USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 946 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 833 THR OG1 : rot -162:sc= 0.852 USER MOD Set 1.2: A 867 THR OG1 : rot 71:sc= -0.0331! USER MOD Single : A 786 THR OG1 : rot 180:sc= 0 USER MOD Single : A 788 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 790 THR OG1 : rot 170:sc= 0 USER MOD Single : A 798 TYR OH : rot 180:sc= 0.0063 USER MOD Single : A 800 GLN : amide:sc= -5.49! K(o=-5.5!,f=-0.88) USER MOD Single : A 802 THR OG1 : rot -80:sc= 0.0105 USER MOD Single : A 804 THR OG1 : rot 73:sc= 0.814 USER MOD Single : A 807 THR OG1 : rot 91:sc= 1.27 USER MOD Single : A 809 THR OG1 : rot 70:sc= 1.27 USER MOD Single : A 811 ASN : amide:sc= -0.208 K(o=-0.21,f=-1.3!) USER MOD Single : A 814 SER OG : rot 180:sc= 0 USER MOD Single : A 815 SER OG : rot -72:sc= 1.2 USER MOD Single : A 816 MET CE :methyl -138:sc= -0.617 (180deg=-1.88) USER MOD Single : A 822 MET CE :methyl 159:sc= -0.219 (180deg=-0.828) USER MOD Single : A 825 GLN : amide:sc= -0.785 K(o=-0.78,f=-3.8!) USER MOD Single : A 831 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 834 SER OG : rot 58:sc= 1.22 USER MOD Single : A 838 ASN : amide:sc= 1.23 K(o=1.2,f=-0.056) USER MOD Single : A 841 LYS NZ :NH3+ -167:sc=-0.00305 (180deg=-0.146) USER MOD Single : A 848 SER OG : rot 180:sc= 0 USER MOD Single : A 852 ASN : amide:sc= -0.0942 K(o=-0.094,f=-1.8) USER MOD Single : A 853 SER OG : rot 64:sc= 0.865 USER MOD Single : A 855 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 858 SER OG : rot 75:sc= 0.823 USER MOD Single : A 861 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 869 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 870 MET CE :methyl -173:sc= -0.86 (180deg=-1.01) USER MOD Single : A 875 LYS NZ :NH3+ -112:sc= -0.661 (180deg=-2.67!) USER MOD Single : A 880 HIS : no HD1:sc= -0.184 X(o=-0.18,f=0) USER MOD Single : A 883 SER OG : rot 146:sc= -0.608 USER MOD Single : A 886 GLN : amide:sc= -1.74 K(o=-1.7,f=-0.21) USER MOD Single : A 887 GLN : amide:sc= -0.141 K(o=-0.14,f=-0.95) USER MOD Single : A 888 GLN : amide:sc= 0.683 K(o=0.68,f=-6.6!) USER MOD Single : A 899 MET CE :methyl -158:sc= -0.176 (180deg=-0.792) USER MOD Single : A 901 THR OG1 : rot 72:sc= -0.0234 USER MOD Single : A 902 ASN : amide:sc= -0.363 X(o=-0.36,f=-0.019) USER MOD Single : A 906 GLN : amide:sc= -1.81! K(o=-1.8!,f=-0.42) USER MOD Single : A 907 ASN : amide:sc= -0.154 K(o=-0.15,f=-1.9!) USER MOD Single : A 910 LYS NZ :NH3+ -159:sc= 1.24 (180deg=1.17) USER MOD Single : A 911 LYS NZ :NH3+ -124:sc= 0.63 (180deg=-0.0936) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 781 21.509 -21.608 -14.140 1.00 0.00 N ATOM 2 CA GLY A 781 21.352 -20.801 -15.372 1.00 0.00 C ATOM 3 C GLY A 781 20.399 -19.644 -15.170 1.00 0.00 C ATOM 4 O GLY A 781 19.776 -19.526 -14.112 1.00 0.00 O ATOM 0 HA2 GLY A 781 22.325 -20.420 -15.683 1.00 0.00 H new ATOM 0 HA3 GLY A 781 20.986 -21.437 -16.178 1.00 0.00 H new ATOM 10 N ILE A 782 20.278 -18.793 -16.176 1.00 0.00 N ATOM 11 CA ILE A 782 19.386 -17.646 -16.098 1.00 0.00 C ATOM 12 C ILE A 782 18.020 -18.002 -16.665 1.00 0.00 C ATOM 13 O ILE A 782 17.886 -19.005 -17.371 1.00 0.00 O ATOM 14 CB ILE A 782 19.949 -16.421 -16.851 1.00 0.00 C ATOM 15 CG1 ILE A 782 20.226 -16.771 -18.317 1.00 0.00 C ATOM 16 CG2 ILE A 782 21.210 -15.921 -16.166 1.00 0.00 C ATOM 17 CD1 ILE A 782 20.726 -15.604 -19.141 1.00 0.00 C ATOM 0 H ILE A 782 20.786 -18.874 -17.057 1.00 0.00 H new ATOM 0 HA ILE A 782 19.294 -17.382 -15.044 1.00 0.00 H new ATOM 0 HB ILE A 782 19.206 -15.624 -16.830 1.00 0.00 H new ATOM 0 HG12 ILE A 782 20.963 -17.573 -18.356 1.00 0.00 H new ATOM 0 HG13 ILE A 782 19.311 -17.156 -18.768 1.00 0.00 H new ATOM 0 HG21 ILE A 782 21.599 -15.057 -16.705 1.00 0.00 H new ATOM 0 HG22 ILE A 782 20.978 -15.634 -15.140 1.00 0.00 H new ATOM 0 HG23 ILE A 782 21.959 -16.713 -16.161 1.00 0.00 H new ATOM 0 HD11 ILE A 782 20.899 -15.930 -20.166 1.00 0.00 H new ATOM 0 HD12 ILE A 782 19.981 -14.808 -19.134 1.00 0.00 H new ATOM 0 HD13 ILE A 782 21.658 -15.232 -18.716 1.00 0.00 H new ATOM 29 N ASP A 783 17.024 -17.176 -16.354 1.00 0.00 N ATOM 30 CA ASP A 783 15.642 -17.396 -16.794 1.00 0.00 C ATOM 31 C ASP A 783 15.086 -18.712 -16.253 1.00 0.00 C ATOM 32 O ASP A 783 15.288 -19.778 -16.838 1.00 0.00 O ATOM 33 CB ASP A 783 15.532 -17.361 -18.325 1.00 0.00 C ATOM 34 CG ASP A 783 14.144 -17.728 -18.819 1.00 0.00 C ATOM 35 OD1 ASP A 783 13.168 -17.049 -18.432 1.00 0.00 O ATOM 36 OD2 ASP A 783 14.022 -18.697 -19.596 1.00 0.00 O ATOM 0 H ASP A 783 17.148 -16.335 -15.790 1.00 0.00 H new ATOM 0 HA ASP A 783 15.043 -16.581 -16.388 1.00 0.00 H new ATOM 0 HB2 ASP A 783 15.788 -16.363 -18.681 1.00 0.00 H new ATOM 0 HB3 ASP A 783 16.260 -18.050 -18.754 1.00 0.00 H new ATOM 41 N PRO A 784 14.408 -18.659 -15.100 1.00 0.00 N ATOM 42 CA PRO A 784 13.740 -19.818 -14.523 1.00 0.00 C ATOM 43 C PRO A 784 12.420 -20.106 -15.232 1.00 0.00 C ATOM 44 O PRO A 784 11.417 -19.430 -15.001 1.00 0.00 O ATOM 45 CB PRO A 784 13.491 -19.417 -13.059 1.00 0.00 C ATOM 46 CG PRO A 784 14.141 -18.079 -12.882 1.00 0.00 C ATOM 47 CD PRO A 784 14.249 -17.477 -14.253 1.00 0.00 C ATOM 0 HA PRO A 784 14.335 -20.726 -14.618 1.00 0.00 H new ATOM 0 HB2 PRO A 784 12.424 -19.364 -12.845 1.00 0.00 H new ATOM 0 HB3 PRO A 784 13.917 -20.151 -12.375 1.00 0.00 H new ATOM 0 HG2 PRO A 784 13.549 -17.443 -12.224 1.00 0.00 H new ATOM 0 HG3 PRO A 784 15.125 -18.182 -12.424 1.00 0.00 H new ATOM 0 HD2 PRO A 784 13.360 -16.904 -14.517 1.00 0.00 H new ATOM 0 HD3 PRO A 784 15.100 -16.801 -14.334 1.00 0.00 H new ATOM 55 N PHE A 785 12.440 -21.080 -16.127 1.00 0.00 N ATOM 56 CA PHE A 785 11.250 -21.467 -16.867 1.00 0.00 C ATOM 57 C PHE A 785 10.473 -22.524 -16.096 1.00 0.00 C ATOM 58 O PHE A 785 10.891 -23.683 -16.024 1.00 0.00 O ATOM 59 CB PHE A 785 11.637 -21.988 -18.256 1.00 0.00 C ATOM 60 CG PHE A 785 10.469 -22.419 -19.098 1.00 0.00 C ATOM 61 CD1 PHE A 785 9.572 -21.483 -19.590 1.00 0.00 C ATOM 62 CD2 PHE A 785 10.263 -23.758 -19.390 1.00 0.00 C ATOM 63 CE1 PHE A 785 8.493 -21.875 -20.357 1.00 0.00 C ATOM 64 CE2 PHE A 785 9.185 -24.155 -20.157 1.00 0.00 C ATOM 65 CZ PHE A 785 8.318 -23.215 -20.667 1.00 0.00 C ATOM 0 H PHE A 785 13.273 -21.620 -16.360 1.00 0.00 H new ATOM 0 HA PHE A 785 10.612 -20.592 -16.992 1.00 0.00 H new ATOM 0 HB2 PHE A 785 12.184 -21.208 -18.785 1.00 0.00 H new ATOM 0 HB3 PHE A 785 12.318 -22.831 -18.139 1.00 0.00 H new ATOM 0 HD1 PHE A 785 9.719 -20.436 -19.371 1.00 0.00 H new ATOM 0 HD2 PHE A 785 10.953 -24.499 -19.014 1.00 0.00 H new ATOM 0 HE1 PHE A 785 7.787 -21.140 -20.715 1.00 0.00 H new ATOM 0 HE2 PHE A 785 9.022 -25.204 -20.357 1.00 0.00 H new ATOM 0 HZ PHE A 785 7.504 -23.521 -21.307 1.00 0.00 H new ATOM 75 N THR A 786 9.358 -22.104 -15.510 1.00 0.00 N ATOM 76 CA THR A 786 8.498 -22.981 -14.725 1.00 0.00 C ATOM 77 C THR A 786 9.239 -23.514 -13.499 1.00 0.00 C ATOM 78 O THR A 786 9.847 -24.586 -13.537 1.00 0.00 O ATOM 79 CB THR A 786 7.963 -24.152 -15.572 1.00 0.00 C ATOM 80 OG1 THR A 786 7.387 -23.649 -16.789 1.00 0.00 O ATOM 81 CG2 THR A 786 6.916 -24.948 -14.807 1.00 0.00 C ATOM 0 H THR A 786 9.024 -21.142 -15.566 1.00 0.00 H new ATOM 0 HA THR A 786 7.647 -22.388 -14.390 1.00 0.00 H new ATOM 0 HB THR A 786 8.798 -24.813 -15.804 1.00 0.00 H new ATOM 0 HG1 THR A 786 7.050 -24.397 -17.325 1.00 0.00 H new ATOM 0 HG21 THR A 786 6.556 -25.768 -15.429 1.00 0.00 H new ATOM 0 HG22 THR A 786 7.359 -25.351 -13.896 1.00 0.00 H new ATOM 0 HG23 THR A 786 6.082 -24.296 -14.547 1.00 0.00 H new ATOM 89 N ALA A 787 9.208 -22.747 -12.422 1.00 0.00 N ATOM 90 CA ALA A 787 9.891 -23.131 -11.198 1.00 0.00 C ATOM 91 C ALA A 787 9.061 -22.767 -9.976 1.00 0.00 C ATOM 92 O ALA A 787 8.322 -21.783 -9.987 1.00 0.00 O ATOM 93 CB ALA A 787 11.258 -22.465 -11.132 1.00 0.00 C ATOM 0 H ALA A 787 8.717 -21.854 -12.370 1.00 0.00 H new ATOM 0 HA ALA A 787 10.026 -24.213 -11.203 1.00 0.00 H new ATOM 0 HB1 ALA A 787 11.762 -22.759 -10.211 1.00 0.00 H new ATOM 0 HB2 ALA A 787 11.856 -22.776 -11.988 1.00 0.00 H new ATOM 0 HB3 ALA A 787 11.136 -21.382 -11.149 1.00 0.00 H new ATOM 99 N HIS A 788 9.174 -23.574 -8.932 1.00 0.00 N ATOM 100 CA HIS A 788 8.474 -23.315 -7.684 1.00 0.00 C ATOM 101 C HIS A 788 9.388 -22.560 -6.727 1.00 0.00 C ATOM 102 O HIS A 788 10.566 -22.902 -6.599 1.00 0.00 O ATOM 103 CB HIS A 788 8.011 -24.632 -7.053 1.00 0.00 C ATOM 104 CG HIS A 788 7.266 -24.463 -5.763 1.00 0.00 C ATOM 105 ND1 HIS A 788 7.847 -24.652 -4.528 1.00 0.00 N ATOM 106 CD2 HIS A 788 5.978 -24.124 -5.519 1.00 0.00 C ATOM 107 CE1 HIS A 788 6.950 -24.437 -3.584 1.00 0.00 C ATOM 108 NE2 HIS A 788 5.812 -24.116 -4.159 1.00 0.00 N ATOM 0 H HIS A 788 9.747 -24.418 -8.925 1.00 0.00 H new ATOM 0 HA HIS A 788 7.595 -22.703 -7.889 1.00 0.00 H new ATOM 0 HB2 HIS A 788 7.373 -25.158 -7.763 1.00 0.00 H new ATOM 0 HB3 HIS A 788 8.881 -25.264 -6.878 1.00 0.00 H new ATOM 0 HD2 HIS A 788 5.223 -23.902 -6.258 1.00 0.00 H new ATOM 0 HE1 HIS A 788 7.122 -24.512 -2.520 1.00 0.00 H new ATOM 0 HE2 HIS A 788 4.944 -23.896 -3.671 1.00 0.00 H new ATOM 116 N ALA A 789 8.835 -21.540 -6.071 1.00 0.00 N ATOM 117 CA ALA A 789 9.588 -20.684 -5.155 1.00 0.00 C ATOM 118 C ALA A 789 10.736 -19.996 -5.885 1.00 0.00 C ATOM 119 O ALA A 789 11.856 -20.512 -5.943 1.00 0.00 O ATOM 120 CB ALA A 789 10.100 -21.471 -3.954 1.00 0.00 C ATOM 0 H ALA A 789 7.852 -21.284 -6.160 1.00 0.00 H new ATOM 0 HA ALA A 789 8.911 -19.917 -4.780 1.00 0.00 H new ATOM 0 HB1 ALA A 789 10.655 -20.806 -3.293 1.00 0.00 H new ATOM 0 HB2 ALA A 789 9.256 -21.899 -3.413 1.00 0.00 H new ATOM 0 HB3 ALA A 789 10.755 -22.272 -4.296 1.00 0.00 H new ATOM 126 N THR A 790 10.445 -18.843 -6.461 1.00 0.00 N ATOM 127 CA THR A 790 11.417 -18.133 -7.275 1.00 0.00 C ATOM 128 C THR A 790 11.466 -16.659 -6.892 1.00 0.00 C ATOM 129 O THR A 790 10.430 -16.031 -6.674 1.00 0.00 O ATOM 130 CB THR A 790 11.071 -18.259 -8.772 1.00 0.00 C ATOM 131 OG1 THR A 790 10.667 -19.604 -9.065 1.00 0.00 O ATOM 132 CG2 THR A 790 12.266 -17.893 -9.638 1.00 0.00 C ATOM 0 H THR A 790 9.541 -18.377 -6.380 1.00 0.00 H new ATOM 0 HA THR A 790 12.393 -18.583 -7.094 1.00 0.00 H new ATOM 0 HB THR A 790 10.255 -17.571 -8.993 1.00 0.00 H new ATOM 0 HG1 THR A 790 10.296 -19.644 -9.971 1.00 0.00 H new ATOM 0 HG21 THR A 790 11.996 -17.990 -10.690 1.00 0.00 H new ATOM 0 HG22 THR A 790 12.563 -16.864 -9.433 1.00 0.00 H new ATOM 0 HG23 THR A 790 13.097 -18.562 -9.413 1.00 0.00 H new ATOM 140 N GLY A 791 12.671 -16.114 -6.806 1.00 0.00 N ATOM 141 CA GLY A 791 12.827 -14.709 -6.493 1.00 0.00 C ATOM 142 C GLY A 791 13.516 -13.961 -7.612 1.00 0.00 C ATOM 143 O GLY A 791 14.443 -13.186 -7.375 1.00 0.00 O ATOM 0 H GLY A 791 13.545 -16.621 -6.948 1.00 0.00 H new ATOM 0 HA2 GLY A 791 11.848 -14.266 -6.308 1.00 0.00 H new ATOM 0 HA3 GLY A 791 13.404 -14.602 -5.574 1.00 0.00 H new ATOM 147 N ALA A 792 13.060 -14.189 -8.836 1.00 0.00 N ATOM 148 CA ALA A 792 13.675 -13.576 -10.005 1.00 0.00 C ATOM 149 C ALA A 792 13.061 -12.211 -10.291 1.00 0.00 C ATOM 150 O ALA A 792 12.340 -12.023 -11.274 1.00 0.00 O ATOM 151 CB ALA A 792 13.554 -14.489 -11.216 1.00 0.00 C ATOM 0 H ALA A 792 12.266 -14.794 -9.045 1.00 0.00 H new ATOM 0 HA ALA A 792 14.734 -13.429 -9.793 1.00 0.00 H new ATOM 0 HB1 ALA A 792 14.020 -14.013 -12.079 1.00 0.00 H new ATOM 0 HB2 ALA A 792 14.054 -15.435 -11.010 1.00 0.00 H new ATOM 0 HB3 ALA A 792 12.501 -14.674 -11.428 1.00 0.00 H new ATOM 157 N GLY A 793 13.339 -11.265 -9.408 1.00 0.00 N ATOM 158 CA GLY A 793 12.826 -9.925 -9.563 1.00 0.00 C ATOM 159 C GLY A 793 13.673 -8.908 -8.828 1.00 0.00 C ATOM 160 O GLY A 793 14.065 -9.147 -7.683 1.00 0.00 O ATOM 0 H GLY A 793 13.917 -11.406 -8.579 1.00 0.00 H new ATOM 0 HA2 GLY A 793 12.790 -9.670 -10.622 1.00 0.00 H new ATOM 0 HA3 GLY A 793 11.803 -9.883 -9.190 1.00 0.00 H new ATOM 164 N PRO A 794 13.986 -7.773 -9.469 1.00 0.00 N ATOM 165 CA PRO A 794 14.784 -6.708 -8.853 1.00 0.00 C ATOM 166 C PRO A 794 14.073 -6.084 -7.659 1.00 0.00 C ATOM 167 O PRO A 794 12.879 -5.779 -7.724 1.00 0.00 O ATOM 168 CB PRO A 794 14.953 -5.680 -9.977 1.00 0.00 C ATOM 169 CG PRO A 794 13.845 -5.962 -10.932 1.00 0.00 C ATOM 170 CD PRO A 794 13.594 -7.439 -10.849 1.00 0.00 C ATOM 0 HA PRO A 794 15.732 -7.081 -8.464 1.00 0.00 H new ATOM 0 HB2 PRO A 794 14.892 -4.662 -9.592 1.00 0.00 H new ATOM 0 HB3 PRO A 794 15.925 -5.781 -10.460 1.00 0.00 H new ATOM 0 HG2 PRO A 794 12.950 -5.399 -10.669 1.00 0.00 H new ATOM 0 HG3 PRO A 794 14.119 -5.669 -11.945 1.00 0.00 H new ATOM 0 HD2 PRO A 794 12.548 -7.681 -11.040 1.00 0.00 H new ATOM 0 HD3 PRO A 794 14.187 -7.989 -11.580 1.00 0.00 H new ATOM 178 N ALA A 795 14.802 -5.901 -6.572 1.00 0.00 N ATOM 179 CA ALA A 795 14.228 -5.353 -5.357 1.00 0.00 C ATOM 180 C ALA A 795 14.961 -4.091 -4.925 1.00 0.00 C ATOM 181 O ALA A 795 16.191 -4.028 -4.966 1.00 0.00 O ATOM 182 CB ALA A 795 14.257 -6.393 -4.247 1.00 0.00 C ATOM 0 H ALA A 795 15.795 -6.125 -6.507 1.00 0.00 H new ATOM 0 HA ALA A 795 13.191 -5.085 -5.561 1.00 0.00 H new ATOM 0 HB1 ALA A 795 13.824 -5.970 -3.341 1.00 0.00 H new ATOM 0 HB2 ALA A 795 13.680 -7.266 -4.552 1.00 0.00 H new ATOM 0 HB3 ALA A 795 15.288 -6.689 -4.052 1.00 0.00 H new ATOM 188 N GLY A 796 14.196 -3.091 -4.521 1.00 0.00 N ATOM 189 CA GLY A 796 14.767 -1.863 -4.022 1.00 0.00 C ATOM 190 C GLY A 796 14.861 -1.880 -2.516 1.00 0.00 C ATOM 191 O GLY A 796 15.875 -2.300 -1.962 1.00 0.00 O ATOM 0 H GLY A 796 13.176 -3.111 -4.531 1.00 0.00 H new ATOM 0 HA2 GLY A 796 15.759 -1.720 -4.450 1.00 0.00 H new ATOM 0 HA3 GLY A 796 14.157 -1.018 -4.342 1.00 0.00 H new ATOM 195 N ARG A 797 13.796 -1.447 -1.842 1.00 0.00 N ATOM 196 CA ARG A 797 13.771 -1.476 -0.381 1.00 0.00 C ATOM 197 C ARG A 797 12.358 -1.324 0.194 1.00 0.00 C ATOM 198 O ARG A 797 12.198 -1.160 1.401 1.00 0.00 O ATOM 199 CB ARG A 797 14.699 -0.398 0.191 1.00 0.00 C ATOM 200 CG ARG A 797 14.291 1.030 -0.129 1.00 0.00 C ATOM 201 CD ARG A 797 15.455 1.974 0.103 1.00 0.00 C ATOM 202 NE ARG A 797 15.065 3.381 0.115 1.00 0.00 N ATOM 203 CZ ARG A 797 15.524 4.284 -0.751 1.00 0.00 C ATOM 204 NH1 ARG A 797 16.195 3.897 -1.831 1.00 0.00 N ATOM 205 NH2 ARG A 797 15.281 5.571 -0.546 1.00 0.00 N ATOM 0 H ARG A 797 12.951 -1.077 -2.277 1.00 0.00 H new ATOM 0 HA ARG A 797 14.129 -2.460 -0.080 1.00 0.00 H new ATOM 0 HB2 ARG A 797 14.743 -0.514 1.274 1.00 0.00 H new ATOM 0 HB3 ARG A 797 15.706 -0.567 -0.189 1.00 0.00 H new ATOM 0 HG2 ARG A 797 13.960 1.097 -1.165 1.00 0.00 H new ATOM 0 HG3 ARG A 797 13.446 1.323 0.495 1.00 0.00 H new ATOM 0 HD2 ARG A 797 15.930 1.728 1.053 1.00 0.00 H new ATOM 0 HD3 ARG A 797 16.201 1.818 -0.676 1.00 0.00 H new ATOM 0 HE ARG A 797 14.403 3.690 0.827 1.00 0.00 H new ATOM 0 HH11 ARG A 797 16.361 2.905 -2.000 1.00 0.00 H new ATOM 0 HH12 ARG A 797 16.544 4.592 -2.491 1.00 0.00 H new ATOM 0 HH21 ARG A 797 14.746 5.865 0.271 1.00 0.00 H new ATOM 0 HH22 ARG A 797 15.630 6.267 -1.205 1.00 0.00 H new ATOM 219 N TYR A 798 11.336 -1.401 -0.656 1.00 0.00 N ATOM 220 CA TYR A 798 9.946 -1.333 -0.191 1.00 0.00 C ATOM 221 C TYR A 798 9.143 -2.437 -0.860 1.00 0.00 C ATOM 222 O TYR A 798 7.928 -2.546 -0.688 1.00 0.00 O ATOM 223 CB TYR A 798 9.306 0.024 -0.525 1.00 0.00 C ATOM 224 CG TYR A 798 10.099 1.229 -0.066 1.00 0.00 C ATOM 225 CD1 TYR A 798 10.411 1.398 1.274 1.00 0.00 C ATOM 226 CD2 TYR A 798 10.536 2.191 -0.969 1.00 0.00 C ATOM 227 CE1 TYR A 798 11.130 2.493 1.707 1.00 0.00 C ATOM 228 CE2 TYR A 798 11.257 3.290 -0.542 1.00 0.00 C ATOM 229 CZ TYR A 798 11.561 3.445 0.752 1.00 0.00 C ATOM 230 OH TYR A 798 12.260 4.527 1.226 1.00 0.00 O ATOM 0 H TYR A 798 11.440 -1.510 -1.665 1.00 0.00 H new ATOM 0 HA TYR A 798 9.943 -1.456 0.892 1.00 0.00 H new ATOM 0 HB2 TYR A 798 9.166 0.088 -1.604 1.00 0.00 H new ATOM 0 HB3 TYR A 798 8.315 0.064 -0.072 1.00 0.00 H new ATOM 0 HD1 TYR A 798 10.086 0.660 1.992 1.00 0.00 H new ATOM 0 HD2 TYR A 798 10.309 2.078 -2.019 1.00 0.00 H new ATOM 0 HE1 TYR A 798 11.360 2.621 2.754 1.00 0.00 H new ATOM 0 HE2 TYR A 798 11.578 4.031 -1.259 1.00 0.00 H new ATOM 0 HH TYR A 798 12.504 5.112 0.478 1.00 0.00 H new ATOM 240 N ASP A 799 9.865 -3.283 -1.576 1.00 0.00 N ATOM 241 CA ASP A 799 9.282 -4.223 -2.524 1.00 0.00 C ATOM 242 C ASP A 799 8.471 -5.308 -1.841 1.00 0.00 C ATOM 243 O ASP A 799 7.463 -5.755 -2.379 1.00 0.00 O ATOM 244 CB ASP A 799 10.386 -4.867 -3.363 1.00 0.00 C ATOM 245 CG ASP A 799 11.180 -3.849 -4.155 1.00 0.00 C ATOM 246 OD1 ASP A 799 11.717 -2.897 -3.545 1.00 0.00 O ATOM 247 OD2 ASP A 799 11.295 -4.008 -5.387 1.00 0.00 O ATOM 0 H ASP A 799 10.882 -3.339 -1.516 1.00 0.00 H new ATOM 0 HA ASP A 799 8.604 -3.656 -3.161 1.00 0.00 H new ATOM 0 HB2 ASP A 799 11.060 -5.420 -2.708 1.00 0.00 H new ATOM 0 HB3 ASP A 799 9.943 -5.590 -4.048 1.00 0.00 H new ATOM 252 N GLN A 800 8.908 -5.740 -0.667 1.00 0.00 N ATOM 253 CA GLN A 800 8.185 -6.777 0.054 1.00 0.00 C ATOM 254 C GLN A 800 6.851 -6.242 0.550 1.00 0.00 C ATOM 255 O GLN A 800 5.823 -6.907 0.436 1.00 0.00 O ATOM 256 CB GLN A 800 9.011 -7.310 1.229 1.00 0.00 C ATOM 257 CG GLN A 800 8.281 -8.348 2.079 1.00 0.00 C ATOM 258 CD GLN A 800 8.128 -9.710 1.409 1.00 0.00 C ATOM 259 OE1 GLN A 800 8.065 -10.736 2.088 1.00 0.00 O ATOM 260 NE2 GLN A 800 8.067 -9.742 0.084 1.00 0.00 N ATOM 0 H GLN A 800 9.746 -5.395 -0.199 1.00 0.00 H new ATOM 0 HA GLN A 800 8.002 -7.602 -0.634 1.00 0.00 H new ATOM 0 HB2 GLN A 800 9.930 -7.752 0.843 1.00 0.00 H new ATOM 0 HB3 GLN A 800 9.302 -6.474 1.865 1.00 0.00 H new ATOM 0 HG2 GLN A 800 8.820 -8.476 3.018 1.00 0.00 H new ATOM 0 HG3 GLN A 800 7.291 -7.965 2.329 1.00 0.00 H new ATOM 0 HE21 GLN A 800 8.122 -8.875 -0.450 1.00 0.00 H new ATOM 0 HE22 GLN A 800 7.965 -10.634 -0.400 1.00 0.00 H new ATOM 269 N ALA A 801 6.873 -5.028 1.082 1.00 0.00 N ATOM 270 CA ALA A 801 5.674 -4.413 1.625 1.00 0.00 C ATOM 271 C ALA A 801 4.682 -4.085 0.516 1.00 0.00 C ATOM 272 O ALA A 801 3.486 -4.356 0.645 1.00 0.00 O ATOM 273 CB ALA A 801 6.032 -3.166 2.415 1.00 0.00 C ATOM 0 H ALA A 801 7.711 -4.450 1.148 1.00 0.00 H new ATOM 0 HA ALA A 801 5.198 -5.124 2.300 1.00 0.00 H new ATOM 0 HB1 ALA A 801 5.124 -2.716 2.816 1.00 0.00 H new ATOM 0 HB2 ALA A 801 6.697 -3.434 3.236 1.00 0.00 H new ATOM 0 HB3 ALA A 801 6.533 -2.452 1.761 1.00 0.00 H new ATOM 279 N THR A 802 5.178 -3.520 -0.580 1.00 0.00 N ATOM 280 CA THR A 802 4.323 -3.189 -1.707 1.00 0.00 C ATOM 281 C THR A 802 3.764 -4.450 -2.348 1.00 0.00 C ATOM 282 O THR A 802 2.603 -4.486 -2.740 1.00 0.00 O ATOM 283 CB THR A 802 5.068 -2.360 -2.770 1.00 0.00 C ATOM 284 OG1 THR A 802 6.297 -3.000 -3.125 1.00 0.00 O ATOM 285 CG2 THR A 802 5.345 -0.955 -2.262 1.00 0.00 C ATOM 0 H THR A 802 6.162 -3.284 -0.709 1.00 0.00 H new ATOM 0 HA THR A 802 3.503 -2.586 -1.316 1.00 0.00 H new ATOM 0 HB THR A 802 4.433 -2.291 -3.653 1.00 0.00 H new ATOM 0 HG1 THR A 802 6.974 -2.808 -2.443 1.00 0.00 H new ATOM 0 HG21 THR A 802 5.872 -0.388 -3.029 1.00 0.00 H new ATOM 0 HG22 THR A 802 4.402 -0.460 -2.028 1.00 0.00 H new ATOM 0 HG23 THR A 802 5.960 -1.008 -1.363 1.00 0.00 H new ATOM 293 N ASP A 803 4.594 -5.487 -2.433 1.00 0.00 N ATOM 294 CA ASP A 803 4.167 -6.779 -2.966 1.00 0.00 C ATOM 295 C ASP A 803 2.977 -7.311 -2.183 1.00 0.00 C ATOM 296 O ASP A 803 1.986 -7.760 -2.764 1.00 0.00 O ATOM 297 CB ASP A 803 5.313 -7.790 -2.914 1.00 0.00 C ATOM 298 CG ASP A 803 4.905 -9.169 -3.392 1.00 0.00 C ATOM 299 OD1 ASP A 803 4.871 -9.391 -4.620 1.00 0.00 O ATOM 300 OD2 ASP A 803 4.586 -10.029 -2.542 1.00 0.00 O ATOM 0 H ASP A 803 5.570 -5.457 -2.138 1.00 0.00 H new ATOM 0 HA ASP A 803 3.872 -6.635 -4.005 1.00 0.00 H new ATOM 0 HB2 ASP A 803 6.138 -7.428 -3.527 1.00 0.00 H new ATOM 0 HB3 ASP A 803 5.683 -7.860 -1.891 1.00 0.00 H new ATOM 305 N THR A 804 3.075 -7.242 -0.862 1.00 0.00 N ATOM 306 CA THR A 804 1.992 -7.662 0.007 1.00 0.00 C ATOM 307 C THR A 804 0.733 -6.837 -0.263 1.00 0.00 C ATOM 308 O THR A 804 -0.314 -7.388 -0.589 1.00 0.00 O ATOM 309 CB THR A 804 2.391 -7.538 1.490 1.00 0.00 C ATOM 310 OG1 THR A 804 3.625 -8.235 1.718 1.00 0.00 O ATOM 311 CG2 THR A 804 1.310 -8.105 2.400 1.00 0.00 C ATOM 0 H THR A 804 3.899 -6.897 -0.370 1.00 0.00 H new ATOM 0 HA THR A 804 1.782 -8.710 -0.208 1.00 0.00 H new ATOM 0 HB THR A 804 2.514 -6.480 1.722 1.00 0.00 H new ATOM 0 HG1 THR A 804 4.365 -7.728 1.323 1.00 0.00 H new ATOM 0 HG21 THR A 804 1.620 -8.003 3.440 1.00 0.00 H new ATOM 0 HG22 THR A 804 0.380 -7.559 2.244 1.00 0.00 H new ATOM 0 HG23 THR A 804 1.156 -9.159 2.169 1.00 0.00 H new ATOM 319 N ILE A 805 0.854 -5.514 -0.160 1.00 0.00 N ATOM 320 CA ILE A 805 -0.285 -4.621 -0.369 1.00 0.00 C ATOM 321 C ILE A 805 -0.897 -4.820 -1.758 1.00 0.00 C ATOM 322 O ILE A 805 -2.108 -4.995 -1.887 1.00 0.00 O ATOM 323 CB ILE A 805 0.116 -3.138 -0.198 1.00 0.00 C ATOM 324 CG1 ILE A 805 0.590 -2.864 1.234 1.00 0.00 C ATOM 325 CG2 ILE A 805 -1.050 -2.226 -0.557 1.00 0.00 C ATOM 326 CD1 ILE A 805 1.091 -1.452 1.450 1.00 0.00 C ATOM 0 H ILE A 805 1.727 -5.038 0.066 1.00 0.00 H new ATOM 0 HA ILE A 805 -1.026 -4.875 0.389 1.00 0.00 H new ATOM 0 HB ILE A 805 0.943 -2.928 -0.877 1.00 0.00 H new ATOM 0 HG12 ILE A 805 -0.232 -3.057 1.923 1.00 0.00 H new ATOM 0 HG13 ILE A 805 1.387 -3.565 1.484 1.00 0.00 H new ATOM 0 HG21 ILE A 805 -0.750 -1.186 -0.431 1.00 0.00 H new ATOM 0 HG22 ILE A 805 -1.340 -2.397 -1.594 1.00 0.00 H new ATOM 0 HG23 ILE A 805 -1.895 -2.442 0.096 1.00 0.00 H new ATOM 0 HD11 ILE A 805 1.409 -1.333 2.486 1.00 0.00 H new ATOM 0 HD12 ILE A 805 1.935 -1.260 0.787 1.00 0.00 H new ATOM 0 HD13 ILE A 805 0.291 -0.745 1.233 1.00 0.00 H new ATOM 338 N LEU A 806 -0.049 -4.816 -2.783 1.00 0.00 N ATOM 339 CA LEU A 806 -0.491 -4.988 -4.169 1.00 0.00 C ATOM 340 C LEU A 806 -1.295 -6.278 -4.335 1.00 0.00 C ATOM 341 O LEU A 806 -2.331 -6.292 -4.999 1.00 0.00 O ATOM 342 CB LEU A 806 0.717 -5.003 -5.113 1.00 0.00 C ATOM 343 CG LEU A 806 1.038 -3.671 -5.805 1.00 0.00 C ATOM 344 CD1 LEU A 806 1.006 -2.512 -4.826 1.00 0.00 C ATOM 345 CD2 LEU A 806 2.400 -3.743 -6.472 1.00 0.00 C ATOM 0 H LEU A 806 0.959 -4.694 -2.680 1.00 0.00 H new ATOM 0 HA LEU A 806 -1.136 -4.146 -4.423 1.00 0.00 H new ATOM 0 HB2 LEU A 806 1.594 -5.317 -4.547 1.00 0.00 H new ATOM 0 HB3 LEU A 806 0.546 -5.758 -5.880 1.00 0.00 H new ATOM 0 HG LEU A 806 0.271 -3.497 -6.560 1.00 0.00 H new ATOM 0 HD11 LEU A 806 1.238 -1.586 -5.351 1.00 0.00 H new ATOM 0 HD12 LEU A 806 0.013 -2.438 -4.382 1.00 0.00 H new ATOM 0 HD13 LEU A 806 1.744 -2.678 -4.041 1.00 0.00 H new ATOM 0 HD21 LEU A 806 2.617 -2.793 -6.960 1.00 0.00 H new ATOM 0 HD22 LEU A 806 3.163 -3.948 -5.721 1.00 0.00 H new ATOM 0 HD23 LEU A 806 2.399 -4.540 -7.215 1.00 0.00 H new ATOM 357 N THR A 807 -0.817 -7.353 -3.717 1.00 0.00 N ATOM 358 CA THR A 807 -1.470 -8.652 -3.822 1.00 0.00 C ATOM 359 C THR A 807 -2.747 -8.710 -2.980 1.00 0.00 C ATOM 360 O THR A 807 -3.756 -9.264 -3.407 1.00 0.00 O ATOM 361 CB THR A 807 -0.515 -9.783 -3.392 1.00 0.00 C ATOM 362 OG1 THR A 807 0.710 -9.687 -4.134 1.00 0.00 O ATOM 363 CG2 THR A 807 -1.143 -11.150 -3.627 1.00 0.00 C ATOM 0 H THR A 807 0.022 -7.350 -3.137 1.00 0.00 H new ATOM 0 HA THR A 807 -1.741 -8.791 -4.869 1.00 0.00 H new ATOM 0 HB THR A 807 -0.315 -9.674 -2.326 1.00 0.00 H new ATOM 0 HG1 THR A 807 1.350 -9.135 -3.638 1.00 0.00 H new ATOM 0 HG21 THR A 807 -0.447 -11.929 -3.315 1.00 0.00 H new ATOM 0 HG22 THR A 807 -2.063 -11.232 -3.048 1.00 0.00 H new ATOM 0 HG23 THR A 807 -1.369 -11.269 -4.687 1.00 0.00 H new ATOM 371 N VAL A 808 -2.710 -8.126 -1.789 1.00 0.00 N ATOM 372 CA VAL A 808 -3.875 -8.130 -0.912 1.00 0.00 C ATOM 373 C VAL A 808 -4.997 -7.275 -1.496 1.00 0.00 C ATOM 374 O VAL A 808 -6.166 -7.639 -1.412 1.00 0.00 O ATOM 375 CB VAL A 808 -3.522 -7.640 0.512 1.00 0.00 C ATOM 376 CG1 VAL A 808 -4.770 -7.522 1.377 1.00 0.00 C ATOM 377 CG2 VAL A 808 -2.522 -8.579 1.164 1.00 0.00 C ATOM 0 H VAL A 808 -1.893 -7.647 -1.410 1.00 0.00 H new ATOM 0 HA VAL A 808 -4.218 -9.162 -0.838 1.00 0.00 H new ATOM 0 HB VAL A 808 -3.073 -6.651 0.424 1.00 0.00 H new ATOM 0 HG11 