0.00 C ATOM 1637 C ARG A 99 4.315 3.017 7.421 1.00 0.00 C ATOM 1638 O ARG A 99 5.407 3.550 7.222 1.00 0.00 O ATOM 1639 CB ARG A 99 2.372 2.535 5.921 1.00 0.00 C ATOM 1640 CG ARG A 99 3.160 2.200 4.665 1.00 0.00 C ATOM 1641 CD ARG A 99 2.240 1.846 3.508 1.00 0.00 C ATOM 1642 NE ARG A 99 1.307 2.927 3.200 1.00 0.00 N ATOM 1643 CZ ARG A 99 0.208 2.764 2.472 1.00 0.00 C ATOM 1644 NH1 ARG A 99 -0.095 1.570 1.980 1.00 0.00 N ATOM 1645 NH2 ARG A 99 -0.591 3.796 2.235 1.00 0.00 N ATOM 0 H ARG A 99 4.300 4.849 5.693 1.00 0.00 H new ATOM 0 HA ARG A 99 2.362 3.869 7.606 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.229 1.625 6.504 1.00 0.00 H new ATOM 0 HB3 ARG A 99 1.382 2.889 5.635 1.00 0.00 H new ATOM 0 HG2 ARG A 99 3.784 3.050 4.388 1.00 0.00 H new ATOM 0 HG3 ARG A 99 3.830 1.365 4.867 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.838 1.621 2.625 1.00 0.00 H new ATOM 0 HD3 ARG A 99 1.681 0.943 3.753 1.00 0.00 H new ATOM 0 HE ARG A 99 1.511 3.858 3.564 1.00 0.00 H new ATOM 0 HH11 ARG A 99 0.517 0.774 2.160 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -0.940 1.448 1.421 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -0.362 4.716 2.612 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -1.435 3.670 1.676 1.00 0.00 H new ATOM 1659 N GLN A 100 4.166 1.930 8.170 1.00 0.00 N ATOM 1660 CA GLN A 100 5.303 1.287 8.818 1.00 0.00 C ATOM 1661 C GLN A 100 5.486 -0.138 8.307 1.00 0.00 C ATOM 1662 O GLN A 100 4.573 -0.958 8.383 1.00 0.00 O ATOM 1663 CB GLN A 100 5.112 1.276 10.336 1.00 0.00 C ATOM 1664 CG GLN A 100 3.884 0.504 10.790 1.00 0.00 C ATOM 1665 CD GLN A 100 3.443 0.880 12.191 1.00 0.00 C ATOM 1666 OE1 GLN A 100 3.741 1.972 12.676 1.00 0.00 O ATOM 1667 NE2 GLN A 100 2.727 -0.024 12.849 1.00 0.00 N ATOM 0 H GLN A 100 3.269 1.476 8.343 1.00 0.00 H new ATOM 0 HA GLN A 100 6.199 1.859 8.575 1.00 0.00 H new ATOM 0 HB2 GLN A 100 5.997 0.842 10.802 1.00 0.00 H new ATOM 0 HB3 GLN A 100 5.037 2.304 10.692 1.00 0.00 H new ATOM 0 HG2 GLN A 100 3.066 0.688 10.094 1.00 0.00 H new ATOM 0 HG3 GLN A 100 4.098 -0.564 10.755 1.00 0.00 H new ATOM 0 HE21 GLN A 100 2.503 -0.916 12.408 1.00 0.00 H new ATOM 0 HE22 GLN A 100 2.401 0.174 13.795 1.00 0.00 H new ATOM 1676 N GLY A 101 6.675 -0.425 7.785 1.00 0.00 N ATOM 1677 CA GLY A 101 6.957 -1.752 7.267 1.00 0.00 C ATOM 1678 C GLY A 101 8.362 -2.215 7.594 1.00 0.00 C ATOM 1679 O GLY A 101 8.827 -3.227 7.070 1.00 0.00 O ATOM 0 H GLY A 101 7.448 0.237 7.712 1.00 0.00 H new ATOM 0 HA2 GLY A 101 6.239 -2.460 7.680 1.00 0.00 H new ATOM 0 HA3 GLY A 101 6.820 -1.753 6.186 1.00 0.00 H new ATOM 1683 N ASP A 102 9.042 -1.472 8.461 1.00 0.00 N ATOM 1684 CA ASP A 102 10.404 -1.811 8.856 1.00 0.00 C ATOM 1685 C ASP A 102 11.350 -1.745 7.661 1.00 0.00 C ATOM 1686 O ASP A 102 12.052 -2.710 7.357 1.00 0.00 O ATOM 1687 CB ASP A 102 10.444 -3.209 9.477 1.00 0.00 C ATOM 1688 CG ASP A 102 9.231 -3.493 10.341 1.00 0.00 C ATOM 1689 OD1 ASP A 102 9.240 -3.097 11.526 1.00 0.00 O ATOM 1690 OD2 ASP A 102 8.273 -4.111 9.833 1.00 0.00 O ATOM 0 H ASP A 102 8.672 -0.631 8.904 1.00 0.00 H new ATOM 0 HA ASP A 102 10.733 -1.082 9.597 1.00 0.00 H new ATOM 0 HB2 ASP A 102 10.504 -3.954 8.684 1.00 0.00 H new ATOM 0 HB3 ASP A 102 11.347 -3.310 10.079 1.00 0.00 H new ATOM 1695 N LEU A 103 11.361 -0.601 6.985 1.00 0.00 N ATOM 1696 CA LEU A 103 12.220 -0.409 5.822 1.00 0.00 C ATOM 1697 C LEU A 103 13.108 0.819 5.998 1.00 0.00 C ATOM 1698 O LEU A 103 13.923 1.137 5.132 1.00 0.00 O ATOM 1699 CB LEU A 103 11.373 -0.262 4.557 1.00 0.00 C ATOM 1700 CG LEU A 103 10.135 0.629 4.677 1.00 0.00 C ATOM 1701 CD1 LEU A 103 9.034 -0.089 5.442 1.00 0.00 C ATOM 1702 CD2 LEU A 103 10.488 1.944 5.356 1.00 0.00 C ATOM 0 H LEU A 103 10.785 0.207 7.222 1.00 0.00 H new ATOM 0 HA LEU A 103 12.859 -1.286 5.724 1.00 0.00 H new ATOM 0 HB2 LEU A 103 12.006 0.135 3.764 1.00 0.00 H new ATOM 0 HB3 LEU A 103 11.052 -1.255 4.241 1.00 0.00 H new ATOM 0 HG LEU A 103 9.770 0.848 3.674 1.00 0.00 H new ATOM 0 HD11 LEU A 103 8.161 0.559 5.518 1.00 0.00 H new ATOM 0 HD12 LEU A 103 8.762 -1.004 4.915 1.00 0.00 H new ATOM 0 HD13 LEU A 103 9.389 -0.338 6.442 1.00 0.00 H new ATOM 0 HD21 LEU A 103 9.595 2.565 5.433 1.00 0.00 H new ATOM 0 HD22 LEU A 103 10.878 1.745 6.354 1.00 0.00 H new ATOM 0 HD23 LEU A 103 11.243 2.466 4.768 1.00 0.00 H new ATOM 1714 N ALA A 104 12.947 1.503 7.126 1.00 0.00 N ATOM 1715 CA ALA A 104 13.737 2.692 7.418 1.00 0.00 C ATOM 1716 C ALA A 104 15.229 2.373 7.423 1.00 0.00 C ATOM 1717 O ALA A 104 15.652 1.345 7.950 1.00 0.00 O ATOM 1718 CB ALA A 104 13.319 3.289 8.754 1.00 0.00 C ATOM 0 H ALA A 104 12.276 1.254 7.853 1.00 0.00 H new ATOM 0 HA ALA A 104 13.551 3.423 6.631 1.00 0.00 H new ATOM 0 HB1 ALA A 104 13.918 4.177 8.959 1.00 0.00 H new ATOM 0 HB2 ALA A 104 12.265 3.563 8.716 1.00 0.00 H new ATOM 0 HB3 ALA A 104 13.475 2.555 9.545 1.00 0.00 H new ATOM 1724 N GLY A 105 16.021 3.261 6.831 1.00 0.00 N ATOM 1725 CA GLY A 105 17.457 3.055 6.778 1.00 0.00 C ATOM 1726 C GLY A 105 18.101 3.765 5.604 1.00 0.00 C ATOM 1727 O GLY A 105 18.250 4.987 5.614 1.00 0.00 O ATOM 0 H GLY A 105 15.694 4.119 6.387 1.00 0.00 H new ATOM 0 HA2 GLY A 105 17.907 3.411 7.705 1.00 0.00 H new ATOM 0 HA3 GLY A 105 17.666 1.987 6.712 1.00 0.00 H new ATOM 1731 N ALA A 106 18.487 2.998 4.590 1.00 0.00 N ATOM 1732 CA ALA A 106 19.119 3.561 3.403 1.00 0.00 C ATOM 1733 C ALA A 106 18.159 4.478 2.653 1.00 0.00 C ATOM 1734 O ALA A 106 17.256 4.012 1.958 1.00 0.00 O ATOM 1735 CB ALA A 106 19.612 2.448 2.489 1.00 0.00 C ATOM 0 H ALA A 106 18.373 1.985 4.567 1.00 0.00 H new ATOM 0 HA ALA A 106 19.973 4.157 3.724 1.00 0.00 H new ATOM 0 HB1 ALA A 106 20.082 2.883 1.607 1.00 0.00 H new ATOM 0 HB2 ALA A 106 20.339 1.835 3.022 1.00 0.00 H new ATOM 0 HB3 ALA A 106 18.769 1.828 2.183 1.00 0.00 H new ATOM 1741 N ASP A 107 18.361 5.783 2.798 1.00 0.00 N ATOM 1742 CA ASP A 107 17.513 6.766 2.134 1.00 0.00 C ATOM 1743 C ASP A 107 18.243 7.407 0.957 1.00 0.00 C ATOM 1744 O ASP A 107 19.437 7.185 0.761 1.00 0.00 O ATOM 1745 CB ASP A 107 17.072 7.844 3.125 1.00 0.00 C ATOM 1746 CG ASP A 107 18.141 8.896 3.349 1.00 0.00 C ATOM 1747 OD1 ASP A 107 19.335 8.530 3.389 1.00 0.00 O ATOM 1748 OD2 ASP A 107 17.784 10.085 3.483 1.00 0.00 O ATOM 0 H ASP A 107 19.104 6.185 3.369 1.00 0.00 H new ATOM 0 HA ASP A 107 16.631 6.251 1.754 1.00 0.00 H new ATOM 0 HB2 ASP A 107 16.166 8.324 2.756 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.820 7.377 4.077 1.00 0.00 H new ATOM 1753 N ALA A 108 17.516 8.201 0.178 1.00 0.00 N ATOM 1754 CA ALA A 108 18.095 8.874 -0.978 1.00 0.00 C ATOM 1755 C ALA A 108 18.527 10.294 -0.627 1.00 0.00 C ATOM 1756 O ALA A 108 18.295 10.767 0.486 1.00 0.00 O ATOM 1757 CB ALA A 108 17.101 8.892 -2.130 1.00 0.00 C ATOM 0 H ALA A 108 16.525 8.394 0.326 1.00 0.00 H new ATOM 0 HA ALA A 108 18.981 8.318 -1.285 1.00 0.00 H new ATOM 0 HB1 ALA A 108 17.546 9.398 -2.987 1.00 0.00 H new ATOM 0 HB2 ALA A 108 16.844 7.869 -2.405 1.00 0.00 H new ATOM 0 HB3 ALA A 108 16.199 9.422 -1.824 1.00 0.00 H new ATOM 1763 N LEU A 109 19.156 10.968 -1.583 1.00 0.00 N ATOM 1764 CA LEU A 109 19.622 12.335 -1.375 1.00 0.00 C ATOM 1765 C LEU A 109 19.937 13.012 -2.705 1.00 0.00 C ATOM 1766 O LEU A 109 19.983 12.361 -3.750 1.00 0.00 O ATOM 1767 CB LEU A 109 20.863 12.341 -0.480 1.00 0.00 C ATOM 1768 CG LEU A 109 21.985 11.385 -0.882 1.00 0.00 C ATOM 1769 CD1 LEU A 109 22.786 11.959 -2.041 1.00 0.00 C ATOM 1770 CD2 LEU A 109 22.893 11.098 0.305 1.00 0.00 C ATOM 0 H LEU A 109 19.355 10.591 -2.510 1.00 0.00 H new ATOM 0 HA LEU A 109 18.825 12.893 -0.884 1.00 0.00 