VAL A 808 -4.491 -7.176 2.372 1.00 0.00 H new ATOM 0 HG12 VAL A 808 -5.460 -6.810 0.925 1.00 0.00 H new ATOM 0 HG13 VAL A 808 -5.253 -8.496 1.454 1.00 0.00 H new ATOM 0 HG21 VAL A 808 -2.285 -8.219 2.165 1.00 0.00 H new ATOM 0 HG22 VAL A 808 -2.951 -9.579 1.230 1.00 0.00 H new ATOM 0 HG23 VAL A 808 -1.612 -8.614 0.566 1.00 0.00 H new ATOM 387 N THR A 809 -4.630 -6.157 -2.114 1.00 0.00 N ATOM 388 CA THR A 809 -5.602 -5.231 -2.689 1.00 0.00 C ATOM 389 C THR A 809 -6.574 -5.930 -3.641 1.00 0.00 C ATOM 390 O THR A 809 -7.793 -5.817 -3.496 1.00 0.00 O ATOM 391 CB THR A 809 -4.902 -4.097 -3.453 1.00 0.00 C ATOM 392 OG1 THR A 809 -4.092 -3.328 -2.560 1.00 0.00 O ATOM 393 CG2 THR A 809 -5.924 -3.202 -4.134 1.00 0.00 C ATOM 0 H THR A 809 -3.659 -5.868 -2.230 1.00 0.00 H new ATOM 0 HA THR A 809 -6.164 -4.823 -1.849 1.00 0.00 H new ATOM 0 HB THR A 809 -4.264 -4.538 -4.218 1.00 0.00 H new ATOM 0 HG1 THR A 809 -3.324 -3.864 -2.271 1.00 0.00 H new ATOM 0 HG21 THR A 809 -5.409 -2.405 -4.670 1.00 0.00 H new ATOM 0 HG22 THR A 809 -6.512 -3.791 -4.837 1.00 0.00 H new ATOM 0 HG23 THR A 809 -6.584 -2.767 -3.384 1.00 0.00 H new ATOM 401 N GLU A 810 -6.031 -6.656 -4.612 1.00 0.00 N ATOM 402 CA GLU A 810 -6.852 -7.335 -5.606 1.00 0.00 C ATOM 403 C GLU A 810 -7.754 -8.379 -4.954 1.00 0.00 C ATOM 404 O GLU A 810 -8.811 -8.722 -5.490 1.00 0.00 O ATOM 405 CB GLU A 810 -5.977 -7.971 -6.690 1.00 0.00 C ATOM 406 CG GLU A 810 -4.837 -8.818 -6.150 1.00 0.00 C ATOM 407 CD GLU A 810 -3.978 -9.408 -7.247 1.00 0.00 C ATOM 408 OE1 GLU A 810 -3.380 -8.633 -8.025 1.00 0.00 O ATOM 409 OE2 GLU A 810 -3.903 -10.648 -7.350 1.00 0.00 O ATOM 0 H GLU A 810 -5.027 -6.789 -4.731 1.00 0.00 H new ATOM 0 HA GLU A 810 -7.492 -6.590 -6.079 1.00 0.00 H new ATOM 0 HB2 GLU A 810 -6.604 -8.591 -7.330 1.00 0.00 H new ATOM 0 HB3 GLU A 810 -5.563 -7.181 -7.317 1.00 0.00 H new ATOM 0 HG2 GLU A 810 -4.215 -8.208 -5.495 1.00 0.00 H new ATOM 0 HG3 GLU A 810 -5.246 -9.624 -5.541 1.00 0.00 H new ATOM 416 N ASN A 811 -7.341 -8.870 -3.792 1.00 0.00 N ATOM 417 CA ASN A 811 -8.098 -9.892 -3.086 1.00 0.00 C ATOM 418 C ASN A 811 -9.433 -9.365 -2.577 1.00 0.00 C ATOM 419 O ASN A 811 -10.387 -10.127 -2.457 1.00 0.00 O ATOM 420 CB ASN A 811 -7.303 -10.482 -1.918 1.00 0.00 C ATOM 421 CG ASN A 811 -6.186 -11.396 -2.371 1.00 0.00 C ATOM 422 OD1 ASN A 811 -6.262 -12.010 -3.439 1.00 0.00 O ATOM 423 ND2 ASN A 811 -5.151 -11.517 -1.554 1.00 0.00 N ATOM 0 H ASN A 811 -6.486 -8.576 -3.320 1.00 0.00 H new ATOM 0 HA ASN A 811 -8.292 -10.681 -3.813 1.00 0.00 H new ATOM 0 HB2 ASN A 811 -6.884 -9.670 -1.323 1.00 0.00 H new ATOM 0 HB3 ASN A 811 -7.979 -11.037 -1.268 1.00 0.00 H new ATOM 0 HD21 ASN A 811 -4.378 -12.136 -1.799 1.00 0.00 H new ATOM 0 HD22 ASN A 811 -5.127 -10.992 -0.680 1.00 0.00 H new ATOM 430 N ILE A 812 -9.509 -8.067 -2.289 1.00 0.00 N ATOM 431 CA ILE A 812 -10.759 -7.472 -1.813 1.00 0.00 C ATOM 432 C ILE A 812 -11.879 -7.700 -2.828 1.00 0.00 C ATOM 433 O ILE A 812 -13.018 -7.979 -2.459 1.00 0.00 O ATOM 434 CB ILE A 812 -10.626 -5.951 -1.518 1.00 0.00 C ATOM 435 CG1 ILE A 812 -9.869 -5.705 -0.209 1.00 0.00 C ATOM 436 CG2 ILE A 812 -11.993 -5.284 -1.453 1.00 0.00 C ATOM 437 CD1 ILE A 812 -8.372 -5.859 -0.324 1.00 0.00 C ATOM 0 H ILE A 812 -8.731 -7.413 -2.375 1.00 0.00 H new ATOM 0 HA ILE A 812 -11.002 -7.969 -0.874 1.00 0.00 H new ATOM 0 HB ILE A 812 -10.059 -5.511 -2.338 1.00 0.00 H new ATOM 0 HG12 ILE A 812 -10.094 -4.699 0.144 1.00 0.00 H new ATOM 0 HG13 ILE A 812 -10.238 -6.398 0.547 1.00 0.00 H new ATOM 0 HG21 ILE A 812 -11.870 -4.221 -1.245 1.00 0.00 H new ATOM 0 HG22 ILE A 812 -12.505 -5.410 -2.407 1.00 0.00 H new ATOM 0 HG23 ILE A 812 -12.584 -5.742 -0.660 1.00 0.00 H new ATOM 0 HD11 ILE A 812 -7.911 -5.668 0.645 1.00 0.00 H new ATOM 0 HD12 ILE A 812 -8.134 -6.873 -0.646 1.00 0.00 H new ATOM 0 HD13 ILE A 812 -7.988 -5.147 -1.055 1.00 0.00 H new ATOM 449 N PHE A 813 -11.539 -7.611 -4.108 1.00 0.00 N ATOM 450 CA PHE A 813 -12.515 -7.804 -5.171 1.00 0.00 C ATOM 451 C PHE A 813 -12.898 -9.274 -5.299 1.00 0.00 C ATOM 452 O PHE A 813 -14.012 -9.601 -5.700 1.00 0.00 O ATOM 453 CB PHE A 813 -11.969 -7.277 -6.499 1.00 0.00 C ATOM 454 CG PHE A 813 -11.757 -5.790 -6.499 1.00 0.00 C ATOM 455 CD1 PHE A 813 -12.799 -4.932 -6.814 1.00 0.00 C ATOM 456 CD2 PHE A 813 -10.523 -5.250 -6.179 1.00 0.00 C ATOM 457 CE1 PHE A 813 -12.615 -3.564 -6.809 1.00 0.00 C ATOM 458 CE2 PHE A 813 -10.333 -3.883 -6.173 1.00 0.00 C ATOM 459 CZ PHE A 813 -11.381 -3.038 -6.488 1.00 0.00 C ATOM 0 H PHE A 813 -10.594 -7.406 -4.434 1.00 0.00 H new ATOM 0 HA PHE A 813 -13.412 -7.241 -4.914 1.00 0.00 H new ATOM 0 HB2 PHE A 813 -11.024 -7.773 -6.719 1.00 0.00 H new ATOM 0 HB3 PHE A 813 -12.661 -7.540 -7.299 1.00 0.00 H new ATOM 0 HD1 PHE A 813 -13.767 -5.339 -7.067 1.00 0.00 H new ATOM 0 HD2 PHE A 813 -9.701 -5.905 -5.932 1.00 0.00 H new ATOM 0 HE1 PHE A 813 -13.436 -2.907 -7.056 1.00 0.00 H new ATOM 0 HE2 PHE A 813 -9.366 -3.473 -5.922 1.00 0.00 H new ATOM 0 HZ PHE A 813 -11.234 -1.968 -6.483 1.00 0.00 H new ATOM 469 N SER A 814 -11.978 -10.158 -4.941 1.00 0.00 N ATOM 470 CA SER A 814 -12.239 -11.588 -4.985 1.00 0.00 C ATOM 471 C SER A 814 -13.074 -12.009 -3.773 1.00 0.00 C ATOM 472 O SER A 814 -13.952 -12.869 -3.871 1.00 0.00 O ATOM 473 CB SER A 814 -10.916 -12.353 -5.026 1.00 0.00 C ATOM 474 OG SER A 814 -10.080 -11.854 -6.060 1.00 0.00 O ATOM 0 H SER A 814 -11.044 -9.909 -4.617 1.00 0.00 H new ATOM 0 HA SER A 814 -12.805 -11.824 -5.886 1.00 0.00 H new ATOM 0 HB2 SER A 814 -10.408 -12.263 -4.066 1.00 0.00 H new ATOM 0 HB3 SER A 814 -11.108 -13.414 -5.187 1.00 0.00 H new ATOM 0 HG SER A 814 -9.238 -12.354 -6.070 1.00 0.00 H new ATOM 480 N SER A 815 -12.796 -11.383 -2.639 1.00 0.00 N ATOM 481 CA SER A 815 -13.533 -11.634 -1.411 1.00 0.00 C ATOM 482 C SER A 815 -14.832 -10.837 -1.376 1.00 0.00 C ATOM 483 O SER A 815 -15.622 -10.964 -0.437 1.00 0.00 O ATOM 484 CB SER A 815 -12.664 -11.274 -0.207 1.00 0.00 C ATOM 485 OG SER A 815 -11.482 -12.055 -0.190 1.00 0.00 O ATOM 0 H SER A 815 -12.055 -10.689 -2.545 1.00 0.00 H new ATOM 0 HA SER A 815 -13.787 -12.693 -1.373 1.00 0.00 H new ATOM 0 HB2 SER A 815 -12.406 -10.216 -0.242 1.00 0.00 H new ATOM 0 HB3 SER A 815 -13.225 -11.435 0.714 1.00 0.00 H new ATOM 0 HG SER A 815 -11.703 -12.977 0.058 1.00 0.00 H new ATOM 491 N MET A 816 -15.042 -10.013 -2.398 1.00 0.00 N ATOM 492 CA MET A 816 -16.242 -9.190 -2.491 1.00 0.00 C ATOM 493 C MET A 816 -17.486 -10.061 -2.432 1.00 0.00 C ATOM 494 O MET A 816 -17.759 -10.850 -3.339 1.00 0.00 O ATOM 495 CB MET A 816 -16.227 -8.358 -3.772 1.00 0.00 C ATOM 496 CG MET A 816 -17.436 -7.452 -3.929 1.00 0.00 C ATOM 497 SD MET A 816 -17.247 -6.289 -5.292 1.00 0.00 S ATOM 498 CE MET A 816 -15.846 -5.337 -4.711 1.00 0.00 C ATOM 0 H MET A 816 -14.393 -9.898 -3.176 1.00 0.00 H new ATOM 0 HA MET A 816 -16.258 -8.506 -1.642 1.00 0.00 H new ATOM 0 HB2 MET A 816 -15.323 -7.748 -3.788 1.00 0.00 H new ATOM 0 HB3 MET A 816 -16.174 -9.029 -4.629 1.00 0.00 H new ATOM 0 HG2 MET A 816 -18.325 -8.061 -4.095 1.00 0.00 H new ATOM 0 HG3 MET A 816 -17.596 -6.900 -3.003 1.00 0.00 H new ATOM 0 HE1 MET A 816 -16.017 -4.279 -4.911 1.00 0.00 H new ATOM 0 HE2 MET A 816 -15.723 -5.488 -3.639 1.00 0.00 H new ATOM 0 HE3 MET A 816 -14.944 -5.664 -5.229 1.00 0.00 H new ATOM 508 N GLY A 817 -18.220 -9.923 -1.346 1.00 0.00 N ATOM 509 CA GLY A 817 -19.367 -10.763 -1.108 1.00 0.00 C ATOM 510 C GLY A 817 -19.379 -11.271 0.312 1.00 0.00 C ATOM 511 O GLY A 817 -20.441 -11.496 0.891 1.00 0.00 O ATOM 0 H GLY A 817 -18.039 -9.235 -0.616 1.00 0.00 H new ATOM 0 HA2 GLY A 817 -20.280 -10.202 -1.305 1.00 0.00 H new ATOM 0 HA3 GLY A 817 -19.355 -11.606 -1.799 1.00 0.00 H new ATOM 515 N ASP A 818 -18.193 -11.449 0.877 1.00 0.00 N ATOM 516 CA ASP A 818 -18.070 -11.831 2.275 1.00 0.00 C ATOM 517 C ASP A 818 -17.556 -10.657 3.085 1.00 0.00 C ATOM 518 O ASP A 818 -16.431 -10.196 2.885 1.00 0.00 O ATOM 519 CB ASP A 818 -17.135 -13.027 2.449 1.00 0.00 C ATOM 520 CG ASP A 818 -17.130 -13.526 3.880 1.00 0.00 C ATOM 521 OD1 ASP A 818 -18.100 -14.210 4.272 1.00 0.00 O ATOM 522 OD2 ASP A 818 -16.166 -13.239 4.622 1.00 0.00 O ATOM 0 H ASP A 818 -17.304 -11.335 0.389 1.00 0.00 H new ATOM 0 HA ASP A 818 -19.058 -12.121 2.632 1.00 0.00 H new ATOM 0 HB2 ASP A 818 -17.445 -13.832 1.783 1.00 0.00 H new ATOM 0 HB3 ASP A 818 -16.123 -12.744 2.158 1.00 0.00 H new ATOM 527 N ALA A 819 -18.379 -10.186 4.006 1.00 0.00 N ATOM 528 CA ALA A 819 -18.084 -8.982 4.761 1.00 0.00 C ATOM 529 C ALA A 819 -16.847 -9.164 5.632 1.00 0.00 C ATOM 530 O ALA A 819 -15.921 -8.350 5.593 1.00 0.00 O ATOM 531 CB ALA A 819 -19.289 -8.599 5.601 1.00 0.00 C ATOM 0 H ALA A 819 -19.266 -10.626 4.250 1.00 0.00 H new ATOM 0 HA ALA A 819 -17.869 -8.175 4.060 1.00 0.00 H new ATOM 0 HB1 ALA A 819 -19.065 -7.695 6.167 1.00 0.00 H new ATOM 0 HB2 ALA A 819 -20.144 -8.417 4.949 1.00 0.00 H new ATOM 0 HB3 ALA A 819 -19.524 -9.410 6.290 1.00 0.00 H new ATOM 537 N GLY A 820 -16.846 -10.231 6.413 1.00 0.00 N ATOM 538 CA GLY A 820 -15.715 -10.547 7.267 1.00 0.00 C ATOM 539 C GLY A 820 -14.383 -10.543 6.534 1.00 0.00 C ATOM 540 O GLY A 820 -13.454 -9.846 6.941 1.00 0.00 O ATOM 0 H GLY A 820 -17.618 -10.894 6.473 1.00 0.00 H new ATOM 0 HA2 GLY A 820 -15.674 -9.826 8.084 1.00 0.00 H new ATOM 0 HA3 GLY A 820 -15.871 -11.528 7.715 1.00 0.00 H new ATOM 544 N GLU A 821 -14.287 -11.303 5.444 1.00 0.00 N ATOM 545 CA GLU A 821 -13.027 -11.427 4.721 1.00 0.00 C ATOM 546 C GLU A 821 -12.654 -10.125 4.009 1.00 0.00 C ATOM 547 O GLU A 821 -11.474 -9.780 3.929 1.00 0.00 O ATOM 548 CB GLU A 821 -13.073 -12.591 3.727 1.00 0.00 C ATOM 549 CG GLU A 821 -11.731 -12.862 3.063 1.00 0.00 C ATOM 550 CD GLU A 821 -11.714 -14.139 2.249 1.00 0.00 C ATOM 551 OE1 GLU A 821 -12.352 -14.175 1.179 1.00 0.00 O ATOM 552 OE2 GLU A 821 -11.092 -15.124 2.690 1.00 0.00 O ATOM 0 H GLU A 821 -15.060 -11.837 5.047 1.00 0.00 H new ATOM 0 HA GLU A 821 -12.252 -11.637 5.458 1.00 0.00 H new ATOM 0 HB2 GLU A 821 -13.403 -13.491 4.246 1.00 0.00 H new ATOM 0 HB3 GLU A 821 -13.815 -12.375 2.958 1.00 0.00 H new ATOM 0 HG2 GLU A 821 -11.478 -12.023 2.415 1.00 0.00 H new ATOM 0 HG3 GLU A 821 -10.958 -12.917 3.830 1.00 0.00 H new ATOM 559 N MET A 822 -13.648 -9.395 3.503 1.00 0.00 N ATOM 560 CA MET A 822 -13.388 -8.102 2.864 1.00 0.00 C ATOM 561 C MET A 822 -12.745 -7.136 3.852 1.00 0.00 C ATOM 562 O MET A 822 -11.763 -6.462 3.531 1.00 0.00 O ATOM 563 CB MET A 822 -14.671 -7.485 2.301 1.00 0.00 C ATOM 564 CG MET A 822 -15.160 -8.142 1.022 1.00 0.00 C ATOM 565 SD MET A 822 -16.660 -7.377 0.372 1.00 0.00 S ATOM 566 CE MET A 822 -16.093 -5.699 0.095 1.00 0.00 C ATOM 0 H MET A 822 -14.630 -9.671 3.522 1.00 0.00 H new ATOM 0 HA MET A 822 -12.702 -8.281 2.036 1.00 0.00 H new ATOM 0 HB2 MET A 822 -15.456 -7.551 3.055 1.00 0.00 H new ATOM 0 HB3 MET A 822 -14.500 -6.425 2.111 1.00 0.00 H new ATOM 0 HG2 MET A 822 -14.374 -8.089 0.268 1.00 0.00 H new ATOM 0 HG3 MET A 822 -15.349 -9.199 1.211 1.00 0.00 H new ATOM 0 HE1 MET A 822 -16.747 -5.209 -0.626 1.00 0.00 H new ATOM 0 HE2 MET A 822 -16.113 -5.148 1.035 1.00 0.00 H new ATOM 0 HE3 MET A 822 -15.074 -5.718 -0.293 1.00 0.00 H new ATOM 576 N VAL A 823 -13.296 -7.080 5.059 1.00 0.00 N ATOM 577 CA VAL A 823 -12.727 -6.251 6.113 1.00 0.00 C ATOM 578 C VAL A 823 -11.353 -6.782 6.508 1.00 0.00 C ATOM 579 O VAL A 823 -10.420 -6.013 6.731 1.00 0.00 O ATOM 580 CB VAL A 823 -13.644 -6.202 7.359 1.00 0.00 C ATOM 581 CG1 VAL A 823 -13.005 -5.389 8.476 1.00 0.00 C ATOM 582 CG2 VAL A 823 -15.005 -5.626 6.999 1.00 0.00 C ATOM 0 H VAL A 823 -14.132 -7.597 5.331 1.00 0.00 H new ATOM 0 HA VAL A 823 -12.633 -5.237 5.723 1.00 0.00 H new ATOM 0 HB VAL A 823 -13.780 -7.223 7.716 1.00 0.00 H new ATOM 0 HG11 VAL A 823 -13.670 -5.371 9.339 1.00 0.00 H new ATOM 0 HG12 VAL A 823 -12.055 -5.843 8.759 1.00 0.00 H new ATOM 0 HG13 VAL A 823 -12.831 -4.370 8.131 1.00 0.00 H new ATOM 0 HG21 VAL A 823 -15.636 -5.600 7.888 1.00 0.00 H new ATOM 0 HG22 VAL A 823 -14.881 -4.615 6.612 1.00 0.00 H new ATOM 0 HG23 VAL A 823 -15.475 -6.250 6.239 1.00 0.00 H new ATOM 592 N ARG A 824 -11.238 -8.104 6.570 1.00 0.00 N ATOM 593 CA ARG A 824 -9.980 -8.768 6.893 1.00 0.00 C ATOM 594 C ARG A 824 -8.859 -8.291 5.972 1.00 0.00 C ATOM 595 O ARG A 824 -7.790 -7.895 6.438 1.00 0.00 O ATOM 596 CB ARG A 824 -10.150 -10.282 6.770 1.00 0.00 C ATOM 597 CG ARG A 824 -8.906 -11.083 7.116 1.00 0.00 C ATOM 598 CD ARG A 824 -9.116 -12.564 6.845 1.00 0.00 C ATOM 599 NE ARG A 824 -10.284 -13.086 7.552 1.00 0.00 N ATOM 600 CZ ARG A 824 -11.030 -14.098 7.116 1.00 0.00 C ATOM 601 NH1 ARG A 824 -10.716 -14.723 5.988 1.00 0.00 N ATOM 602 NH2 ARG A 824 -12.087 -14.492 7.811 1.00 0.00 N ATOM 0 H ARG A 824 -12.013 -8.745 6.398 1.00 0.00 H new ATOM 0 HA ARG A 824 -9.709 -8.515 7.918 1.00 0.00 H new ATOM 0 HB2 ARG A 824 -10.964 -10.598 7.422 1.00 0.00 H new ATOM 0 HB3 ARG A 824 -10.449 -10.520 5.749 1.00 0.00 H new ATOM 0 HG2 ARG A 824 -8.061 -10.719 6.531 1.00 0.00 H new ATOM 0 HG3 ARG A 824 -8.654 -10.934 8.166 1.00 0.00 H new ATOM 0 HD2 ARG A 824 -9.239 -12.723 5.774 1.00 0.00 H new ATOM 0 HD3 ARG A 824 -8.229 -13.119 7.150 1.00 0.00 H new ATOM 0 HE ARG A 824 -10.544 -12.647 8.435 1.00 0.00 H new ATOM 0 HH11 ARG A 824 -9.900 -14.428 5.452 1.00 0.00 H new ATOM 0 HH12 ARG A 824 -11.291 -15.498 5.658 1.00 0.00 H new ATOM 0 HH21 ARG A 824 -12.330 -14.019 8.682 1.00 0.00 H new ATOM 0 HH22 ARG A 824 -12.658 -15.268 7.475 1.00 0.00 H new ATOM 616 N GLN A 825 -9.120 -8.318 4.668 1.00 0.00 N ATOM 617 CA GLN A 825 -8.138 -7.888 3.677 1.00 0.00 C ATOM 618 C GLN A 825 -7.782 -6.415 3.877 1.00 0.00 C ATOM 619 O GLN A 825 -6.608 -6.045 3.875 1.00 0.00 O ATOM 620 CB GLN A 825 -8.680 -8.104 2.260 1.00 0.00 C ATOM 621 CG GLN A 825 -9.082 -9.540 1.953 1.00 0.00 C ATOM 622 CD GLN A 825 -7.922 -10.515 2.012 1.00 0.00 C ATOM 623 OE1 GLN A 825 -6.777 -10.164 1.732 1.00 0.00 O ATOM 624 NE2 GLN A 825 -8.217 -11.753 2.374 1.00 0.00 N ATOM 0 H GLN A 825 -10.005 -8.634 4.272 1.00 0.00 H new ATOM 0 HA GLN A 825 -7.237 -8.488 3.808 1.00 0.00 H new ATOM 0 HB2 GLN A 825 -9.545 -7.458 2.113 1.00 0.00 H new ATOM 0 HB3 GLN A 825 -7.922 -7.790 1.542 1.00 0.00 H new ATOM 0 HG2 GLN A 825 -9.848 -9.855 2.662 1.00 0.00 H new ATOM 0 HG3 GLN A 825 -9.531 -9.580 0.960 1.00 0.00 H new ATOM 0 HE21 GLN A 825 -9.180 -12.003 2.598 1.00 0.00 H new ATOM 0 HE22 GLN A 825 -7.481 -12.457 2.429 1.00 0.00 H new ATOM 633 N ALA A 826 -8.804 -5.581 4.057 1.00 0.00 N ATOM 634 CA ALA A 826 -8.607 -4.155 4.306 1.00 0.00 C ATOM 635 C ALA A 826 -7.742 -3.908 5.543 1.00 0.00 C ATOM 636 O ALA A 826 -6.902 -3.008 5.546 1.00 0.00 O ATOM 637 CB ALA A 826 -9.948 -3.456 4.452 1.00 0.00 C ATOM 0 H ALA A 826 -9.782 -5.870 4.035 1.00 0.00 H new ATOM 0 HA ALA A 826 -8.079 -3.741 3.447 1.00 0.00 H new ATOM 0 HB1 ALA A 826 -9.787 -2.394 4.637 1.00 0.00 H new ATOM 0 HB2 ALA A 826 -10.525 -3.581 3.536 1.00 0.00 H new ATOM 0 HB3 ALA A 826 -10.496 -3.891 5.288 1.00 0.00 H new ATOM 643 N ARG A 827 -7.949 -4.701 6.595 1.00 0.00 N ATOM 644 CA ARG A 827 -7.147 -4.575 7.813 1.00 0.00 C ATOM 645 C ARG A 827 -5.681 -4.867 7.514 1.00 0.00 C ATOM 646 O ARG A 827 -4.786 -4.205 8.042 1.00 0.00 O ATOM 647 CB ARG A 827 -7.632 -5.525 8.912 1.00 0.00 C ATOM 648 CG ARG A 827 -9.077 -5.316 9.337 1.00 0.00 C ATOM 649 CD ARG A 827 -9.442 -6.208 10.515 1.00 0.00 C ATOM 650 NE ARG A 827 -8.936 -7.572 10.346 1.00 0.00 N ATOM 651 CZ ARG A 827 -9.292 -8.613 11.100 1.00 0.00 C ATOM 652 NH1 ARG A 827 -10.234 -8.491 12.025 1.00 0.00 N ATOM 653 NH2 ARG A 827 -8.709 -9.787 10.906 1.00 0.00 N ATOM 0 H ARG A 827 -8.659 -5.432 6.629 1.00 0.00 H new ATOM 0 HA ARG A 827 -7.258 -3.550 8.168 1.00 0.00 H new ATOM 0 HB2 ARG A 827 -7.514 -6.551 8.565 1.00 0.00 H new ATOM 0 HB3 ARG A 827 -6.990 -5.408 9.785 1.00 0.00 H new ATOM 0 HG2 ARG A 827 -9.231 -4.271 9.608 1.00 0.00 H new ATOM 0 HG3 ARG A 827 -9.739 -5.529 8.498 1.00 0.00 H new ATOM 0 HD2 ARG A 827 -9.036 -5.782 11.432 1.00 0.00 H new ATOM 0 HD3 ARG A 827 -10.526 -6.234 10.628 1.00 0.00 H new ATOM 0 HE ARG A 827 -8.263 -7.738 9.598 1.00 0.00 H new ATOM 0 HH11 ARG A 827 -10.696 -7.593 12.167 1.00 0.00 H new ATOM 0 HH12 ARG A 827 -10.497 -9.295 12.595 1.00 0.00 H new ATOM 0 HH21 ARG A 827 -7.995 -9.889 10.185 1.00 0.00 H new ATOM 0 HH22 ARG A 827 -8.975 -10.589 11.478 1.00 0.00 H new ATOM 667 N ILE A 828 -5.447 -5.861 6.663 1.00 0.00 N ATOM 668 CA ILE A 828 -4.093 -6.219 6.256 1.00 0.00 C ATOM 669 C ILE A 828 -3.439 -5.045 5.539 1.00 0.00 C ATOM 670 O ILE A 828 -2.274 -4.731 5.777 1.00 0.00 O ATOM 671 CB ILE A 828 -4.085 -7.457 5.331 1.00 0.00 C ATOM 672 CG1 ILE A 828 -4.767 -8.641 6.022 1.00 0.00 C ATOM 673 CG2 ILE A 828 -2.658 -7.821 4.936 1.00 0.00 C ATOM 674 CD1 ILE A 828 -4.923 -9.859 5.137 1.00 0.00 C ATOM 0 H ILE A 828 -6.179 -6.433 6.242 1.00 0.00 H new ATOM 0 HA ILE A 828 -3.530 -6.464 7.157 1.00 0.00 H new ATOM 0 HB ILE A 828 -4.641 -7.215 4.425 1.00 0.00 H new ATOM 0 HG12 ILE A 828 -4.189 -8.916 6.904 1.00 0.00 H new ATOM 0 HG13 ILE A 828 -5.751 -8.328 6.370 1.00 0.00 H new ATOM 0 HG21 ILE A 828 -2.672 -8.695 4.285 1.00 0.00 H new ATOM 0 HG22 ILE A 828 -2.201 -6.983 4.409 1.00 0.00 H new ATOM 0 HG23 ILE A 828 -2.079 -8.045 5.832 1.00 0.00 H new ATOM 0 HD11 ILE A 828 -5.414 -10.655 5.697 1.00 0.00 H new ATOM 0 HD12 ILE A 828 -5.527 -9.602 4.267 1.00 0.00 H new ATOM 0 HD13 ILE A 828 -3.941 -10.199 4.809 1.00 0.00 H new ATOM 686 N LEU A 829 -4.208 -4.387 4.680 1.00 0.00 N ATOM 687 CA LEU A 829 -3.728 -3.209 3.968 1.00 0.00 C ATOM 688 C LEU A 829 -3.362 -2.101 4.940 1.00 0.00 C ATOM 689 O LEU A 829 -2.276 -1.540 4.860 1.00 0.00 O ATOM 690 CB LEU A 829 -4.784 -2.698 2.992 1.00 0.00 C ATOM 691 CG LEU A 829 -5.112 -3.639 1.839 1.00 0.00 C ATOM 692 CD1 LEU A 829 -6.167 -3.020 0.947 1.00 0.00 C ATOM 693 CD2 LEU A 829 -3.859 -3.961 1.040 1.00 0.00 C ATOM 0 H LEU A 829 -5.169 -4.650 4.459 1.00 0.00 H new ATOM 0 HA LEU A 829 -2.838 -3.501 3.410 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -5.700 -2.496 3.546 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -4.445 -1.748 2.579 1.00 0.00 H new ATOM 0 HG LEU A 829 -5.503 -4.570 2.248 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -6.394 -3.700 0.126 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -7.071 -2.836 1.527 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -5.796 -2.077 0.545 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -4.113 -4.634 0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -3.438 -3.040 0.636 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -3.126 -4.440 1.690 1.00 0.00 H new ATOM 705 N ALA A 830 -4.267 -1.805 5.865 1.00 0.00 N ATOM 706 CA ALA A 830 -4.032 -0.767 6.863 1.00 0.00 C ATOM 707 C ALA A 830 -2.739 -1.036 7.625 1.00 0.00 C ATOM 708 O ALA A 830 -1.946 -0.126 7.871 1.00 0.00 O ATOM 709 CB ALA A 830 -5.209 -0.680 7.822 1.00 0.00 C ATOM 0 H ALA A 830 -5.172 -2.269 5.945 1.00 0.00 H new ATOM 0 HA ALA A 830 -3.932 0.189 6.349 1.00 0.00 H new ATOM 0 HB1 ALA A 830 -5.019 0.099 8.561 1.00 0.00 H new ATOM 0 HB2 ALA A 830 -6.115 -0.439 7.265 1.00 0.00 H new ATOM 0 HB3 ALA A 830 -5.338 -1.637 8.328 1.00 0.00 H new ATOM 715 N GLN A 831 -2.527 -2.296 7.977 1.00 0.00 N ATOM 716 CA GLN A 831 -1.330 -2.703 8.700 1.00 0.00 C ATOM 717 C GLN A 831 -0.090 -2.577 7.815 1.00 0.00 C ATOM 718 O GLN A 831 0.917 -1.995 8.220 1.00 0.00 O ATOM 719 CB GLN A 831 -1.487 -4.143 9.176 1.00 0.00 C ATOM 720 CG GLN A 831 -0.370 -4.616 10.086 1.00 0.00 C ATOM 721 CD GLN A 831 -0.456 -6.099 10.366 1.00 0.00 C ATOM 722 OE1 GLN A 831 0.142 -6.911 9.660 1.00 0.00 O ATOM 723 NE2 GLN A 831 -1.229 -6.469 11.371 1.00 0.00 N ATOM 0 H GLN A 831 -3.173 -3.059 7.772 1.00 0.00 H new ATOM 0 HA GLN A 831 -1.202 -2.046 9.560 1.00 0.00 H new ATOM 0 HB2 GLN A 831 -2.436 -4.239 9.703 1.00 0.00 H new ATOM 0 HB3 GLN A 831 -1.536 -4.799 8.307 1.00 0.00 H new ATOM 0 HG2 GLN A 831 0.592 -4.389 9.627 1.00 0.00 H new ATOM 0 HG3 GLN A 831 -0.412 -4.067 11.027 1.00 0.00 H new ATOM 0 HE21 GLN A 831 -1.708 -5.765 11.932 1.00 0.00 H new ATOM 0 HE22 GLN A 831 -1.347 -7.459 11.586 1.00 0.00 H new ATOM 732 N ALA A 832 -0.181 -3.119 6.606 1.00 0.00 N ATOM 733 CA ALA A 832 0.939 -3.127 5.673 1.00 0.00 C ATOM 734 C ALA A 832 1.314 -1.718 5.245 1.00 0.00 C ATOM 735 O ALA A 832 2.496 -1.372 5.183 1.00 0.00 O ATOM 736 CB ALA A 832 0.600 -3.977 4.464 1.00 0.00 C ATOM 0 H ALA A 832 -1.027 -3.562 6.247 1.00 0.00 H new ATOM 0 HA ALA A 832 1.802 -3.558 6.181 1.00 0.00 H new ATOM 0 HB1 ALA A 832 1.442 -3.978 3.772 1.00 0.00 H new ATOM 0 HB2 ALA A 832 0.392 -4.998 4.784 1.00 0.00 H new ATOM 0 HB3 ALA A 832 -0.279 -3.567 3.966 1.00 0.00 H new ATOM 742 N THR A 833 0.310 -0.908 4.952 1.00 0.00 N ATOM 743 CA THR A 833 0.534 0.479 4.596 1.00 0.00 C ATOM 744 C THR A 833 1.252 1.204 5.723 1.00 0.00 C ATOM 745 O THR A 833 2.164 1.994 5.483 1.00 0.00 O ATOM 746 CB THR A 833 -0.790 1.203 4.285 1.00 0.00 C ATOM 747 OG1 THR A 833 -1.358 0.689 3.076 1.00 0.00 O ATOM 748 CG2 THR A 833 -0.579 2.704 4.164 1.00 0.00 C ATOM 0 H THR A 833 -0.670 -1.190 4.954 1.00 0.00 H new ATOM 0 HA THR A 833 1.153 0.491 3.699 1.00 0.00 H new ATOM 0 HB THR A 833 -1.478 1.022 5.111 1.00 0.00 H new ATOM 0 HG1 THR A 833 -2.024 1.321 2.733 1.00 0.00 H new ATOM 0 HG21 THR A 833 -1.530 3.189 3.944 1.00 0.00 H new ATOM 0 HG22 THR A 833 -0.182 3.092 5.102 1.00 0.00 H new ATOM 0 HG23 THR A 833 0.127 2.908 3.359 1.00 0.00 H new ATOM 756 N SER A 834 0.861 0.897 6.952 1.00 0.00 N ATOM 757 CA SER A 834 1.447 1.547 8.117 1.00 0.00 C ATOM 758 C SER A 834 2.944 1.268 8.189 1.00 0.00 C ATOM 759 O SER A 834 3.730 2.132 8.580 1.00 0.00 O ATOM 760 CB SER A 834 0.753 1.081 9.395 1.00 0.00 C ATOM 761 OG SER A 834 -0.600 1.510 9.424 1.00 0.00 O ATOM 0 H SER A 834 0.144 0.205 7.168 1.00 0.00 H new ATOM 0 HA SER A 834 1.303 2.623 8.020 1.00 0.00 H new ATOM 0 HB2 SER A 834 0.795 -0.006 9.460 1.00 0.00 H new ATOM 0 HB3 SER A 834 1.281 1.473 10.264 1.00 0.00 H new ATOM 0 HG SER A 834 -1.068 1.169 8.633 1.00 0.00 H new ATOM 767 N ASP A 835 3.331 0.065 7.781 1.00 0.00 N ATOM 768 CA ASP A 835 4.736 -0.310 7.741 1.00 0.00 C ATOM 769 C ASP A 835 5.480 0.570 6.743 1.00 0.00 C ATOM 770 O ASP A 835 6.528 1.135 7.056 1.00 0.00 O ATOM 771 CB ASP A 835 4.883 -1.783 7.357 1.00 0.00 C ATOM 772 CG ASP A 835 6.297 -2.293 7.539 1.00 0.00 C ATOM 773 OD1 ASP A 835 6.635 -2.726 8.662 1.00 0.00 O ATOM 774 OD2 ASP A 835 7.076 -2.270 6.565 1.00 0.00 O ATOM 0 H ASP A 835 2.690 -0.666 7.473 1.00 0.00 H new ATOM 0 HA ASP A 835 5.167 -0.165 8.732 1.00 0.00 H new ATOM 0 HB2 ASP A 835 4.204 -2.382 7.963 1.00 0.00 H new ATOM 0 HB3 ASP A 835 4.584 -1.915 6.317 1.00 0.00 H new ATOM 779 N LEU A 836 4.909 0.707 5.550 1.00 0.00 N ATOM 780 CA LEU A 836 5.504 1.536 4.507 1.00 0.00 C ATOM 781 C LEU A 836 5.534 3.005 4.899 1.00 0.00 C ATOM 782 O LEU A 836 6.538 3.674 4.694 1.00 0.00 O ATOM 783 CB LEU A 836 4.750 1.378 3.188 1.00 0.00 C ATOM 784 CG LEU A 836 5.192 0.193 2.335 1.00 0.00 C ATOM 785 CD1 LEU A 836 4.326 0.080 1.092 1.00 0.00 C ATOM 786 CD2 LEU A 836 6.656 0.339 1.950 1.00 0.00 C ATOM 0 H LEU A 836 4.035 0.255 5.282 1.00 0.00 H new ATOM 0 HA LEU A 836 6.531 1.193 4.380 1.00 0.00 H new ATOM 0 HB2 LEU A 836 3.687 1.275 3.404 1.00 0.00 H new ATOM 0 HB3 LEU A 836 4.870 2.291 2.606 1.00 0.00 H new ATOM 0 HG LEU A 836 5.075 -0.719 2.920 1.00 0.00 H new ATOM 0 HD11 LEU A 836 4.655 -0.771 0.495 1.00 0.00 H new ATOM 0 HD12 LEU A 836 3.286 -0.063 1.385 1.00 0.00 H new ATOM 0 HD13 LEU A 836 4.414 0.993 0.503 1.00 0.00 H new ATOM 0 HD21 LEU A 836 6.959 -0.513 1.341 1.00 0.00 H new ATOM 0 HD22 LEU A 836 6.793 1.258 1.381 1.00 0.00 H new ATOM 0 HD23 LEU A 836 7.267 0.377 2.852 1.00 0.00 H new ATOM 798 N VAL A 837 4.436 3.504 5.455 1.00 0.00 N ATOM 799 CA VAL A 837 4.350 4.907 5.849 1.00 0.00 C ATOM 800 C VAL A 837 5.515 5.293 6.755 1.00 0.00 C ATOM 801 O VAL A 837 6.199 6.284 6.508 1.00 0.00 O ATOM 802 CB VAL A 837 3.012 5.222 6.557 1.00 0.00 C ATOM 803 CG1 VAL A 837 2.999 6.644 7.098 