H new ATOM 0 HB2 LEU A 109 21.266 13.354 -0.459 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.554 12.099 0.537 1.00 0.00 H new ATOM 0 HG LEU A 109 21.537 10.446 -1.206 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.581 11.264 -2.313 1.00 0.00 H new ATOM 0 HD12 LEU A 109 22.129 12.112 -2.897 1.00 0.00 H new ATOM 0 HD13 LEU A 109 23.223 12.912 -1.744 1.00 0.00 H new ATOM 0 HD21 LEU A 109 23.686 10.415 -0.000 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.333 12.030 0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 109 22.311 10.643 1.106 1.00 0.00 H new ATOM 1782 N THR A 110 20.156 14.322 -2.660 1.00 0.00 N ATOM 1783 CA THR A 110 20.468 15.087 -3.860 1.00 0.00 C ATOM 1784 C THR A 110 21.513 16.159 -3.573 1.00 0.00 C ATOM 1785 O THR A 110 21.209 17.189 -2.972 1.00 0.00 O ATOM 1786 CB THR A 110 19.209 15.757 -4.443 1.00 0.00 C ATOM 1787 OG1 THR A 110 18.337 16.166 -3.383 1.00 0.00 O ATOM 1788 CG2 THR A 110 18.472 14.806 -5.374 1.00 0.00 C ATOM 0 H THR A 110 20.123 14.876 -1.804 1.00 0.00 H new ATOM 0 HA THR A 110 20.866 14.381 -4.589 1.00 0.00 H new ATOM 0 HB THR A 110 19.521 16.631 -5.015 1.00 0.00 H new ATOM 0 HG1 THR A 110 17.540 16.593 -3.761 1.00 0.00 H new ATOM 0 HG21 THR A 110 17.587 15.301 -5.773 1.00 0.00 H new ATOM 0 HG22 THR A 110 19.129 14.519 -6.195 1.00 0.00 H new ATOM 0 HG23 THR A 110 18.172 13.916 -4.821 1.00 0.00 H new ATOM 1796 N GLU A 111 22.744 15.910 -4.007 1.00 0.00 N ATOM 1797 CA GLU A 111 23.834 16.855 -3.796 1.00 0.00 C ATOM 1798 C GLU A 111 24.569 17.140 -5.103 1.00 0.00 C ATOM 1799 O GLU A 111 24.251 16.566 -6.143 1.00 0.00 O ATOM 1800 CB GLU A 111 24.815 16.312 -2.755 1.00 0.00 C ATOM 1801 CG GLU A 111 25.387 14.950 -3.109 1.00 0.00 C ATOM 1802 CD GLU A 111 26.192 14.342 -1.977 1.00 0.00 C ATOM 1803 OE1 GLU A 111 27.147 14.997 -1.509 1.00 0.00 O ATOM 1804 OE2 GLU A 111 25.866 13.211 -1.559 1.00 0.00 O ATOM 0 H GLU A 111 23.012 15.062 -4.507 1.00 0.00 H new ATOM 0 HA GLU A 111 23.405 17.788 -3.430 1.00 0.00 H new ATOM 0 HB2 GLU A 111 25.634 17.021 -2.636 1.00 0.00 H new ATOM 0 HB3 GLU A 111 24.309 16.245 -1.792 1.00 0.00 H new ATOM 0 HG2 GLU A 111 24.572 14.276 -3.373 1.00 0.00 H new ATOM 0 HG3 GLU A 111 26.021 15.045 -3.991 1.00 0.00 H new ATOM 1811 N ASN A 112 25.552 18.032 -5.040 1.00 0.00 N ATOM 1812 CA ASN A 112 26.332 18.394 -6.218 1.00 0.00 C ATOM 1813 C ASN A 112 26.905 17.152 -6.894 1.00 0.00 C ATOM 1814 O ASN A 112 26.896 16.061 -6.324 1.00 0.00 O ATOM 1815 CB ASN A 112 27.465 19.347 -5.832 1.00 0.00 C ATOM 1816 CG ASN A 112 26.964 20.742 -5.513 1.00 0.00 C ATOM 1817 OD1 ASN A 112 26.564 21.489 -6.407 1.00 0.00 O ATOM 1818 ND2 ASN A 112 26.983 21.100 -4.235 1.00 0.00 N ATOM 0 H ASN A 112 25.827 18.517 -4.186 1.00 0.00 H new ATOM 0 HA ASN A 112 25.668 18.896 -6.922 1.00 0.00 H new ATOM 0 HB2 ASN A 112 27.993 18.947 -4.967 1.00 0.00 H new ATOM 0 HB3 ASN A 112 28.185 19.400 -6.649 1.00 0.00 H new ATOM 0 HD21 ASN A 112 26.658 22.027 -3.960 1.00 0.00 H new ATOM 0 HD22 ASN A 112 27.323 20.448 -3.528 1.00 0.00 H new ATOM 1825 N THR A 113 27.404 17.327 -8.114 1.00 0.00 N ATOM 1826 CA THR A 113 27.980 16.221 -8.869 1.00 0.00 C ATOM 1827 C THR A 113 29.117 15.562 -8.097 1.00 0.00 C ATOM 1828 O THR A 113 29.936 16.242 -7.477 1.00 0.00 O ATOM 1829 CB THR A 113 28.509 16.691 -10.238 1.00 0.00 C ATOM 1830 OG1 THR A 113 29.010 15.573 -10.979 1.00 0.00 O ATOM 1831 CG2 THR A 113 29.610 17.727 -10.066 1.00 0.00 C ATOM 0 H THR A 113 27.421 18.224 -8.600 1.00 0.00 H new ATOM 0 HA THR A 113 27.182 15.495 -9.025 1.00 0.00 H new ATOM 0 HB THR A 113 27.684 17.148 -10.784 1.00 0.00 H new ATOM 0 HG1 THR A 113 29.343 15.879 -11.848 1.00 0.00 H new ATOM 0 HG21 THR A 113 29.968 18.044 -11.046 1.00 0.00 H new ATOM 0 HG22 THR A 113 29.217 18.589 -9.527 1.00 0.00 H new ATOM 0 HG23 THR A 113 30.435 17.291 -9.502 1.00 0.00 H new ATOM 1839 N ASP A 114 29.163 14.235 -8.139 1.00 0.00 N ATOM 1840 CA ASP A 114 30.202 13.483 -7.444 1.00 0.00 C ATOM 1841 C ASP A 114 30.205 12.024 -7.887 1.00 0.00 C ATOM 1842 O ASP A 114 29.339 11.594 -8.648 1.00 0.00 O ATOM 1843 CB ASP A 114 29.997 13.569 -5.930 1.00 0.00 C ATOM 1844 CG ASP A 114 28.923 12.619 -5.437 1.00 0.00 C ATOM 1845 OD1 ASP A 114 27.886 12.489 -6.120 1.00 0.00 O ATOM 1846 OD2 ASP A 114 29.121 12.005 -4.368 1.00 0.00 O ATOM 0 H ASP A 114 28.493 13.658 -8.647 1.00 0.00 H new ATOM 0 HA ASP A 114 31.166 13.923 -7.698 1.00 0.00 H new ATOM 0 HB2 ASP A 114 30.937 13.344 -5.426 1.00 0.00 H new ATOM 0 HB3 ASP A 114 29.727 14.590 -5.660 1.00 0.00 H new ATOM 1851 N ALA A 115 31.186 11.267 -7.407 1.00 0.00 N ATOM 1852 CA ALA A 115 31.302 9.856 -7.753 1.00 0.00 C ATOM 1853 C ALA A 115 30.000 9.113 -7.473 1.00 0.00 C ATOM 1854 O ALA A 115 29.305 9.404 -6.499 1.00 0.00 O ATOM 1855 CB ALA A 115 32.452 9.217 -6.988 1.00 0.00 C ATOM 0 H ALA A 115 31.912 11.608 -6.777 1.00 0.00 H new ATOM 0 HA ALA A 115 31.507 9.785 -8.821 1.00 0.00 H new ATOM 0 HB1 ALA A 115 32.527 8.163 -7.256 1.00 0.00 H new ATOM 0 HB2 ALA A 115 33.383 9.723 -7.242 1.00 0.00 H new ATOM 0 HB3 ALA A 115 32.271 9.307 -5.917 1.00 0.00 H new ATOM 1861 N LYS A 116 29.675 8.153 -8.332 1.00 0.00 N ATOM 1862 CA LYS A 116 28.457 7.367 -8.177 1.00 0.00 C ATOM 1863 C LYS A 116 28.779 5.950 -7.714 1.00 0.00 C ATOM 1864 O LYS A 116 29.877 5.444 -7.946 1.00 0.00 O ATOM 1865 CB LYS A 116 27.684 7.322 -9.497 1.00 0.00 C ATOM 1866 CG LYS A 116 26.196 7.070 -9.322 1.00 0.00 C ATOM 1867 CD LYS A 116 25.454 8.345 -8.959 1.00 0.00 C ATOM 1868 CE LYS A 116 23.951 8.117 -8.896 1.00 0.00 C ATOM 1869 NZ LYS A 116 23.425 7.537 -10.162 1.00 0.00 N ATOM 0 H LYS A 116 30.239 7.900 -9.144 1.00 0.00 H new ATOM 0 HA LYS A 116 27.839 7.846 -7.418 1.00 0.00 H new ATOM 0 HB2 LYS A 116 27.825 8.266 -10.023 1.00 0.00 H new ATOM 0 HB3 LYS A 116 28.105 6.539 -10.128 1.00 0.00 H new ATOM 0 HG2 LYS A 116 25.785 6.658 -10.244 1.00 0.00 H new ATOM 0 HG3 LYS A 116 26.042 6.324 -8.543 1.00 0.00 H new ATOM 0 HD2 LYS A 116 25.808 8.711 -7.995 1.00 0.00 H new ATOM 0 HD3 LYS A 116 25.675 9.118 -9.695 1.00 0.00 H new ATOM 0 HE2 LYS A 116 23.719 7.449 -8.067 1.00 0.00 H new ATOM 0 HE3 LYS A 116 23.448 9.063 -8.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 22.398 7.691 -10.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 23.886 7.998 -10.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 23.624 6.516 -10.185 1.00 0.00 H new ATOM 1883 N LYS A 117 27.814 5.313 -7.060 1.00 0.00 N ATOM 1884 CA LYS A 117 27.992 3.952 -6.567 1.00 0.00 C ATOM 1885 C LYS A 117 28.425 3.018 -7.693 1.00 0.00 C ATOM 1886 O LYS A 117 28.347 3.369 -8.870 1.00 0.00 O ATOM 1887 CB LYS A 117 26.695 3.442 -5.936 1.00 0.00 C ATOM 1888 CG LYS A 117 26.403 4.045 -4.573 1.00 0.00 C ATOM 1889 CD LYS A 117 24.988 3.731 -4.116 1.00 0.00 C ATOM 1890 CE LYS A 117 24.923 2.401 -3.381 1.00 0.00 C ATOM 1891 NZ LYS A 117 25.177 2.559 -1.923 1.00 0.00 N ATOM 0 H LYS A 117 26.900 5.718 -6.859 1.00 0.00 H new ATOM 0 HA LYS A 117 28.775 3.966 -5.809 1.00 0.00 H new ATOM 0 HB2 LYS A 117 25.864 3.661 -6.606 1.00 0.00 H new ATOM 0 HB3 LYS A 117 26.750 2.358 -5.840 1.00 0.00 H new ATOM 0 HG2 LYS A 117 27.116 3.660 -3.844 1.00 0.00 H new ATOM 0 HG3 LYS A 117 26.542 5.125 -4.615 1.00 0.00 H new ATOM 0 HD2 LYS A 117 24.630 4.527 -3.463 1.00 0.00 H new ATOM 0 HD3 LYS A 117 24.323 3.704 -4.979 1.00 0.00 H new ATOM 0 HE2 LYS A 117 23.942 1.951 -3.532 1.00 0.00 H new ATOM 0 HE3 LYS A 117 25.657 1.716 -3.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 25.124 1.630 -1.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 26.123 2.965 -1.