1.00 0.00 C ATOM 804 CG2 VAL A 837 1.846 5.014 5.602 1.00 0.00 C ATOM 0 H VAL A 837 3.594 2.960 5.643 1.00 0.00 H new ATOM 0 HA VAL A 837 4.400 5.497 4.934 1.00 0.00 H new ATOM 0 HB VAL A 837 2.908 4.537 7.398 1.00 0.00 H new ATOM 0 HG11 VAL A 837 2.046 6.837 7.591 1.00 0.00 H new ATOM 0 HG12 VAL A 837 3.810 6.768 7.816 1.00 0.00 H new ATOM 0 HG13 VAL A 837 3.132 7.347 6.276 1.00 0.00 H new ATOM 0 HG21 VAL A 837 0.911 5.240 6.115 1.00 0.00 H new ATOM 0 HG22 VAL A 837 1.957 5.675 4.743 1.00 0.00 H new ATOM 0 HG23 VAL A 837 1.833 3.978 5.264 1.00 0.00 H new ATOM 814 N ASN A 838 5.760 4.487 7.781 1.00 0.00 N ATOM 815 CA ASN A 838 6.855 4.753 8.708 1.00 0.00 C ATOM 816 C ASN A 838 8.201 4.591 8.017 1.00 0.00 C ATOM 817 O ASN A 838 9.088 5.433 8.167 1.00 0.00 O ATOM 818 CB ASN A 838 6.780 3.832 9.927 1.00 0.00 C ATOM 819 CG ASN A 838 5.669 4.227 10.885 1.00 0.00 C ATOM 820 OD1 ASN A 838 5.867 5.048 11.778 1.00 0.00 O ATOM 821 ND2 ASN A 838 4.493 3.646 10.711 1.00 0.00 N ATOM 0 H ASN A 838 5.219 3.648 7.992 1.00 0.00 H new ATOM 0 HA ASN A 838 6.756 5.784 9.047 1.00 0.00 H new ATOM 0 HB2 ASN A 838 6.621 2.806 9.594 1.00 0.00 H new ATOM 0 HB3 ASN A 838 7.734 3.852 10.454 1.00 0.00 H new ATOM 0 HD21 ASN A 838 3.715 3.875 11.329 1.00 0.00 H new ATOM 0 HD22 ASN A 838 4.365 2.969 9.959 1.00 0.00 H new ATOM 828 N ALA A 839 8.339 3.519 7.245 1.00 0.00 N ATOM 829 CA ALA A 839 9.581 3.234 6.539 1.00 0.00 C ATOM 830 C ALA A 839 9.930 4.345 5.555 1.00 0.00 C ATOM 831 O ALA A 839 11.023 4.901 5.603 1.00 0.00 O ATOM 832 CB ALA A 839 9.477 1.903 5.813 1.00 0.00 C ATOM 0 H ALA A 839 7.602 2.831 7.092 1.00 0.00 H new ATOM 0 HA ALA A 839 10.381 3.178 7.277 1.00 0.00 H new ATOM 0 HB1 ALA A 839 10.411 1.700 5.289 1.00 0.00 H new ATOM 0 HB2 ALA A 839 9.286 1.109 6.535 1.00 0.00 H new ATOM 0 HB3 ALA A 839 8.659 1.944 5.094 1.00 0.00 H new ATOM 838 N ILE A 840 8.985 4.675 4.683 1.00 0.00 N ATOM 839 CA ILE A 840 9.200 5.690 3.660 1.00 0.00 C ATOM 840 C ILE A 840 9.526 7.048 4.283 1.00 0.00 C ATOM 841 O ILE A 840 10.472 7.715 3.864 1.00 0.00 O ATOM 842 CB ILE A 840 7.968 5.824 2.737 1.00 0.00 C ATOM 843 CG1 ILE A 840 7.705 4.505 2.003 1.00 0.00 C ATOM 844 CG2 ILE A 840 8.170 6.952 1.737 1.00 0.00 C ATOM 845 CD1 ILE A 840 6.436 4.509 1.175 1.00 0.00 C ATOM 0 H ILE A 840 8.057 4.251 4.665 1.00 0.00 H new ATOM 0 HA ILE A 840 10.053 5.366 3.063 1.00 0.00 H new ATOM 0 HB ILE A 840 7.101 6.059 3.354 1.00 0.00 H new ATOM 0 HG12 ILE A 840 8.552 4.287 1.352 1.00 0.00 H new ATOM 0 HG13 ILE A 840 7.649 3.698 2.734 1.00 0.00 H new ATOM 0 HG21 ILE A 840 7.292 7.031 1.096 1.00 0.00 H new ATOM 0 HG22 ILE A 840 8.315 7.891 2.272 1.00 0.00 H new ATOM 0 HG23 ILE A 840 9.048 6.744 1.126 1.00 0.00 H new ATOM 0 HD11 ILE A 840 6.318 3.542 0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 840 5.579 4.695 1.823 1.00 0.00 H new ATOM 0 HD13 ILE A 840 6.497 5.293 0.420 1.00 0.00 H new ATOM 857 N LYS A 841 8.753 7.445 5.291 1.00 0.00 N ATOM 858 CA LYS A 841 8.982 8.717 5.977 1.00 0.00 C ATOM 859 C LYS A 841 10.381 8.775 6.579 1.00 0.00 C ATOM 860 O LYS A 841 11.118 9.741 6.376 1.00 0.00 O ATOM 861 CB LYS A 841 7.945 8.934 7.082 1.00 0.00 C ATOM 862 CG LYS A 841 6.583 9.384 6.581 1.00 0.00 C ATOM 863 CD LYS A 841 5.569 9.397 7.713 1.00 0.00 C ATOM 864 CE LYS A 841 4.259 10.041 7.297 1.00 0.00 C ATOM 865 NZ LYS A 841 4.401 11.504 7.075 1.00 0.00 N ATOM 0 H LYS A 841 7.965 6.907 5.651 1.00 0.00 H new ATOM 0 HA LYS A 841 8.886 9.508 5.233 1.00 0.00 H new ATOM 0 HB2 LYS A 841 7.825 8.005 7.640 1.00 0.00 H new ATOM 0 HB3 LYS A 841 8.326 9.678 7.781 1.00 0.00 H new ATOM 0 HG2 LYS A 841 6.662 10.380 6.146 1.00 0.00 H new ATOM 0 HG3 LYS A 841 6.243 8.716 5.790 1.00 0.00 H new ATOM 0 HD2 LYS A 841 5.382 8.375 8.043 1.00 0.00 H new ATOM 0 HD3 LYS A 841 5.984 9.936 8.565 1.00 0.00 H new ATOM 0 HE2 LYS A 841 3.898 9.569 6.383 1.00 0.00 H new ATOM 0 HE3 LYS A 841 3.508 9.863 8.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 841 3.458 11.938 7.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 841 4.923 11.927 7.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 841 4.921 11.672 6.190 1.00 0.00 H new ATOM 879 N ALA A 842 10.742 7.726 7.309 1.00 0.00 N ATOM 880 CA ALA A 842 12.021 7.673 8.000 1.00 0.00 C ATOM 881 C ALA A 842 13.177 7.559 7.017 1.00 0.00 C ATOM 882 O ALA A 842 14.259 8.101 7.251 1.00 0.00 O ATOM 883 CB ALA A 842 12.046 6.506 8.973 1.00 0.00 C ATOM 0 H ALA A 842 10.162 6.897 7.437 1.00 0.00 H new ATOM 0 HA ALA A 842 12.140 8.604 8.555 1.00 0.00 H new ATOM 0 HB1 ALA A 842 13.009 6.478 9.483 1.00 0.00 H new ATOM 0 HB2 ALA A 842 11.250 6.627 9.707 1.00 0.00 H new ATOM 0 HB3 ALA A 842 11.897 5.574 8.427 1.00 0.00 H new ATOM 889 N ASP A 843 12.952 6.849 5.922 1.00 0.00 N ATOM 890 CA ASP A 843 13.991 6.640 4.926 1.00 0.00 C ATOM 891 C ASP A 843 14.220 7.912 4.122 1.00 0.00 C ATOM 892 O ASP A 843 15.346 8.225 3.742 1.00 0.00 O ATOM 893 CB ASP A 843 13.616 5.484 3.998 1.00 0.00 C ATOM 894 CG ASP A 843 14.764 5.068 3.107 1.00 0.00 C ATOM 895 OD1 ASP A 843 14.975 5.720 2.059 1.00 0.00 O ATOM 896 OD2 ASP A 843 15.457 4.090 3.443 1.00 0.00 O ATOM 0 H ASP A 843 12.059 6.408 5.701 1.00 0.00 H new ATOM 0 HA ASP A 843 14.917 6.384 5.441 1.00 0.00 H new ATOM 0 HB2 ASP A 843 13.295 4.631 4.596 1.00 0.00 H new ATOM 0 HB3 ASP A 843 12.767 5.778 3.380 1.00 0.00 H new ATOM 901 N ALA A 844 13.144 8.661 3.895 1.00 0.00 N ATOM 902 CA ALA A 844 13.223 9.930 3.179 1.00 0.00 C ATOM 903 C ALA A 844 14.060 10.943 3.953 1.00 0.00 C ATOM 904 O ALA A 844 14.599 11.890 3.376 1.00 0.00 O ATOM 905 CB ALA A 844 11.830 10.482 2.923 1.00 0.00 C ATOM 0 H ALA A 844 12.203 8.409 4.198 1.00 0.00 H new ATOM 0 HA ALA A 844 13.710 9.748 2.221 1.00 0.00 H new ATOM 0 HB1 ALA A 844 11.906 11.429 2.388 1.00 0.00 H new ATOM 0 HB2 ALA A 844 11.262 9.771 2.323 1.00 0.00 H new ATOM 0 HB3 ALA A 844 11.322 10.642 3.874 1.00 0.00 H new ATOM 911 N GLU A 845 14.155 10.738 5.263 1.00 0.00 N ATOM 912 CA GLU A 845 14.981 11.582 6.119 1.00 0.00 C ATOM 913 C GLU A 845 16.460 11.296 5.875 1.00 0.00 C ATOM 914 O GLU A 845 17.320 12.146 6.112 1.00 0.00 O ATOM 915 CB GLU A 845 14.650 11.334 7.592 1.00 0.00 C ATOM 916 CG GLU A 845 13.193 11.575 7.950 1.00 0.00 C ATOM 917 CD GLU A 845 12.895 11.296 9.407 1.00 0.00 C ATOM 918 OE1 GLU A 845 12.719 10.112 9.770 1.00 0.00 O ATOM 919 OE2 GLU A 845 12.839 12.256 10.201 1.00 0.00 O ATOM 0 H GLU A 845 13.667 9.991 5.757 1.00 0.00 H new ATOM 0 HA GLU A 845 14.772 12.624 5.877 1.00 0.00 H new ATOM 0 HB2 GLU A 845 14.909 10.306 7.843 1.00 0.00 H new ATOM 0 HB3 GLU A 845 15.276 11.980 8.208 1.00 0.00 H new ATOM 0 HG2 GLU A 845 12.933 12.609 7.722 1.00 0.00 H new ATOM 0 HG3 GLU A 845 12.561 10.943 7.327 1.00 0.00 H new ATOM 926 N GLY A 846 16.745 10.090 5.400 1.00 0.00 N ATOM 927 CA GLY A 846 18.112 9.697 5.130 1.00 0.00 C ATOM 928 C GLY A 846 18.489 9.906 3.679 1.00 0.00 C ATOM 929 O GLY A 846 19.665 10.083 3.356 1.00 0.00 O ATOM 0 H GLY A 846 16.048 9.374 5.196 1.00 0.00 H new ATOM 0 HA2 GLY A 846 18.786 10.271 5.765 1.00 0.00 H new ATOM 0 HA3 GLY A 846 18.245 8.647 5.391 1.00 0.00 H new ATOM 933 N GLU A 847 17.491 9.862 2.804 1.00 0.00 N ATOM 934 CA GLU A 847 17.689 10.122 1.384 1.00 0.00 C ATOM 935 C GLU A 847 18.255 11.526 1.188 1.00 0.00 C ATOM 936 O GLU A 847 17.693 12.499 1.690 1.00 0.00 O ATOM 937 CB GLU A 847 16.357 9.976 0.642 1.00 0.00 C ATOM 938 CG GLU A 847 16.483 9.984 -0.871 1.00 0.00 C ATOM 939 CD GLU A 847 17.317 8.832 -1.395 1.00 0.00 C ATOM 940 OE1 GLU A 847 16.956 7.665 -1.137 1.00 0.00 O ATOM 941 OE2 GLU A 847 18.339 9.092 -2.064 1.00 0.00 O ATOM 0 H GLU A 847 16.527 9.646 3.057 1.00 0.00 H new ATOM 0 HA GLU A 847 18.398 9.400 0.980 1.00 0.00 H new ATOM 0 HB2 GLU A 847 15.882 9.045 0.951 1.00 0.00 H new ATOM 0 HB3 GLU A 847 15.695 10.787 0.944 1.00 0.00 H new ATOM 0 HG2 GLU A 847 15.488 9.938 -1.314 1.00 0.00 H new ATOM 0 HG3 GLU A 847 16.931 10.925 -1.189 1.00 0.00 H new ATOM 948 N SER A 848 19.369 11.630 0.478 1.00 0.00 N ATOM 949 CA SER A 848 20.022 12.915 0.273 1.00 0.00 C ATOM 950 C SER A 848 19.402 13.669 -0.897 1.00 0.00 C ATOM 951 O SER A 848 19.362 14.899 -0.900 1.00 0.00 O ATOM 952 CB SER A 848 21.516 12.718 0.037 1.00 0.00 C ATOM 953 OG SER A 848 22.117 12.037 1.128 1.00 0.00 O ATOM 0 H SER A 848 19.839 10.841 0.035 1.00 0.00 H new ATOM 0 HA SER A 848 19.879 13.511 1.174 1.00 0.00 H new ATOM 0 HB2 SER A 848 21.671 12.151 -0.881 1.00 0.00 H new ATOM 0 HB3 SER A 848 21.997 13.686 -0.102 1.00 0.00 H new ATOM 0 HG SER A 848 23.074 11.921 0.954 1.00 0.00 H new ATOM 959 N ASP A 849 18.903 12.931 -1.881 1.00 0.00 N ATOM 960 CA ASP A 849 18.291 13.545 -3.054 1.00 0.00 C ATOM 961 C ASP A 849 16.952 14.152 -2.671 1.00 0.00 C ATOM 962 O ASP A 849 15.969 13.435 -2.529 1.00 0.00 O ATOM 963 CB ASP A 849 18.090 12.512 -4.167 1.00 0.00 C ATOM 964 CG ASP A 849 17.650 13.147 -5.473 1.00 0.00 C ATOM 965 OD1 ASP A 849 18.491 13.773 -6.151 1.00 0.00 O ATOM 966 OD2 ASP A 849 16.454 13.037 -5.816 1.00 0.00 O ATOM 0 H ASP A 849 18.910 11.911 -1.891 1.00 0.00 H new ATOM 0 HA ASP A 849 18.956 14.325 -3.424 1.00 0.00 H new ATOM 0 HB2 ASP A 849 19.021 11.968 -4.326 1.00 0.00 H new ATOM 0 HB3 ASP A 849 17.344 11.782 -3.851 1.00 0.00 H new ATOM 971 N LEU A 850 16.928 15.467 -2.493 1.00 0.00 N ATOM 972 CA LEU A 850 15.748 16.155 -1.975 1.00 0.00 C ATOM 973 C LEU A 850 14.513 15.889 -2.828 1.00 0.00 C ATOM 974 O LEU A 850 13.416 15.720 -2.297 1.00 0.00 O ATOM 975 CB LEU A 850 16.000 17.646 -1.880 1.00 0.00 C ATOM 976 CG LEU A 850 14.987 18.407 -1.023 1.00 0.00 C ATOM 977 CD1 LEU A 850 14.458 17.531 0.108 1.00 0.00 C ATOM 978 CD2 LEU A 850 15.649 19.623 -0.438 1.00 0.00 C ATOM 0 H LEU A 850 17.715 16.082 -2.700 1.00 0.00 H new ATOM 0 HA LEU A 850 15.556 15.759 -0.978 1.00 0.00 H new ATOM 0 HB2 LEU A 850 16.997 17.808 -1.471 1.00 0.00 H new ATOM 0 HB3 LEU A 850 15.996 18.067 -2.885 1.00 0.00 H new ATOM 0 HG LEU A 850 14.149 18.698 -1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 850 13.740 18.097 0.701 1.00 0.00 H new ATOM 0 HD12 LEU A 850 13.969 16.652 -0.311 1.00 0.00 H new ATOM 0 HD13 LEU A 850 15.286 17.217 0.743 1.00 0.00 H new ATOM 0 HD21 LEU A 850 14.931 20.169 0.174 1.00 0.00 H new ATOM 0 HD22 LEU A 850 16.493 19.316 0.180 1.00 0.00 H new ATOM 0 HD23 LEU A 850 16.004 20.267 -1.243 1.00 0.00 H new ATOM 990 N GLU A 851 14.693 15.848 -4.143 1.00 0.00 N ATOM 991 CA GLU A 851 13.589 15.556 -5.050 1.00 0.00 C ATOM 992 C GLU A 851 12.968 14.209 -4.703 1.00 0.00 C ATOM 993 O GLU A 851 11.748 14.088 -4.573 1.00 0.00 O ATOM 994 CB GLU A 851 14.069 15.543 -6.498 1.00 0.00 C ATOM 995 CG GLU A 851 14.734 16.832 -6.940 1.00 0.00 C ATOM 996 CD GLU A 851 15.149 16.791 -8.395 1.00 0.00 C ATOM 997 OE1 GLU A 851 16.196 16.186 -8.702 1.00 0.00 O ATOM 998 OE2 GLU A 851 14.434 17.372 -9.237 1.00 0.00 O ATOM 0 H GLU A 851 15.588 16.012 -4.603 1.00 0.00 H new ATOM 0 HA GLU A 851 12.839 16.339 -4.938 1.00 0.00 H new ATOM 0 HB2 GLU A 851 14.772 14.720 -6.629 1.00 0.00 H new ATOM 0 HB3 GLU A 851 13.219 15.343 -7.150 1.00 0.00 H new ATOM 0 HG2 GLU A 851 14.049 17.665 -6.783 1.00 0.00 H new ATOM 0 HG3 GLU A 851 15.610 17.018 -6.319 1.00 0.00 H new ATOM 1005 N ASN A 852 13.823 13.207 -4.539 1.00 0.00 N ATOM 1006 CA ASN A 852 13.383 11.865 -4.182 1.00 0.00 C ATOM 1007 C ASN A 852 12.886 11.825 -2.737 1.00 0.00 C ATOM 1008 O ASN A 852 11.921 11.130 -2.430 1.00 0.00 O ATOM 1009 CB ASN A 852 14.528 10.868 -4.389 1.00 0.00 C ATOM 1010 CG ASN A 852 14.119 9.420 -4.174 1.00 0.00 C ATOM 1011 OD1 ASN A 852 12.964 9.041 -4.371 1.00 0.00 O ATOM 1012 ND2 ASN A 852 15.080 8.591 -3.802 1.00 0.00 N ATOM 0 H ASN A 852 14.833 13.301 -4.649 1.00 0.00 H new ATOM 0 HA ASN A 852 12.553 11.585 -4.830 1.00 0.00 H new ATOM 0 HB2 ASN A 852 14.918 10.980 -5.400 1.00 0.00 H new ATOM 0 HB3 ASN A 852 15.340 11.113 -3.705 1.00 0.00 H new ATOM 0 HD21 ASN A 852 14.876 7.601 -3.669 1.00 0.00 H new ATOM 0 HD22 ASN A 852 16.025 8.942 -3.648 1.00 0.00 H new ATOM 1019 N SER A 853 13.535 