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 24.462 3.193 -1.513 1.00 0.00 H new ATOM 1905 N THR A 118 28.879 1.824 -7.324 1.00 0.00 N ATOM 1906 CA THR A 118 29.323 0.840 -8.302 1.00 0.00 C ATOM 1907 C THR A 118 28.233 -0.188 -8.581 1.00 0.00 C ATOM 1908 O THR A 118 27.885 -0.988 -7.713 1.00 0.00 O ATOM 1909 CB THR A 118 30.593 0.108 -7.826 1.00 0.00 C ATOM 1910 OG1 THR A 118 30.368 -0.475 -6.538 1.00 0.00 O ATOM 1911 CG2 THR A 118 31.774 1.064 -7.757 1.00 0.00 C ATOM 0 H THR A 118 28.949 1.516 -6.354 1.00 0.00 H new ATOM 0 HA THR A 118 29.548 1.385 -9.219 1.00 0.00 H new ATOM 0 HB THR A 118 30.824 -0.678 -8.545 1.00 0.00 H new ATOM 0 HG1 THR A 118 29.454 -0.827 -6.493 1.00 0.00 H new ATOM 0 HG21 THR A 118 32.659 0.525 -7.419 1.00 0.00 H new ATOM 0 HG22 THR A 118 31.961 1.484 -8.745 1.00 0.00 H new ATOM 0 HG23 THR A 118 31.550 1.869 -7.057 1.00 0.00 H new ATOM 1919 N GLN A 119 27.699 -0.161 -9.798 1.00 0.00 N ATOM 1920 CA GLN A 119 26.647 -1.092 -10.191 1.00 0.00 C ATOM 1921 C GLN A 119 26.884 -1.616 -11.603 1.00 0.00 C ATOM 1922 O GLN A 119 26.739 -0.882 -12.582 1.00 0.00 O ATOM 1923 CB GLN A 119 25.279 -0.413 -10.108 1.00 0.00 C ATOM 1924 CG GLN A 119 25.223 0.931 -10.816 1.00 0.00 C ATOM 1925 CD GLN A 119 23.942 1.690 -10.529 1.00 0.00 C ATOM 1926 OE1 GLN A 119 23.687 2.092 -9.394 1.00 0.00 O ATOM 1927 NE2 GLN A 119 23.129 1.890 -11.560 1.00 0.00 N ATOM 0 H GLN A 119 27.977 0.495 -10.528 1.00 0.00 H new ATOM 0 HA GLN A 119 26.667 -1.936 -9.502 1.00 0.00 H new ATOM 0 HB2 GLN A 119 24.528 -1.074 -10.541 1.00 0.00 H new ATOM 0 HB3 GLN A 119 25.015 -0.273 -9.060 1.00 0.00 H new ATOM 0 HG2 GLN A 119 26.076 1.536 -10.507 1.00 0.00 H new ATOM 0 HG3 GLN A 119 25.315 0.775 -11.891 1.00 0.00 H new ATOM 0 HE21 GLN A 119 23.381 1.539 -12.484 1.00 0.00 H new ATOM 0 HE22 GLN A 119 22.253 2.395 -11.428 1.00 0.00 H new ATOM 1936 N LYS A 120 27.248 -2.890 -11.703 1.00 0.00 N ATOM 1937 CA LYS A 120 27.504 -3.514 -12.996 1.00 0.00 C ATOM 1938 C LYS A 120 26.774 -4.848 -13.110 1.00 0.00 C ATOM 1939 O LYS A 120 27.384 -5.917 -13.142 1.00 0.00 O ATOM 1940 CB LYS A 120 29.007 -3.724 -13.195 1.00 0.00 C ATOM 1941 CG LYS A 120 29.414 -3.863 -14.651 1.00 0.00 C ATOM 1942 CD LYS A 120 29.619 -2.506 -15.304 1.00 0.00 C ATOM 1943 CE LYS A 120 29.330 -2.556 -16.797 1.00 0.00 C ATOM 1944 NZ LYS A 120 27.901 -2.868 -17.074 1.00 0.00 N ATOM 0 H LYS A 120 27.372 -3.511 -10.903 1.00 0.00 H new ATOM 0 HA LYS A 120 27.130 -2.848 -13.774 1.00 0.00 H new ATOM 0 HB2 LYS A 120 29.544 -2.884 -12.755 1.00 0.00 H new ATOM 0 HB3 LYS A 120 29.315 -4.618 -12.653 1.00 0.00 H new ATOM 0 HG2 LYS A 120 30.334 -4.443 -14.719 1.00 0.00 H new ATOM 0 HG3 LYS A 120 28.647 -4.417 -15.193 1.00 0.00 H new ATOM 0 HD2 LYS A 120 28.968 -1.771 -14.831 1.00 0.00 H new ATOM 0 HD3 LYS A 120 30.645 -2.174 -15.142 1.00 0.00 H new ATOM 0 HE2 LYS A 120 29.587 -1.598 -17.249 1.00 0.00 H new ATOM 0 HE3 LYS A 120 29.964 -3.309 -17.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 27.625 -2.449 -17.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 27.772 -3.899 -17.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 27.307 -2.474 -16.317 1.00 0.00 H new ATOM 1958 N PRO A 121 25.435 -4.787 -13.175 1.00 0.00 N ATOM 1959 CA PRO A 121 24.593 -5.982 -13.289 1.00 0.00 C ATOM 1960 C PRO A 121 24.726 -6.657 -14.650 1.00 0.00 C ATOM 1961 O PRO A 121 25.576 -6.283 -15.460 1.00 0.00 O ATOM 1962 CB PRO A 121 23.176 -5.436 -13.099 1.00 0.00 C ATOM 1963 CG PRO A 121 23.260 -4.009 -13.519 1.00 0.00 C ATOM 1964 CD PRO A 121 24.641 -3.548 -13.143 1.00 0.00 C ATOM 0 HA PRO A 121 24.871 -6.747 -12.564 1.00 0.00 H new ATOM 0 HB2 PRO A 121 22.456 -5.985 -13.705 1.00 0.00 H new ATOM 0 HB3 PRO A 121 22.853 -5.525 -12.062 1.00 0.00 H new ATOM 0 HG2 PRO A 121 23.093 -3.907 -14.591 1.00 0.00 H new ATOM 0 HG3 PRO A 121 22.499 -3.410 -13.020 1.00 0.00 H new ATOM 0 HD2 PRO A 121 25.023 -2.808 -13.846 1.00 0.00 H new ATOM 0 HD3 PRO A 121 24.656 -3.087 -12.155 1.00 0.00 H new ATOM 1972 N LEU A 122 23.883 -7.653 -14.895 1.00 0.00 N ATOM 1973 CA LEU A 122 23.906 -8.381 -16.159 1.00 0.00 C ATOM 1974 C LEU A 122 22.502 -8.503 -16.743 1.00 0.00 C ATOM 1975 O LEU A 122 21.604 -9.062 -16.113 1.00 0.00 O ATOM 1976 CB LEU A 122 24.510 -9.772 -15.959 1.00 0.00 C ATOM 1977 CG LEU A 122 24.043 -10.534 -14.718 1.00 0.00 C ATOM 1978 CD1 LEU A 122 24.072 -12.033 -14.970 1.00 0.00 C ATOM 1979 CD2 LEU A 122 24.906 -10.176 -13.516 1.00 0.00 C ATOM 0 H LEU A 122 23.175 -7.975 -14.235 1.00 0.00 H new ATOM 0 HA LEU A 122 24.524 -7.821 -16.861 1.00 0.00 H new ATOM 0 HB2 LEU A 122 24.282 -10.375 -16.838 1.00 0.00 H new ATOM 0 HB3 LEU A 122 25.594 -9.672 -15.913 1.00 0.00 H new ATOM 0 HG LEU A 122 23.015 -10.243 -14.502 1.00 0.00 H new ATOM 0 HD11 LEU A 122 23.737 -12.559 -14.076 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.411 -12.275 -15.803 1.00 0.00 H new ATOM 0 HD13 LEU A 122 25.089 -12.342 -15.212 1.00 0.00 H new ATOM 0 HD21 LEU A 122 24.559 -10.727 -12.642 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.944 -10.438 -13.722 1.00 0.00 H new ATOM 0 HD23 LEU A 122 24.834 -9.106 -13.322 1.00 0.00 H new ATOM 1991 N ILE A 123 22.321 -7.980 -17.951 1.00 0.00 N ATOM 1992 CA ILE A 123 21.028 -8.033 -18.621 1.00 0.00 C ATOM 1993 C ILE A 123 21.067 -8.978 -19.817 1.00 0.00 C ATOM 1994 O ILE A 123 21.886 -8.817 -20.721 1.00 0.00 O ATOM 1995 CB ILE A 123 20.583 -6.638 -19.097 1.00 0.00 C ATOM 1996 CG1 ILE A 123 20.592 -5.649 -17.929 1.00 0.00 C ATOM 1997 CG2 ILE A 123 19.199 -6.710 -19.727 1.00 0.00 C ATOM 1998 CD1 ILE A 123 20.400 -4.210 -18.355 1.00 0.00 C ATOM 0 H ILE A 123 23.054 -7.514 -18.486 1.00 0.00 H new ATOM 0 HA ILE A 123 20.309 -8.405 -17.891 1.00 0.00 H new ATOM 0 HB ILE A 123 21.287 -6.286 -19.851 1.00 0.00 H new ATOM 0 HG12 ILE A 123 19.803 -5.920 -17.228 1.00 0.00 H new ATOM 0 HG13 ILE A 123 21.538 -5.738 -17.395 1.00 0.00 H new ATOM 0 HG21 ILE A 123 18.898 -5.716 -20.059 1.00 0.00 H new ATOM 0 HG22 ILE A 123 19.223 -7.386 -20.582 1.00 0.00 H new ATOM 0 HG23 ILE A 123 18.484 -7.079 -18.992 1.00 0.00 H new ATOM 0 HD11 ILE A 123 20.417 -3.565 -17.476 1.00 0.00 H new ATOM 0 HD12 ILE A 123 21.203 -3.921 -19.033 1.00 0.00 H new ATOM 0 HD13 ILE A 123 19.441 -4.106 -18.863 1.00 0.00 H new ATOM 2010 N GLN A 124 20.174 -9.963 -19.815 1.00 0.00 N ATOM 2011 CA GLN A 124 20.106 -10.934 -20.901 1.00 0.00 C ATOM 2012 C GLN A 124 19.742 -10.254 -22.217 1.00 0.00 C ATOM 2013 O GLN A 124 19.500 -9.048 -22.256 1.00 0.00 O ATOM 2014 CB GLN A 124 19.084 -12.024 -20.576 1.00 0.00 C ATOM 2015 CG GLN A 124 17.661 -11.504 -20.445 1.00 0.00 C ATOM 2016 CD GLN A 124 17.325 -11.074 -19.030 1.00 0.00 C ATOM 2017 OE1 GLN A 124 17.054 -9.900 -18.774 1.00 0.00 O ATOM 2018 NE2 GLN A 124 17.341 -12.024 -18.103 1.00 0.00 N ATOM 0 H GLN A 124 19.488 -10.110 -19.074 1.00 0.00 H new ATOM 0 HA GLN A 124 21.090 -11.390 -21.009 1.00 0.00 H new ATOM 0 HB2 GLN A 124 19.114 -12.783 -21.357 1.00 0.00 H new ATOM 0 HB3 GLN A 124 19.370 -12.513 -19.645 1.00 0.00 H new ATOM 0 HG2 GLN A 124 17.523 -10.659 -21.120 1.00 0.00 H new ATOM 0 HG3 GLN A 124 16.964 -12.281 -20.760 1.00 0.00 H new ATOM 0 HE21 GLN A 124 17.571 -12.984 -18.360 1.00 0.00 H new ATOM 0 HE22 GLN A 124 17.123 -11.794 -17.133 1.00 0.00 H new ATOM 2027 N GLU A 125 19.705 -11.036 -23.291 1.00 0.00 N ATOM 2028 CA GLU A 125 19.371 -10.507 -24.609 1.00 0.00 C ATOM 2029 C GLU A 125 18.216 -11.286 -25.230 1.00 0.00 C ATOM 2030 O GLU A 125 18.209 -12.517 -25.227 1.00 0.00 O ATOM 2031 CB GLU A 125 20.592 -10.563 -25.529 1.00 0.00 C ATOM 2032 CG GLU A 125 20.432 -9.748 -26.802 1.00 0.00 C ATOM 2033 CD GLU A 125 21.762 -9.394 -27.439 1.00 0.00 C ATOM 2034 OE1 GLU A 125 22.292 -10.223 -28.207 1.00 0.00 O ATOM 2035 OE2 GLU A 125 22.272 -8.287 -27.169 1.00 0.00 O ATOM 0 H GLU A 125 19.902 -12.037 -23.275 1.00 0.00 H new ATOM 0 HA GLU A 125 19.063 -9.468 -24.489 1.00 0.00 H new ATOM 0 HB2 GLU A 125 21.464 -10.202 -24.984 1.00 0.00 H new ATOM 0 HB3 GLU A 125 20.789 -11.602 -25.795 1.00 0.00 H new ATOM 0 HG2 GLU A 125 19.830 -10.310 -27.516 1.00 0.00 H new ATOM 0 HG3 GLU A 125 19.886 -8.832 -26.576 1.00 0.00 H new ATOM 2042 N VAL A 126 17.239 -10.560 -25.763 1.00 0.00 N ATOM 2043 CA VAL A 126 16.078 -11.181 -26.389 1.00 0.00 C ATOM 2044 C VAL A 126 15.661 -10.425 -27.646 1.00 0.00 C ATOM 2045 O VAL A 126 15.719 -9.197 -27.690 1.00 0.00 O ATOM 2046 CB VAL A 126 14.883 -11.242 -25.419 1.00 0.00 C ATOM 2047 CG1 VAL A 126 14.538 -9.852 -24.908 1.00 0.00 C ATOM 2048 CG2 VAL A 126 13.681 -11.884 -26.096 1.00 0.00 C ATOM 0 H VAL A 126 17.228 -9.540 -25.774 1.00 0.00 H new ATOM 0 HA VAL A 126 16.369 -12.196 -26.659 1.00 0.00 H new ATOM 0 HB VAL A 126 15.162 -11.858 -24.564 1.00 0.00 H new ATOM 0 HG11 VAL A 126 13.692 -9.915 -24.224 1.00 0.00 H new ATOM 0 HG12 VAL A 126 15.397 -9.433 -24.384 1.00 0.00 H new ATOM 0 HG13 VAL A 126 14.278 -9.209 -25.749 1.00 0.00 H new ATOM 0 HG21 VAL A 126 12.846 -11.919 -25.397 1.00 0.00 H new ATOM 0 HG22 VAL A 126 13.399 -11.296 -26.970 1.00 0.00 H new ATOM 0 HG23 VAL A 126 13.937 -12.897 -26.407 1.00 0.00 H new ATOM 2058 N GLU A 127 15.239 -11.168 -28.664 1.00 0.00 N ATOM 2059 CA GLU A 127 14.812 -10.566 -29.922 1.00 0.00 C ATOM 2060 C GLU A 127 13.356 -10.118 -29.844 1.00 0.00 C ATOM 2061 O GLU A 127 12.449 -10.938 -29.690 1.00 0.00 O ATOM 2062 CB GLU A 127 14.991 -11.558 -31.074 1.00 0.00 C ATOM 2063 CG GLU A 127 16.382 -11.535 -31.686 1.00 0.00 C ATOM 2064 CD GLU A 127 16.611 -10.322 -32.567 1.00 0.00 C ATOM 2065 OE1 GLU A 127 15.794 -9.379 -32.502 1.00 0.00 O ATOM 2066 OE2 GLU A 127 17.606 -10.315 -33.321 1.00 0.00 O ATOM 0 H GLU A 127 15.184 -12.186 -28.643 1.00 0.00 H new ATOM 0 HA GLU A 127 15.434 -9.690 -30.106 1.00 0.00 H new ATOM 0 HB2 GLU A 127 14.779 -12.564 -30.712 1.00 0.00 H new ATOM 0 HB3 GLU A 127 14.258 -11.337 -31.850 1.00 0.00 H new ATOM 0 HG2 GLU A 127 17.126 -11.547 -30.889 1.00 0.00 H new ATOM 0 HG3 GLU A 127 16.531 -12.440 -32.274 1.00 0.00 H new ATOM 2073 N THR A 128 13.138 -8.811 -29.951 1.00 0.00 N ATOM 2074 CA THR A 128 11.793 -8.253 -29.891 1.00 0.00 C ATOM 2075 C THR A 128 11.093 -8.360 -31.241 1.00 0.00 C ATOM 2076 O THR A 128 11.700 -8.127 -32.286 1.00 0.00 O ATOM 2077 CB THR A 128 11.817 -6.776 -29.453 1.00 0.00 C ATOM 2078 OG1 THR A 128 12.672 -6.616 -28.315 1.00 0.00 O ATOM 2079 CG2 THR A 128 10.416 -6.290 -29.113 1.00 0.00 C ATOM 0 H THR A 128 13.876 -8.119 -30.080 1.00 0.00 H new ATOM 0 HA THR A 128 11.242 -8.834 -29.152 1.00 0.00 H new ATOM 0 HB THR A 128 12.200 -6.180 -30.281 1.00 0.00 H new ATOM 0 HG1 THR A 128 12.683 -5.674 -28.044 1.00 0.00 H new ATOM 0 HG21 THR A 128 10.458 -5.245 -28.806 1.00 0.00 H new ATOM 0 HG22 THR A 128 9.775 -6.386 -29.989 1.00 0.00 H new ATOM 0 HG23 THR A 128 10.010 -6.891 -28.299 1.00 0.00 H new ATOM 2087 N ASP A 129 9.812 -8.711 -31.211 1.00 0.00 N ATOM 2088 CA ASP A 129 9.028 -8.847 -32.433 1.00 0.00 C ATOM 2089 C ASP A 129 8.269 -7.559 -32.738 1.00 0.00 C ATOM 2090 O ASP A 129 7.902 -6.814 -31.831 1.00 0.00 O ATOM 2091 CB ASP A 129 8.047 -10.014 -32.308 1.00 0.00 C ATOM 2092 CG ASP A 129 7.557 -10.506 -33.656 1.00 0.00 C ATOM 2093 OD1 ASP A 129 8.403 -10.886 -34.492 1.00 0.00 O ATOM 2094 OD2 ASP A 129 6.328 -10.511 -33.874 1.00 0.00 O ATOM 0 H ASP A 129 9.295 -8.906 -30.354 1.00 0.00 H new ATOM 0 HA ASP A 129 9.715 -9.046 -33.256 1.00 0.00 H new ATOM 0 HB2 