12.589 -1.858 1.00 0.00 N ATOM 1020 CA SER A 853 13.116 12.679 -0.463 1.00 0.00 C ATOM 1021 C SER A 853 11.678 13.183 -0.379 1.00 0.00 C ATOM 1022 O SER A 853 10.833 12.589 0.294 1.00 0.00 O ATOM 1023 CB SER A 853 14.036 13.620 0.317 1.00 0.00 C ATOM 1024 OG SER A 853 15.388 13.205 0.241 1.00 0.00 O ATOM 0 H SER A 853 14.352 13.154 -2.089 1.00 0.00 H new ATOM 0 HA SER A 853 13.177 11.684 -0.023 1.00 0.00 H new ATOM 0 HB2 SER A 853 13.942 14.632 -0.077 1.00 0.00 H new ATOM 0 HB3 SER A 853 13.723 13.654 1.361 1.00 0.00 H new ATOM 0 HG SER A 853 15.696 13.262 -0.688 1.00 0.00 H new ATOM 1030 N ARG A 854 11.412 14.281 -1.079 1.00 0.00 N ATOM 1031 CA ARG A 854 10.073 14.850 -1.150 1.00 0.00 C ATOM 1032 C ARG A 854 9.104 13.865 -1.785 1.00 0.00 C ATOM 1033 O ARG A 854 8.005 13.654 -1.280 1.00 0.00 O ATOM 1034 CB ARG A 854 10.089 16.142 -1.965 1.00 0.00 C ATOM 1035 CG ARG A 854 10.839 17.280 -1.300 1.00 0.00 C ATOM 1036 CD ARG A 854 11.026 18.444 -2.255 1.00 0.00 C ATOM 1037 NE ARG A 854 9.761 18.888 -2.837 1.00 0.00 N ATOM 1038 CZ ARG A 854 9.639 19.364 -4.077 1.00 0.00 C ATOM 1039 NH1 ARG A 854 10.698 19.425 -4.875 1.00 0.00 N ATOM 1040 NH2 ARG A 854 8.455 19.762 -4.521 1.00 0.00 N ATOM 0 H ARG A 854 12.114 14.798 -1.609 1.00 0.00 H new ATOM 0 HA ARG A 854 9.744 15.067 -0.134 1.00 0.00 H new ATOM 0 HB2 ARG A 854 10.541 15.941 -2.937 1.00 0.00 H new ATOM 0 HB3 ARG A 854 9.062 16.456 -2.150 1.00 0.00 H new ATOM 0 HG2 ARG A 854 10.292 17.614 -0.418 1.00 0.00 H new ATOM 0 HG3 ARG A 854 11.812 16.927 -0.957 1.00 0.00 H new ATOM 0 HD2 ARG A 854 11.492 19.275 -1.726 1.00 0.00 H new ATOM 0 HD3 ARG A 854 11.708 18.151 -3.053 1.00 0.00 H new ATOM 0 HE ARG A 854 8.921 18.830 -2.261 1.00 0.00 H new ATOM 0 HH11 ARG A 854 11.608 19.107 -4.540 1.00 0.00 H new ATOM 0 HH12 ARG A 854 10.602 19.789 -5.823 1.00 0.00 H new ATOM 0 HH21 ARG A 854 7.637 19.704 -3.914 1.00 0.00 H new ATOM 0 HH22 ARG A 854 8.362 20.126 -5.469 1.00 0.00 H new ATOM 1054 N LYS A 855 9.533 13.261 -2.888 1.00 0.00 N ATOM 1055 CA LYS A 855 8.716 12.301 -3.617 1.00 0.00 C ATOM 1056 C LYS A 855 8.298 11.143 -2.710 1.00 0.00 C ATOM 1057 O LYS A 855 7.147 10.709 -2.736 1.00 0.00 O ATOM 1058 CB LYS A 855 9.491 11.789 -4.833 1.00 0.00 C ATOM 1059 CG LYS A 855 8.742 10.768 -5.674 1.00 0.00 C ATOM 1060 CD LYS A 855 9.513 10.422 -6.939 1.00 0.00 C ATOM 1061 CE LYS A 855 10.919 9.939 -6.623 1.00 0.00 C ATOM 1062 NZ LYS A 855 11.679 9.594 -7.851 1.00 0.00 N ATOM 0 H LYS A 855 10.452 13.423 -3.299 1.00 0.00 H new ATOM 0 HA LYS A 855 7.807 12.796 -3.959 1.00 0.00 H new ATOM 0 HB2 LYS A 855 9.754 12.638 -5.464 1.00 0.00 H new ATOM 0 HB3 LYS A 855 10.426 11.344 -4.491 1.00 0.00 H new ATOM 0 HG2 LYS A 855 8.575 9.864 -5.089 1.00 0.00 H new ATOM 0 HG3 LYS A 855 7.761 11.162 -5.940 1.00 0.00 H new ATOM 0 HD2 LYS A 855 8.978 9.650 -7.492 1.00 0.00 H new ATOM 0 HD3 LYS A 855 9.565 11.298 -7.585 1.00 0.00 H new ATOM 0 HE2 LYS A 855 11.453 10.713 -6.072 1.00 0.00 H new ATOM 0 HE3 LYS A 855 10.865 9.066 -5.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 855 12.632 9.269 -7.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 855 11.184 8.837 -8.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 855 11.754 10.434 -8.460 1.00 0.00 H new ATOM 1076 N LEU A 856 9.235 10.669 -1.898 1.00 0.00 N ATOM 1077 CA LEU A 856 8.949 9.619 -0.927 1.00 0.00 C ATOM 1078 C LEU A 856 7.888 10.080 0.070 1.00 0.00 C ATOM 1079 O LEU A 856 6.868 9.413 0.255 1.00 0.00 O ATOM 1080 CB LEU A 856 10.229 9.209 -0.187 1.00 0.00 C ATOM 1081 CG LEU A 856 11.240 8.415 -1.020 1.00 0.00 C ATOM 1082 CD1 LEU A 856 12.533 8.208 -0.244 1.00 0.00 C ATOM 1083 CD2 LEU A 856 10.651 7.073 -1.425 1.00 0.00 C ATOM 0 H LEU A 856 10.201 10.996 -1.892 1.00 0.00 H new ATOM 0 HA LEU A 856 8.564 8.753 -1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 856 10.718 10.109 0.186 1.00 0.00 H new ATOM 0 HB3 LEU A 856 9.951 8.613 0.682 1.00 0.00 H new ATOM 0 HG LEU A 856 11.466 8.987 -1.920 1.00 0.00 H new ATOM 0 HD11 LEU A 856 13.237 7.642 -0.854 1.00 0.00 H new ATOM 0 HD12 LEU A 856 12.966 9.176 0.006 1.00 0.00 H new ATOM 0 HD13 LEU A 856 12.323 7.657 0.673 1.00 0.00 H new ATOM 0 HD21 LEU A 856 11.380 6.519 -2.016 1.00 0.00 H new ATOM 0 HD22 LEU A 856 10.399 6.502 -0.532 1.00 0.00 H new ATOM 0 HD23 LEU A 856 9.751 7.235 -2.018 1.00 0.00 H new ATOM 1095 N LEU A 857 8.121 11.232 0.692 1.00 0.00 N ATOM 1096 CA LEU A 857 7.190 11.770 1.683 1.00 0.00 C ATOM 1097 C LEU A 857 5.814 12.021 1.080 1.00 0.00 C ATOM 1098 O LEU A 857 4.791 11.670 1.676 1.00 0.00 O ATOM 1099 CB LEU A 857 7.734 13.068 2.283 1.00 0.00 C ATOM 1100 CG LEU A 857 8.960 12.904 3.177 1.00 0.00 C ATOM 1101 CD1 LEU A 857 9.398 14.253 3.723 1.00 0.00 C ATOM 1102 CD2 LEU A 857 8.662 11.939 4.315 1.00 0.00 C ATOM 0 H LEU A 857 8.945 11.811 0.529 1.00 0.00 H new ATOM 0 HA LEU A 857 7.087 11.024 2.471 1.00 0.00 H new ATOM 0 HB2 LEU A 857 7.985 13.749 1.470 1.00 0.00 H new ATOM 0 HB3 LEU A 857 6.942 13.542 2.862 1.00 0.00 H new ATOM 0 HG LEU A 857 9.773 12.491 2.580 1.00 0.00 H new ATOM 0 HD11 LEU A 857 10.273 14.121 4.359 1.00 0.00 H new ATOM 0 HD12 LEU A 857 9.647 14.917 2.895 1.00 0.00 H new ATOM 0 HD13 LEU A 857 8.588 14.690 4.307 1.00 0.00 H new ATOM 0 HD21 LEU A 857 9.546 11.833 4.943 1.00 0.00 H new ATOM 0 HD22 LEU A 857 7.836 12.325 4.913 1.00 0.00 H new ATOM 0 HD23 LEU A 857 8.389 10.966 3.905 1.00 0.00 H new ATOM 1114 N SER A 858 5.794 12.617 -0.105 1.00 0.00 N ATOM 1115 CA SER A 858 4.550 12.918 -0.791 1.00 0.00 C ATOM 1116 C SER A 858 3.776 11.636 -1.094 1.00 0.00 C ATOM 1117 O SER A 858 2.556 11.582 -0.917 1.00 0.00 O ATOM 1118 CB SER A 858 4.835 13.687 -2.083 1.00 0.00 C ATOM 1119 OG SER A 858 5.519 14.904 -1.814 1.00 0.00 O ATOM 0 H SER A 858 6.632 12.902 -0.611 1.00 0.00 H new ATOM 0 HA SER A 858 3.937 13.540 -0.139 1.00 0.00 H new ATOM 0 HB2 SER A 858 5.434 13.070 -2.753 1.00 0.00 H new ATOM 0 HB3 SER A 858 3.898 13.899 -2.598 1.00 0.00 H new ATOM 0 HG SER A 858 6.453 14.711 -1.590 1.00 0.00 H new ATOM 1125 N ALA A 859 4.492 10.604 -1.528 1.00 0.00 N ATOM 1126 CA ALA A 859 3.879 9.322 -1.853 1.00 0.00 C ATOM 1127 C ALA A 859 3.371 8.623 -0.598 1.00 0.00 C ATOM 1128 O ALA A 859 2.310 8.002 -0.617 1.00 0.00 O ATOM 1129 CB ALA A 859 4.866 8.428 -2.587 1.00 0.00 C ATOM 0 H ALA A 859 5.503 10.632 -1.663 1.00 0.00 H new ATOM 0 HA ALA A 859 3.027 9.515 -2.505 1.00 0.00 H new ATOM 0 HB1 ALA A 859 4.390 7.476 -2.821 1.00 0.00 H new ATOM 0 HB2 ALA A 859 5.179 8.914 -3.511 1.00 0.00 H new ATOM 0 HB3 ALA A 859 5.737 8.253 -1.956 1.00 0.00 H new ATOM 1135 N ALA A 860 4.131 8.730 0.488 1.00 0.00 N ATOM 1136 CA ALA A 860 3.751 8.123 1.759 1.00 0.00 C ATOM 1137 C ALA A 860 2.418 8.673 2.249 1.00 0.00 C ATOM 1138 O ALA A 860 1.558 7.923 2.715 1.00 0.00 O ATOM 1139 CB ALA A 860 4.834 8.349 2.804 1.00 0.00 C ATOM 0 H ALA A 860 5.018 9.234 0.513 1.00 0.00 H new ATOM 0 HA ALA A 860 3.639 7.051 1.600 1.00 0.00 H new ATOM 0 HB1 ALA A 860 4.533 7.889 3.745 1.00 0.00 H new ATOM 0 HB2 ALA A 860 5.767 7.901 2.463 1.00 0.00 H new ATOM 0 HB3 ALA A 860 4.978 9.419 2.953 1.00 0.00 H new ATOM 1145 N LYS A 861 2.248 9.986 2.133 1.00 0.00 N ATOM 1146 CA LYS A 861 1.005 10.630 2.543 1.00 0.00 C ATOM 1147 C LYS A 861 -0.137 10.174 1.636 1.00 0.00 C ATOM 1148 O LYS A 861 -1.222 9.834 2.113 1.00 0.00 O ATOM 1149 CB LYS A 861 1.155 12.160 2.503 1.00 0.00 C ATOM 1150 CG LYS A 861 0.207 12.908 3.441 1.00 0.00 C ATOM 1151 CD LYS A 861 -1.249 12.825 2.995 1.00 0.00 C ATOM 1152 CE LYS A 861 -1.497 13.626 1.726 1.00 0.00 C ATOM 1153 NZ LYS A 861 -2.882 13.445 1.215 1.00 0.00 N ATOM 0 H LYS A 861 2.952 10.623 1.760 1.00 0.00 H new ATOM 0 HA LYS A 861 0.775 10.340 3.568 1.00 0.00 H new ATOM 0 HB2 LYS A 861 2.182 12.420 2.760 1.00 0.00 H new ATOM 0 HB3 LYS A 861 0.985 12.504 1.483 1.00 0.00 H new ATOM 0 HG2 LYS A 861 0.299 12.498 4.447 1.00 0.00 H new ATOM 0 HG3 LYS A 861 0.507 13.954 3.495 1.00 0.00 H new ATOM 0 HD2 LYS A 861 -1.518 11.783 2.825 1.00 0.00 H new ATOM 0 HD3 LYS A 861 -1.895 13.196 3.791 1.00 0.00 H new ATOM 0 HE2 LYS A 861 -1.319 14.683 1.924 1.00 0.00 H new ATOM 0 HE3 LYS A 861 -0.785 13.321 0.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 861 -3.009 14.008 0.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 861 -3.045 12.440 1.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 861 -3.562 13.760 1.936 1.00 0.00 H new ATOM 1167 N ILE A 862 0.119 10.157 0.329 1.00 0.00 N ATOM 1168 CA ILE A 862 -0.868 9.694 -0.641 1.00 0.00 C ATOM 1169 C ILE A 862 -1.287 8.260 -0.328 1.00 0.00 C ATOM 1170 O ILE A 862 -2.476 7.944 -0.280 1.00 0.00 O ATOM 1171 CB ILE A 862 -0.324 9.772 -2.088 1.00 0.00 C ATOM 1172 CG1 ILE A 862 -0.084 11.231 -2.487 1.00 0.00 C ATOM 1173 CG2 ILE A 862 -1.284 9.103 -3.066 1.00 0.00 C ATOM 1174 CD1 ILE A 862 0.547 11.394 -3.853 1.00 0.00 C ATOM 0 H ILE A 862 1.003 10.459 -0.081 1.00 0.00 H new ATOM 0 HA ILE A 862 -1.734 10.351 -0.566 1.00 0.00 H new ATOM 0 HB ILE A 862 0.625 9.238 -2.126 1.00 0.00 H new ATOM 0 HG12 ILE A 862 -1.035 11.764 -2.470 1.00 0.00 H new ATOM 0 HG13 ILE A 862 0.558 11.701 -1.742 1.00 0.00 H new ATOM 0 HG21 ILE A 862 -0.880 9.171 -4.076 1.00 0.00 H new ATOM 0 HG22 ILE A 862 -1.408 8.055 -2.794 1.00 0.00 H new ATOM 0 HG23 ILE A 862 -2.251 9.605 -3.028 1.00 0.00 H new ATOM 0 HD11 ILE A 862 0.686 12.454 -4.065 1.00 0.00 H new ATOM 0 HD12 ILE A 862 1.514 10.891 -3.870 1.00 0.00 H new ATOM 0 HD13 ILE A 862 -0.104 10.955 -4.609 1.00 0.00 H new ATOM 1186 N LEU A 863 -0.297 7.410 -0.086 1.00 0.00 N ATOM 1187 CA LEU A 863 -0.539 6.018 0.259 1.00 0.00 C ATOM 1188 C LEU A 863 -1.401 5.898 1.511 1.00 0.00 C ATOM 1189 O LEU A 863 -2.462 5.268 1.484 1.00 0.00 O ATOM 1190 CB LEU A 863 0.791 5.292 0.469 1.00 0.00 C ATOM 1191 CG LEU A 863 0.694 3.953 1.199 1.00 0.00 C ATOM 1192 CD1 LEU A 863 -0.351 3.065 0.549 1.00 0.00 C ATOM 1193 CD2 LEU A 863 2.048 3.267 1.232 1.00 0.00 C ATOM 0 H LEU A 863 0.690 7.665 -0.123 1.00 0.00 H new ATOM 0 HA LEU A 863 -1.078 5.555 -0.568 1.00 0.00 H new ATOM 0 HB2 LEU A 863 1.253 5.124 -0.504 1.00 0.00 H new ATOM 0 HB3 LEU A 863 1.459 5.946 1.030 1.00 0.00 H new ATOM 0 HG LEU A 863 0.384 4.140 2.227 1.00 0.00 H new ATOM 0 HD11 LEU A 863 -0.405 2.116 1.083 1.00 0.00 H new ATOM 0 HD12 LEU A 863 -1.322 3.559 0.586 1.00 0.00 H new ATOM 0 HD13 LEU A 863 -0.077 2.881 -0.490 1.00 0.00 H new ATOM 0 HD21 LEU A 863 1.961 2.315 1.756 1.00 0.00 H new ATOM 0 HD22 LEU A 863 2.391 3.091 0.213 1.00 0.00 H new ATOM 0 HD23 LEU A 863 2.765 3.902 1.752 1.00 0.00 H new ATOM 1205 N ALA A 864 -0.943 6.504 2.598 1.00 0.00 N ATOM 1206 CA ALA A 864 -1.629 6.407 3.877 1.00 0.00 C ATOM 1207 C ALA A 864 -3.078 6.861 3.767 1.00 0.00 C ATOM 1208 O ALA A 864 -3.954 6.357 4.472 1.00 0.00 O ATOM 1209 CB ALA A 864 -0.894 7.225 4.926 1.00 0.00 C ATOM 0 H ALA A 864 -0.095 7.070 2.618 1.00 0.00 H new ATOM 0 HA ALA A 864 -1.633 5.360 4.180 1.00 0.00 H new ATOM 0 HB1 ALA A 864 -1.415 7.146 5.880 1.00 0.00 H new ATOM 0 HB2 ALA A 864 0.123 6.847 5.036 1.00 0.00 H new ATOM 0 HB3 ALA A 864 -0.861 8.269 4.616 1.00 0.00 H new ATOM 1215 N ASP A 865 -3.335 7.795 2.865 1.00 0.00 N ATOM 1216 CA ASP A 865 -4.675 8.329 2.703 1.00 0.00 C ATOM 1217 C ASP A 865 -5.513 7.469 1.778 1.00 0.00 C ATOM 1218 O ASP A 865 -6.699 7.249 2.033 1.00 0.00 O ATOM 1219 CB ASP A 865 -4.622 9.770 2.192 1.00 0.00 C ATOM 1220 CG ASP A 865 -5.999 10.369 1.991 1.00 0.00 C ATOM 1221 OD1 ASP A 865 -6.663 10.693 2.997 1.00 0.00 O ATOM 1222 OD2 ASP A 865 -6.427 10.512 0.826 1.00 0.00 O ATOM 0 H ASP A 865 -2.637 8.196 2.238 1.00 0.00 H new ATOM 0 HA ASP A 865 -5.152 8.321 3.683 1.00 0.00 H new ATOM 0 HB2 ASP A 865 -4.064 10.382 2.900 1.00 0.00 H new ATOM 0 HB3 ASP A 865 -4.077 9.797 1.248 1.00 0.00 H new ATOM 1227 N ALA A 866 -4.902 6.975 0.715 1.00 0.00 N ATOM 1228 CA ALA A 866 -5.574 6.048 -0.177 1.00 0.00 C ATOM 1229 C ALA A 866 -6.009 4.814 0.601 1.00 0.00 C ATOM 1230 O ALA A 866 -7.061 4.230 0.337 1.00 0.00 O ATOM 1231 CB ALA A 866 -4.657 5.668 -1.328 1.00 0.00 