ASP A 129 8.530 -10.835 -31.778 1.00 0.00 H new ATOM 0 HB3 ASP A 129 7.193 -9.704 -31.705 1.00 0.00 H new ATOM 2099 N GLY A 130 8.039 -7.304 -34.022 1.00 0.00 N ATOM 2100 CA GLY A 130 7.326 -6.105 -34.424 1.00 0.00 C ATOM 2101 C GLY A 130 6.357 -6.360 -35.561 1.00 0.00 C ATOM 2102 O GLY A 130 6.748 -6.382 -36.728 1.00 0.00 O ATOM 0 H GLY A 130 8.333 -7.906 -34.791 1.00 0.00 H new ATOM 0 HA2 GLY A 130 6.781 -5.706 -33.569 1.00 0.00 H new ATOM 0 HA3 GLY A 130 8.044 -5.343 -34.727 1.00 0.00 H new ATOM 2106 N VAL A 131 5.087 -6.556 -35.220 1.00 0.00 N ATOM 2107 CA VAL A 131 4.058 -6.812 -36.221 1.00 0.00 C ATOM 2108 C VAL A 131 3.229 -5.561 -36.490 1.00 0.00 C ATOM 2109 O VAL A 131 2.403 -5.163 -35.668 1.00 0.00 O ATOM 2110 CB VAL A 131 3.119 -7.952 -35.783 1.00 0.00 C ATOM 2111 CG1 VAL A 131 2.139 -8.294 -36.895 1.00 0.00 C ATOM 2112 CG2 VAL A 131 3.924 -9.176 -35.374 1.00 0.00 C ATOM 0 H VAL A 131 4.746 -6.542 -34.259 1.00 0.00 H new ATOM 0 HA VAL A 131 4.573 -7.107 -37.135 1.00 0.00 H new ATOM 0 HB VAL A 131 2.546 -7.617 -34.918 1.00 0.00 H new ATOM 0 HG11 VAL A 131 1.484 -9.101 -36.567 1.00 0.00 H new ATOM 0 HG12 VAL A 131 1.540 -7.416 -37.135 1.00 0.00 H new ATOM 0 HG13 VAL A 131 2.690 -8.611 -37.781 1.00 0.00 H new ATOM 0 HG21 VAL A 131 3.245 -9.972 -35.067 1.00 0.00 H new ATOM 0 HG22 VAL A 131 4.524 -9.516 -36.218 1.00 0.00 H new ATOM 0 HG23 VAL A 131 4.580 -8.919 -34.543 1.00 0.00 H new ATOM 2122 N SER A 132 3.455 -4.944 -37.645 1.00 0.00 N ATOM 2123 CA SER A 132 2.732 -3.735 -38.021 1.00 0.00 C ATOM 2124 C SER A 132 1.934 -3.956 -39.303 1.00 0.00 C ATOM 2125 O SER A 132 2.248 -4.841 -40.098 1.00 0.00 O ATOM 2126 CB SER A 132 3.705 -2.570 -38.207 1.00 0.00 C ATOM 2127 OG SER A 132 4.939 -3.016 -38.742 1.00 0.00 O ATOM 0 H SER A 132 4.134 -5.262 -38.337 1.00 0.00 H new ATOM 0 HA SER A 132 2.036 -3.493 -37.218 1.00 0.00 H new ATOM 0 HB2 SER A 132 3.264 -1.827 -38.872 1.00 0.00 H new ATOM 0 HB3 SER A 132 3.877 -2.079 -37.249 1.00 0.00 H new ATOM 0 HG SER A 132 5.543 -2.252 -38.853 1.00 0.00 H new ATOM 2133 N ASN A 133 0.900 -3.144 -39.496 1.00 0.00 N ATOM 2134 CA ASN A 133 0.056 -3.250 -40.681 1.00 0.00 C ATOM 2135 C ASN A 133 -0.157 -1.882 -41.321 1.00 0.00 C ATOM 2136 O ASN A 133 0.267 -0.861 -40.783 1.00 0.00 O ATOM 2137 CB ASN A 133 -1.294 -3.871 -40.317 1.00 0.00 C ATOM 2138 CG ASN A 133 -1.145 -5.160 -39.531 1.00 0.00 C ATOM 2139 OD1 ASN A 133 -0.396 -6.055 -39.922 1.00 0.00 O ATOM 2140 ND2 ASN A 133 -1.860 -5.259 -38.417 1.00 0.00 N ATOM 0 H ASN A 133 0.626 -2.406 -38.848 1.00 0.00 H new ATOM 0 HA ASN A 133 0.562 -3.893 -41.401 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -1.873 -3.157 -39.732 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -1.858 -4.068 -41.229 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -1.801 -6.103 -37.847 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -2.468 -4.491 -38.131 1.00 0.00 H new ATOM 2147 N ASN A 134 -0.819 -1.871 -42.474 1.00 0.00 N ATOM 2148 CA ASN A 134 -1.089 -0.628 -43.188 1.00 0.00 C ATOM 2149 C ASN A 134 -2.372 0.023 -42.681 1.00 0.00 C ATOM 2150 O ASN A 134 -3.093 -0.554 -41.867 1.00 0.00 O ATOM 2151 CB ASN A 134 -1.198 -0.892 -44.691 1.00 0.00 C ATOM 2152 CG ASN A 134 -1.272 0.388 -45.500 1.00 0.00 C ATOM 2153 OD1 ASN A 134 -2.153 0.552 -46.344 1.00 0.00 O ATOM 2154 ND2 ASN A 134 -0.345 1.304 -45.244 1.00 0.00 N ATOM 0 H ASN A 134 -1.178 -2.708 -42.933 1.00 0.00 H new ATOM 0 HA ASN A 134 -0.259 0.054 -43.005 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -0.337 -1.476 -45.018 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -2.085 -1.494 -44.888 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -0.345 2.186 -45.756 1.00 0.00 H new ATOM 0 HD22 ASN A 134 0.367 1.125 -44.535 1.00 0.00 H new TER 2161 ASN A 134