C ATOM 0 H ALA A 866 -3.943 7.200 0.449 1.00 0.00 H new ATOM 0 HA ALA A 866 -6.460 6.527 -0.595 1.00 0.00 H new ATOM 0 HB1 ALA A 866 -5.173 4.972 -1.990 1.00 0.00 H new ATOM 0 HB2 ALA A 866 -4.383 6.564 -1.886 1.00 0.00 H new ATOM 0 HB3 ALA A 866 -3.757 5.195 -0.935 1.00 0.00 H new ATOM 1237 N THR A 867 -5.199 4.448 1.587 1.00 0.00 N ATOM 1238 CA THR A 867 -5.507 3.335 2.464 1.00 0.00 C ATOM 1239 C THR A 867 -6.715 3.650 3.335 1.00 0.00 C ATOM 1240 O THR A 867 -7.651 2.862 3.408 1.00 0.00 O ATOM 1241 CB THR A 867 -4.310 2.998 3.372 1.00 0.00 C ATOM 1242 OG1 THR A 867 -3.126 2.855 2.583 1.00 0.00 O ATOM 1243 CG2 THR A 867 -4.556 1.713 4.149 1.00 0.00 C ATOM 0 H THR A 867 -4.316 4.914 1.797 1.00 0.00 H new ATOM 0 HA THR A 867 -5.730 2.476 1.831 1.00 0.00 H new ATOM 0 HB THR A 867 -4.185 3.815 4.082 1.00 0.00 H new ATOM 0 HG1 THR A 867 -2.844 3.734 2.253 1.00 0.00 H new ATOM 0 HG21 THR A 867 -3.694 1.500 4.782 1.00 0.00 H new ATOM 0 HG22 THR A 867 -5.443 1.828 4.771 1.00 0.00 H new ATOM 0 HG23 THR A 867 -4.707 0.889 3.451 1.00 0.00 H new ATOM 1251 N ALA A 868 -6.690 4.815 3.972 1.00 0.00 N ATOM 1252 CA ALA A 868 -7.764 5.231 4.861 1.00 0.00 C ATOM 1253 C ALA A 868 -9.108 5.220 4.143 1.00 0.00 C ATOM 1254 O ALA A 868 -10.076 4.637 4.633 1.00 0.00 O ATOM 1255 CB ALA A 868 -7.471 6.615 5.417 1.00 0.00 C ATOM 0 H ALA A 868 -5.931 5.491 3.887 1.00 0.00 H new ATOM 0 HA ALA A 868 -7.820 4.520 5.686 1.00 0.00 H new ATOM 0 HB1 ALA A 868 -8.280 6.919 6.081 1.00 0.00 H new ATOM 0 HB2 ALA A 868 -6.534 6.593 5.973 1.00 0.00 H new ATOM 0 HB3 ALA A 868 -7.389 7.327 4.596 1.00 0.00 H new ATOM 1261 N LYS A 869 -9.155 5.850 2.974 1.00 0.00 N ATOM 1262 CA LYS A 869 -10.366 5.891 2.181 1.00 0.00 C ATOM 1263 C LYS A 869 -10.812 4.484 1.798 1.00 0.00 C ATOM 1264 O LYS A 869 -11.991 4.146 1.918 1.00 0.00 O ATOM 1265 CB LYS A 869 -10.138 6.725 0.922 1.00 0.00 C ATOM 1266 CG LYS A 869 -11.430 7.153 0.257 1.00 0.00 C ATOM 1267 CD LYS A 869 -11.178 8.015 -0.969 1.00 0.00 C ATOM 1268 CE LYS A 869 -10.467 7.238 -2.061 1.00 0.00 C ATOM 1269 NZ LYS A 869 -10.174 8.091 -3.241 1.00 0.00 N ATOM 0 H LYS A 869 -8.362 6.339 2.558 1.00 0.00 H new ATOM 0 HA LYS A 869 -11.152 6.350 2.780 1.00 0.00 H new ATOM 0 HB2 LYS A 869 -9.557 7.611 1.179 1.00 0.00 H new ATOM 0 HB3 LYS A 869 -9.544 6.149 0.213 1.00 0.00 H new ATOM 0 HG2 LYS A 869 -12.000 6.270 -0.031 1.00 0.00 H new ATOM 0 HG3 LYS A 869 -12.040 7.707 0.971 1.00 0.00 H new ATOM 0 HD2 LYS A 869 -12.127 8.394 -1.350 1.00 0.00 H new ATOM 0 HD3 LYS A 869 -10.579 8.881 -0.689 1.00 0.00 H new ATOM 0 HE2 LYS A 869 -9.537 6.828 -1.669 1.00 0.00 H new ATOM 0 HE3 LYS A 869 -11.084 6.393 -2.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 869 -9.688 7.526 -3.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 869 -11.064 8.462 -3.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 869 -9.565 8.883 -2.954 1.00 0.00 H new ATOM 1283 N MET A 870 -9.868 3.660 1.354 1.00 0.00 N ATOM 1284 CA MET A 870 -10.185 2.296 0.955 1.00 0.00 C ATOM 1285 C MET A 870 -10.671 1.465 2.134 1.00 0.00 C ATOM 1286 O MET A 870 -11.693 0.795 2.038 1.00 0.00 O ATOM 1287 CB MET A 870 -8.987 1.605 0.309 1.00 0.00 C ATOM 1288 CG MET A 870 -9.170 0.100 0.240 1.00 0.00 C ATOM 1289 SD MET A 870 -8.030 -0.725 -0.864 1.00 0.00 S ATOM 1290 CE MET A 870 -8.777 -2.346 -0.829 1.00 0.00 C ATOM 0 H MET A 870 -8.884 3.912 1.262 1.00 0.00 H new ATOM 0 HA MET A 870 -10.987 2.369 0.221 1.00 0.00 H new ATOM 0 HB2 MET A 870 -8.840 1.999 -0.697 1.00 0.00 H new ATOM 0 HB3 MET A 870 -8.086 1.835 0.877 1.00 0.00 H new ATOM 0 HG2 MET A 870 -9.054 -0.315 1.241 1.00 0.00 H new ATOM 0 HG3 MET A 870 -10.189 -0.117 -0.079 1.00 0.00 H new ATOM 0 HE1 MET A 870 -8.140 -3.052 -1.363 1.00 0.00 H new ATOM 0 HE2 MET A 870 -8.892 -2.671 0.205 1.00 0.00 H new ATOM 0 HE3 MET A 870 -9.755 -2.306 -1.308 1.00 0.00 H new ATOM 1300 N VAL A 871 -9.931 1.501 3.233 1.00 0.00 N ATOM 1301 CA VAL A 871 -10.274 0.729 4.420 1.00 0.00 C ATOM 1302 C VAL A 871 -11.695 1.031 4.883 1.00 0.00 C ATOM 1303 O VAL A 871 -12.483 0.114 5.124 1.00 0.00 O ATOM 1304 CB VAL A 871 -9.271 0.987 5.569 1.00 0.00 C ATOM 1305 CG1 VAL A 871 -9.771 0.411 6.884 1.00 0.00 C ATOM 1306 CG2 VAL A 871 -7.915 0.391 5.224 1.00 0.00 C ATOM 0 H VAL A 871 -9.083 2.061 3.328 1.00 0.00 H new ATOM 0 HA VAL A 871 -10.217 -0.325 4.147 1.00 0.00 H new ATOM 0 HB VAL A 871 -9.172 2.066 5.689 1.00 0.00 H new ATOM 0 HG11 VAL A 871 -9.042 0.610 7.669 1.00 0.00 H new ATOM 0 HG12 VAL A 871 -10.722 0.874 7.146 1.00 0.00 H new ATOM 0 HG13 VAL A 871 -9.908 -0.665 6.781 1.00 0.00 H new ATOM 0 HG21 VAL A 871 -7.217 0.579 6.040 1.00 0.00 H new ATOM 0 HG22 VAL A 871 -8.017 -0.684 5.074 1.00 0.00 H new ATOM 0 HG23 VAL A 871 -7.537 0.850 4.311 1.00 0.00 H new ATOM 1316 N GLU A 872 -12.036 2.311 4.978 1.00 0.00 N ATOM 1317 CA GLU A 872 -13.377 2.702 5.389 1.00 0.00 C ATOM 1318 C GLU A 872 -14.408 2.254 4.362 1.00 0.00 C ATOM 1319 O GLU A 872 -15.488 1.779 4.722 1.00 0.00 O ATOM 1320 CB GLU A 872 -13.468 4.211 5.609 1.00 0.00 C ATOM 1321 CG GLU A 872 -12.565 4.712 6.723 1.00 0.00 C ATOM 1322 CD GLU A 872 -12.909 6.120 7.158 1.00 0.00 C ATOM 1323 OE1 GLU A 872 -13.757 6.271 8.060 1.00 0.00 O ATOM 1324 OE2 GLU A 872 -12.335 7.081 6.606 1.00 0.00 O ATOM 0 H GLU A 872 -11.408 3.089 4.778 1.00 0.00 H new ATOM 0 HA GLU A 872 -13.592 2.207 6.336 1.00 0.00 H new ATOM 0 HB2 GLU A 872 -13.208 4.722 4.682 1.00 0.00 H new ATOM 0 HB3 GLU A 872 -14.500 4.476 5.840 1.00 0.00 H new ATOM 0 HG2 GLU A 872 -12.643 4.041 7.579 1.00 0.00 H new ATOM 0 HG3 GLU A 872 -11.528 4.682 6.388 1.00 0.00 H new ATOM 1331 N ALA A 873 -14.072 2.393 3.084 1.00 0.00 N ATOM 1332 CA ALA A 873 -14.960 1.960 2.013 1.00 0.00 C ATOM 1333 C ALA A 873 -15.177 0.450 2.069 1.00 0.00 C ATOM 1334 O ALA A 873 -16.307 -0.023 1.981 1.00 0.00 O ATOM 1335 CB ALA A 873 -14.406 2.370 0.658 1.00 0.00 C ATOM 0 H ALA A 873 -13.193 2.801 2.766 1.00 0.00 H new ATOM 0 HA ALA A 873 -15.924 2.449 2.152 1.00 0.00 H new ATOM 0 HB1 ALA A 873 -15.084 2.037 -0.128 1.00 0.00 H new ATOM 0 HB2 ALA A 873 -14.309 3.455 0.618 1.00 0.00 H new ATOM 0 HB3 ALA A 873 -13.428 1.912 0.511 1.00 0.00 H new ATOM 1341 N ALA A 874 -14.086 -0.295 2.238 1.00 0.00 N ATOM 1342 CA ALA A 874 -14.136 -1.749 2.315 1.00 0.00 C ATOM 1343 C ALA A 874 -14.993 -2.222 3.482 1.00 0.00 C ATOM 1344 O ALA A 874 -15.829 -3.104 3.318 1.00 0.00 O ATOM 1345 CB ALA A 874 -12.729 -2.319 2.434 1.00 0.00 C ATOM 0 H ALA A 874 -13.147 0.093 2.325 1.00 0.00 H new ATOM 0 HA ALA A 874 -14.595 -2.113 1.396 1.00 0.00 H new ATOM 0 HB1 ALA A 874 -12.781 -3.406 2.491 1.00 0.00 H new ATOM 0 HB2 ALA A 874 -12.144 -2.028 1.562 1.00 0.00 H new ATOM 0 HB3 ALA A 874 -12.254 -1.931 3.335 1.00 0.00 H new ATOM 1351 N LYS A 875 -14.790 -1.629 4.659 1.00 0.00 N ATOM 1352 CA LYS A 875 -15.554 -2.011 5.845 1.00 0.00 C ATOM 1353 C LYS A 875 -17.047 -1.807 5.611 1.00 0.00 C ATOM 1354 O LYS A 875 -17.865 -2.664 5.952 1.00 0.00 O ATOM 1355 CB LYS A 875 -15.105 -1.211 7.072 1.00 0.00 C ATOM 1356 CG LYS A 875 -13.647 -1.429 7.447 1.00 0.00 C ATOM 1357 CD LYS A 875 -13.265 -0.746 8.759 1.00 0.00 C ATOM 1358 CE LYS A 875 -13.351 0.777 8.695 1.00 0.00 C ATOM 1359 NZ LYS A 875 -14.746 1.287 8.841 1.00 0.00 N ATOM 0 H LYS A 875 -14.108 -0.887 4.815 1.00 0.00 H new ATOM 0 HA LYS A 875 -15.366 -3.068 6.034 1.00 0.00 H new ATOM 0 HB2 LYS A 875 -15.267 -0.150 6.882 1.00 0.00 H new ATOM 0 HB3 LYS A 875 -15.733 -1.482 7.921 1.00 0.00 H new ATOM 0 HG2 LYS A 875 -13.454 -2.499 7.530 1.00 0.00 H new ATOM 0 HG3 LYS A 875 -13.010 -1.051 6.647 1.00 0.00 H new ATOM 0 HD2 LYS A 875 -13.920 -1.107 9.552 1.00 0.00 H new ATOM 0 HD3 LYS A 875 -12.249 -1.035 9.028 1.00 0.00 H new ATOM 0 HE2 LYS A 875 -12.729 1.204 9.482 1.00 0.00 H new ATOM 0 HE3 LYS A 875 -12.942 1.119 7.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 875 -15.058 1.706 7.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 875 -15.378 0.501 9.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 875 -14.775 2.010 9.588 1.00 0.00 H new ATOM 1373 N GLY A 876 -17.389 -0.672 5.012 1.00 0.00 N ATOM 1374 CA GLY A 876 -18.776 -0.376 4.719 1.00 0.00 C ATOM 1375 C GLY A 876 -19.334 -1.252 3.614 1.00 0.00 C ATOM 1376 O GLY A 876 -20.454 -1.743 3.716 1.00 0.00 O ATOM 0 H GLY A 876 -16.728 0.049 4.724 1.00 0.00 H new ATOM 0 HA2 GLY A 876 -19.372 -0.511 5.622 1.00 0.00 H new ATOM 0 HA3 GLY A 876 -18.868 0.671 4.430 1.00 0.00 H new ATOM 1380 N ALA A 877 -18.544 -1.452 2.562 1.00 0.00 N ATOM 1381 CA ALA A 877 -18.965 -2.258 1.419 1.00 0.00 C ATOM 1382 C ALA A 877 -19.134 -3.713 1.813 1.00 0.00 C ATOM 1383 O ALA A 877 -19.964 -4.429 1.259 1.00 0.00 O ATOM 1384 CB ALA A 877 -17.955 -2.136 0.288 1.00 0.00 C ATOM 0 H ALA A 877 -17.604 -1.065 2.477 1.00 0.00 H new ATOM 0 HA ALA A 877 -19.929 -1.883 1.076 1.00 0.00 H new ATOM 0 HB1 ALA A 877 -18.281 -2.742 -0.558 1.00 0.00 H new ATOM 0 HB2 ALA A 877 -17.878 -1.093 -0.020 1.00 0.00 H new ATOM 0 HB3 ALA A 877 -16.981 -2.485 0.631 1.00 0.00 H new ATOM 1390 N ALA A 878 -18.332 -4.144 2.765 1.00 0.00 N ATOM 1391 CA ALA A 878 -18.420 -5.494 3.269 1.00 0.00 C ATOM 1392 C ALA A 878 -19.687 -5.677 4.091 1.00 0.00 C ATOM 1393 O ALA A 878 -20.537 -6.508 3.770 1.00 0.00 O ATOM 1394 CB ALA A 878 -17.195 -5.816 4.104 1.00 0.00 C ATOM 0 H ALA A 878 -17.610 -3.574 3.205 1.00 0.00 H new ATOM 0 HA ALA A 878 -18.461 -6.181 2.424 1.00 0.00 H new ATOM 0 HB1 ALA A 878 -17.269 -6.836 4.480 1.00 0.00 H new ATOM 0 HB2 ALA A 878 -16.300 -5.720 3.489 1.00 0.00 H new ATOM 0 HB3 ALA A 878 -17.134 -5.123 4.943 1.00 0.00 H new ATOM 1400 N ALA A 879 -19.817 -4.879 5.143 1.00 0.00 N ATOM 1401 CA ALA A 879 -20.927 -5.018 6.074 1.00 0.00 C ATOM 1402 C ALA A 879 -22.253 -4.633 5.428 1.00 0.00 C ATOM 1403 O ALA A 879 -23.306 -5.143 5.811 1.00 0.00 O ATOM 1404 CB ALA A 879 -20.665 -4.197 7.322 1.00 0.00 C ATOM 0 H ALA A 879 -19.166 -4.128 5.372 1.00 0.00 H new ATOM 0 HA ALA A 879 -21.004 -6.068 6.358 1.00 0.00 H new ATOM 0 HB1 ALA A 879 -21.501 -4.308 8.012 1.00 0.00 H new ATOM 0 HB2 ALA A 879 -19.750 -4.545 7.801 1.00 0.00 H new ATOM 0 HB3 ALA A 879 -20.555 -3.147 7.050 1.00 0.00 H new ATOM 1410 N HIS A 880 -22.204 -3.735 4.451 1.00 0.00 N ATOM 1411 CA HIS A 880 -23.382 -3.403 3.655 1.00 0.00 C ATOM 1412 C HIS A 880 -23.247 -4.055 2.285 1.00 0.00 C ATOM 1413 O HIS A 880 -22.753 -3.439 1.342 1.00 0.00 O ATOM 1414 CB HIS A 880 -23.553 -1.884 3.504 1.00 0.00 C ATOM 1415 CG HIS A 880 -23.892 -1.169 4.781 1.00 0.00 C ATOM 1416 ND1 HIS A 880 -24.508 0.064 4.812 1.00 0.00 N ATOM 1417 CD2 HIS A 880 -23.687 -1.510 6.076 1.00 0.00 C ATOM 1418 CE1 HIS A 880 -24.666 0.445 6.065 1.00 0.00 C ATOM 1419 NE2 HIS A 880 -24.177 -0.491 6.852 1.00 0.00 N ATOM 0 H HIS A 880 -21.361 -3.223 4.190 1.00 0.00 H new ATOM 0 HA HIS A 880 -24.268 -3.780 4.166 1.00 0.00 H new ATOM 0 HB2 HIS A 880 -22.631 -1.465 3.101 1.00 0.00 H new ATOM 0 HB3 HIS A 880 -24.338 -1.690 2.773 1.00 0.00 H new ATOM 0 HD2 HIS A 880 -23.223 -2.418 6.432 1.00 0.00 H new ATOM 0 HE1 HIS A 880 -25.120 1.369 6.391 1.00 0.00 H new ATOM 0 HE2 HIS A 880 -24.165 -0.463 7.872 1.00 0.00 H new ATOM 1427 N PRO A 881 -23.695 -5.315 2.165 1.00 0.00 N ATOM 1428 CA PRO A 881 -23.383 -6.171 1.013 1.00 0.00 C ATOM 1429 C PRO A 881 -23.905 -5.613 -0.311 1.00 0.00 C ATOM 1430 O PRO A 881 -23.151 -5.445 -1.273 1.00 0.00 O ATOM 1431 CB PRO A 881 -24.089 -7.493 1.335 1.00 0.00 C ATOM 1432 CG PRO A 881 -24.366 -7.446 2.797 1.00 0.00 C ATOM 1433 CD PRO A 881 -24.570 -6.001 3.129 1.00 0.00 C ATOM 0 HA PRO A 881 -22.305 -6.262 0.877 1.00 0.00 H new ATOM 0 HB2 PRO A 881 -25.011 -7.595 0.763 1.00 0.00 H new ATOM 0 HB3 PRO A 881 -23.460 -8.346 1.081 1.00 0.00 H new ATOM 0 HG2 PRO A 881 -25.250 -8.033 3.046 1.00 0.00 H new ATOM 0 HG3 PRO A 881 -23.535 -7.864 3.366 1.00 0.00 H new ATOM 0 HD2 PRO A 881 -25.612 -5.703 3.012 1.00 0.00 H new ATOM 0 HD3 PRO A 881 -24.289 -5.779 4.159 1.00 0.00 H new ATOM 1441 N ASP A 882 -25.205 -5.327 -0.350 1.00 0.00 N ATOM 1442 CA ASP A 882 -25.868 -4.915 -1.587 1.00 0.00 C ATOM 1443 C ASP A 882 -25.550 -3.470 -1.950 1.00 0.00 C ATOM 1444 O ASP A 882 -25.747 -3.065 -3.098 1.00 0.00 O ATOM 1445 CB ASP A 882 -27.390 -5.079 -1.472 1.00 0.00 C ATOM 1446 CG ASP A 882 -28.059 -3.918 -0.752 1.00 0.00 C ATOM 1447 OD1 ASP A 882 -28.438 -2.934 -1.425 1.00 0.00 O ATOM 1448 OD2 ASP A 882 -28.198 -3.979 0.490 1.00 0.00 O ATOM 0 H ASP A 882 -25.821 -5.373 0.461 1.00 0.00 H new ATOM 0 HA ASP A 882 -25.487 -5.563 -2.376 1.00 0.00 H new ATOM 0 HB2 ASP A 882 -27.816 -5.174 -2.471 1.00 0.00 H new ATOM 0 HB3 ASP A 882 -27.611 -6.005 -0.941 1.00 0.00 H new ATOM 1453 N SER A 883 -25.058 -2.706 -0.980 1.00 0.00 N ATOM 1454 CA SER A 883 -24.884 -1.268 -1.143 1.00 0.00 C ATOM 1455 C SER A 883 -23.980 -0.940 -2.327 1.00 0.00 C ATOM 1456 O SER A 883 -22.755 -1.057 -2.245 1.00 0.00 O ATOM 1457 CB SER A 883 -24.317 -0.648 0.132 1.00 0.00 C ATOM 1458 OG SER A 883 -24.233 0.764 0.016 1.00 0.00 O ATOM 0 H SER A 883 -24.771 -3.062 -0.068 1.00 0.00 H new ATOM 0 HA SER A 883 -25.868 -0.842 -1.342 1.00 0.00 H new ATOM 0 HB2 SER A 883 -24.949 -0.910 0.980 1.00 0.00 H new ATOM 0 HB3 SER A 883 -23.328 -1.060 0.332 1.00 0.00 H new ATOM 0 HG SER A 883 -24.406 1.175 0.889 1.00 0.00 H new ATOM 1464 N GLU A 884 -24.601 -0.527 -3.425 1.00 0.00 N ATOM 1465 CA GLU A 884 -23.877 -0.188 -4.641 1.00 0.00 C ATOM 1466 C GLU A 884 -22.978 1.023 -4.425 1.00 0.00 C ATOM 1467 O GLU A 884 -21.926 1.142 -5.050 1.00 0.00 O ATOM 1468 CB GLU A 884 -24.855 0.075 -5.788 1.00 0.00 C ATOM 1469 CG GLU A 884 -25.884 1.150 -5.485 1.00 0.00 C ATOM 1470 CD GLU A 884 -26.824 1.381 -6.643 1.00 0.00 C ATOM 1471 OE1 GLU A 884 -26.487 2.182 -7.539 1.00 0.00 O ATOM 1472 OE2 GLU A 884 -27.909 0.770 -6.661 1.00 0.00 O ATOM 0 H GLU A 884 -25.613 -0.419 -3.497 1.00 0.00 H new ATOM 0 HA GLU A 884 -23.245 -1.036 -4.904 1.00 0.00 H new ATOM 0 HB2 GLU A 884 -24.291 0.365 -6.674 1.00 0.00 H new ATOM 0 HB3 GLU A 884 -25.374 -0.853 -6.030 1.00 0.00 H new ATOM 0 HG2 GLU A 884 -26.459 0.863 -4.604 1.00 0.00 H new ATOM 0 HG3 GLU A 884 -25.373 2.082 -5.242 1.00 0.00 H new ATOM 1479 N GLU A 885 -23.395 1.917 -3.535 1.00 0.00 N ATOM 1480 CA GLU A 885 -22.592 3.081 -3.197 1.00 0.00 C ATOM 1481 C GLU A 885 -21.300 2.648 -2.520 1.00 0.00 C ATOM 1482 O GLU A 885 -20.211 3.066 -2.912 1.00 0.00 O ATOM 1483 CB GLU A 885 -23.366 4.030 -2.281 1.00 0.00 C ATOM 1484 CG GLU A 885 -22.525 5.191 -1.776 1.00 0.00 C ATOM 1485 CD GLU A 885 -23.308 6.154 -0.918 1.00 0.00 C ATOM 1486 OE1 GLU A 885 -23.691 5.771 0.204 1.00 0.00 O ATOM 1487 OE2 GLU A 885 -23.552 7.298 -1.362 1.00 0.00 O ATOM 0 H GLU A 885 -24.283 1.856 -3.037 1.00 0.00 H new ATOM 0 HA GLU A 885 -22.354 3.610 -4.120 1.00 0.00 H new ATOM 0 HB2 GLU A 885 -24.229 4.422 -2.820 1.00 0.00 H new ATOM 0 HB3 GLU A 885 -23.750 3.470 -1.429 1.00 0.00 H new ATOM 0 HG2 GLU A 885 -21.685 4.801 -1.202 1.00 0.00 H new ATOM 0 HG3 GLU A 885 -22.107 5.728 -2.628 1.00 0.00 H new ATOM 1494 N GLN A 886 -21.431 1.797 -1.508 1.00 0.00 N ATOM 1495 CA GLN A 886 -20.278 1.288 -0.784 1.00 0.00 C ATOM 1496 C GLN A 886 -19.321 0.572 -1.727 1.00 0.00 C ATOM 1497 O GLN A 886 -18.109 0.775 -1.664 1.00 0.00 O ATOM 1498 CB GLN A 886 -20.718 0.343 0.332 1.00 0.00 C ATOM 1499 CG GLN A 886 -21.457 1.032 1.464 1.00 0.00 C ATOM 1500 CD GLN A 886 -20.593 2.031 2.206 1.00 0.00 C ATOM 1501 OE1 GLN A 886 -21.089 3.026 2.731 1.00 0.00 O ATOM 1502 NE2 GLN A 886 -19.294 1.777 2.255 1.00 0.00 N ATOM 0 H GLN A 886 -22.328 1.446 -1.172 1.00 0.00 H new ATOM 0 HA GLN A 886 -19.758 2.137 -0.340 1.00 0.00 H new ATOM 0 HB2 GLN A 886 -21.360 -0.429 -0.091 1.00 0.00 H new ATOM 0 HB3 GLN A 886 -19.840 -0.159 0.737 1.00 0.00 H new ATOM 0 HG2 GLN A 886 -22.332 1.543 1.063 1.00 0.00 H new ATOM 0 HG3 GLN A 886 -21.820 0.281 2.165 1.00 0.00 H new ATOM 0 HE21 GLN A 886 -18.921 0.940 1.807 1.00 0.00 H new ATOM 0 HE22 GLN A 886 -18.667 2.418 2.741 1.00 0.00 H new ATOM 1511 N GLN A 887 -19.877 -0.250 -2.609 1.00 0.00 N ATOM 1512 CA GLN A 887 -19.074 -0.971 -3.586 1.00 0.00 C ATOM 1513 C GLN A 887 -18.370 0.006 -4.519 1.00 0.00 C ATOM 1514 O GLN A 887 -17.168 -0.102 -4.749 1.00 0.00 O ATOM 1515 CB GLN A 887 -19.940 -1.939 -4.399 1.00 0.00 C ATOM 1516 CG GLN A 887 -20.712 -2.943 -3.555 1.00 0.00 C ATOM 1517 CD GLN A 887 -19.826 -3.743 -2.617 1.00 0.00 C ATOM 1518 OE1 GLN A 887 -18.655 -3.991 -2.901 1.00 0.00 O ATOM 1519 NE2 GLN A 887 -20.386 -4.151 -1.489 1.00 0.00 N ATOM 0 H GLN A 887 -20.879 -0.433 -2.667 1.00 0.00 H new ATOM 0 HA GLN A 887 -18.324 -1.549 -3.046 1.00 0.00 H new ATOM 0 HB2 GLN A 887 -20.647 -1.363 -4.996 1.00 0.00 H new ATOM 0 HB3 GLN A 887 -19.302 -2.482 -5.097 1.00 0.00 H new ATOM 0 HG2 GLN A 887 -21.464 -2.414 -2.970 1.00 0.00 H new ATOM 0 HG3 GLN A 887 -21.245 -3.629 -4.214 1.00 0.00 H new ATOM 0 HE21 GLN A 887 -21.361 -3.924 -1.292 1.00 0.00 H new ATOM 0 HE22 GLN A 887 -19.843 -4.693 -0.817 1.00 0.00 H new ATOM 1528 N GLN A 888 -19.122 0.976 -5.035 1.00 0.00 N ATOM 1529 CA GLN A 888 -18.578 1.972 -5.954 1.00 0.00 C ATOM 1530 C GLN A 888 -17.444 2.761 -5.304 1.00 0.00 C ATOM 1531 O GLN A 888 -16.414 3.014 -5.932 1.00 0.00 O ATOM 1532 CB GLN A 888 -19.677 2.923 -6.429 1.00 0.00 C ATOM 1533 CG GLN A 888 -19.183 3.973 -7.409 1.00 0.00 C ATOM 1534 CD GLN A 888 -18.491 3.368 -8.615 1.00 0.00 C ATOM 1535 OE1 GLN A 888 -18.813 2.257 -9.043 1.00 0.00 O ATOM 1536 NE2 GLN A 888 -17.537 4.092 -9.170 1.00 0.00 N ATOM 0 H GLN A 888 -20.114 1.093 -4.831 1.00 0.00 H new ATOM 0 HA GLN A 888 -18.174 1.443 -6.817 1.00 0.00 H new ATOM 0 HB2 GLN A 888 -20.471 2.343 -6.899 1.00 0.00 H new ATOM 0 HB3 GLN A 888 -20.115 3.421 -5.564 1.00 0.00 H new ATOM 0 HG2 GLN A 888 -20.026 4.577 -7.744 1.00 0.00 H new ATOM 0 HG3 GLN A 888 -18.493 4.645 -6.898 1.00 0.00 H new ATOM 0 HE21 GLN A 888 -17.301 5.007 -8.785 1.00 0.00 H new ATOM 0 HE22 GLN A 888 -17.036 3.737 -9.984 1.00 0.00 H new ATOM 1545 N ARG A 889 -17.638 3.142 -4.047 1.00 0.00 N ATOM 1546 CA ARG A 889 -16.606 3.847 -3.301 1.00 0.00 C ATOM 1547 C ARG A 889 -15.346 2.995 -3.201 1.00 0.00 C ATOM 1548 O ARG A 889 -14.238 3.477 -3.439 1.00 0.00 O ATOM 1549 CB ARG A 889 -17.105 4.222 -1.904 1.00 0.00 C ATOM 1550 CG ARG A 889 -18.169 5.307 -1.909 1.00 0.00 C ATOM 1551 CD ARG A 889 -18.631 5.638 -0.501 1.00 0.00 C ATOM 1552 NE ARG A 889 -17.521 6.065 0.352 1.00 0.00 N ATOM 1553 CZ ARG A 889 -17.499 5.919 1.676 1.00 0.00 C ATOM 1554 NH1 ARG A 889 -18.544 5.399 2.307 1.00 0.00 N ATOM 1555 NH2 ARG A 889 -16.442 6.316 2.369 1.00 0.00 N ATOM 0 H ARG A 889 -18.498 2.975 -3.525 1.00 0.00 H new ATOM 0 HA ARG A 889 -16.366 4.765 -3.837 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -17.508 3.332 -1.420 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -16.259 4.557 -1.303 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -17.773 6.205 -2.384 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -19.021 4.980 -2.505 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -19.382 6.427 -0.542 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -19.111 4.764 -0.062 1.00 0.00 H new ATOM 0 HE ARG A 889 -16.715 6.501 -0.095 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -19.367 5.110 1.778 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -18.524 5.288 3.321 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -15.645 6.734 1.889 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -16.425 6.204 3.383 1.00 0.00 H new ATOM 1569 N LEU A 890 -15.534 1.722 -2.885 1.00 0.00 N ATOM 1570 CA LEU A 890 -14.423 0.792 -2.737 1.00 0.00 C ATOM 1571 C LEU A 890 -13.704 0.564 -4.065 1.00 0.00 C ATOM 1572 O LEU A 890 -12.478 0.504 -4.102 1.00 0.00 O ATOM 1573 CB LEU A 890 -14.928 -0.539 -2.178 1.00 0.00 C ATOM 1574 CG LEU A 890 -13.867 -1.629 -2.016 1.00 0.00 C ATOM 1575 CD1 LEU A 890 -12.755 -1.166 -1.085 1.00 0.00 C ATOM 1576 CD2 LEU A 890 -14.508 -2.901 -1.493 1.00 0.00 C ATOM 0 H LEU A 890 -16.452 1.307 -2.725 1.00 0.00 H new ATOM 0 HA LEU A 890 -13.708 1.230 -2.041 1.00 0.00 H new ATOM 0 HB2 LEU A 890 -15.386 -0.355 -1.206 1.00 0.00 H new ATOM 0 HB3 LEU A 890 -15.713 -0.915 -2.834 1.00 0.00 H new ATOM 0 HG LEU A 890 -13.425 -1.834 -2.991 1.00 0.00 H new ATOM 0 HD11 LEU A 890 -12.012 -1.957 -0.984 1.00 0.00 H new ATOM 0 HD12 LEU A 890 -12.283 -0.274 -1.498 1.00 0.00 H new ATOM 0 HD13 LEU A 890 -13.173 -0.935 -0.105 1.00 0.00 H new ATOM 0 HD21 LEU A 890 -13.746 -3.673 -1.380 1.00 0.00 H new ATOM 0 HD22 LEU A 890 -14.971 -2.704 -0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 890 -15.268 -3.241 -2.196 1.00 0.00 H new ATOM 1588 N ARG A 891 -14.468 0.446 -5.146 1.00 0.00 N ATOM 1589 CA ARG A 891 -13.906 0.186 -6.473 1.00 0.00 C ATOM 1590 C ARG A 891 -12.821 1.198 -6.831 1.00 0.00 C ATOM 1591 O ARG A 891 -11.727 0.824 -7.255 1.00 0.00 O ATOM 1592 CB ARG A 891 -15.008 0.213 -7.538 1.00 0.00 C ATOM 1593 CG ARG A 891 -16.020 -0.911 -7.401 1.00 0.00 C ATOM 1594 CD ARG A 891 -17.178 -0.742 -8.371 1.00 0.00 C ATOM 1595 NE ARG A 891 -18.240 -1.714 -8.125 1.00 0.00 N ATOM 1596 CZ ARG A 891 -19.541 -1.423 -8.140 1.00 0.00 C ATOM 1597 NH1 ARG A 891 -19.950 -0.189 -8.416 1.00 0.00 N ATOM 1598 NH2 ARG A 891 -20.431 -2.370 -7.876 1.00 0.00 N ATOM 0 H ARG A 891 -15.485 0.526 -5.132 1.00 0.00 H new ATOM 0 HA ARG A 891 -13.453 -0.805 -6.446 1.00 0.00 H new ATOM 0 HB2 ARG A 891 -15.530 1.168 -7.483 1.00 0.00 H new ATOM 0 HB3 ARG A 891 -14.548 0.157 -8.525 1.00 0.00 H new ATOM 0 HG2 ARG A 891 -15.529 -1.867 -7.582 1.00 0.00 H new ATOM 0 HG3 ARG A 891 -16.401 -0.936 -6.380 1.00 0.00 H new ATOM 0 HD2 ARG A 891 -17.581 0.267 -8.283 1.00 0.00 H new ATOM 0 HD3 ARG A 891 -16.815 -0.852 -9.393 1.00 0.00 H new ATOM 0 HE ARG A 891 -17.969 -2.678 -7.929 1.00 0.00 H new ATOM 0 HH11 ARG A 891 -19.267 0.541 -8.618 1.00 0.00 H new ATOM 0 HH12 ARG A 891 -20.947 0.028 -8.426 1.00 0.00 H new ATOM 0 HH21 ARG A 891 -20.119 -3.317 -7.662 1.00 0.00 H new ATOM 0 HH22 ARG A 891 -21.427 -2.151 -7.887 1.00 0.00 H new ATOM 1612 N GLU A 892 -13.119 2.477 -6.652 1.00 0.00 N ATOM 1613 CA GLU A 892 -12.171 3.527 -6.997 1.00 0.00 C ATOM 1614 C GLU A 892 -11.120 3.699 -5.904 1.00 0.00 C ATOM 1615 O GLU A 892 -9.969 4.040 -6.185 1.00 0.00 O ATOM 1616 CB GLU A 892 -12.898 4.847 -7.244 1.00 0.00 C ATOM 1617 CG GLU A 892 -13.995 4.745 -8.293 1.00 0.00 C ATOM 1618 CD GLU A 892 -14.635 6.082 -8.603 1.00 0.00 C ATOM 1619 OE1 GLU A 892 -15.069 6.774 -7.661 1.00 0.00 O ATOM 1620 OE2 GLU A 892 -14.723 6.442 -9.796 1.00 0.00 O ATOM 0 H GLU A 892 -14.004 2.812 -6.272 1.00 0.00 H new ATOM 0 HA GLU A 892 -11.663 3.230 -7.914 1.00 0.00 H new ATOM 0 HB2 GLU A 892 -13.333 5.195 -6.307 1.00 0.00 H new ATOM 0 HB3 GLU A 892 -12.174 5.599 -7.558 1.00 0.00 H new ATOM 0 HG2 GLU A 892 -13.578 4.326 -9.209 1.00 0.00 H new ATOM 0 HG3 GLU A 892 -14.761 4.052 -7.945 1.00 0.00 H new ATOM 1627 N ALA A 893 -11.520 3.458 -4.660 1.00 0.00 N ATOM 1628 CA ALA A 893 -10.617 3.602 -3.524 1.00 0.00 C ATOM 1629 C ALA A 893 -9.520 2.545 -3.556 1.00 0.00 C ATOM 1630 O ALA A 893 -8.350 2.852 -3.336 1.00 0.00 O ATOM 1631 CB ALA A 893 -11.387 3.525 -2.214 1.00 0.00 C ATOM 0 H ALA A 893 -12.464 3.162 -4.413 1.00 0.00 H new ATOM 0 HA ALA A 893 -10.146 4.582 -3.595 1.00 0.00 H new ATOM 0 HB1 ALA A 893 -10.696 3.635 -1.379 1.00 0.00 H new ATOM 0 HB2 ALA A 893 -12.127 4.324 -2.180 1.00 0.00 H new ATOM 0 HB3 ALA A 893 -11.891 2.561 -2.144 1.00 0.00 H new ATOM 1637 N ALA A 894 -9.902 1.308 -3.845 1.00 0.00 N ATOM 1638 CA ALA A 894 -8.953 0.204 -3.894 1.00 0.00 C ATOM 1639 C ALA A 894 -7.931 0.409 -5.003 1.00 0.00 C ATOM 1640 O ALA A 894 -6.745 0.137 -4.824 1.00 0.00 O ATOM 1641 CB ALA A 894 -9.682 -1.116 -4.083 1.00 0.00 C ATOM 0 H ALA A 894 -10.866 1.044 -4.050 1.00 0.00 H new ATOM 0 HA ALA A 894 -8.420 0.176 -2.944 1.00 0.00 H new ATOM 0 HB1 ALA A 894 -8.958 -1.930 -4.117 1.00 0.00 H new ATOM 0 HB2 ALA A 894 -10.368 -1.275 -3.251 1.00 0.00 H new ATOM 0 HB3 ALA A 894 -10.244 -1.091 -5.017 1.00 0.00 H new ATOM 1647 N GLU A 895 -8.393 0.901 -6.144 1.00 0.00 N ATOM 1648 CA GLU A 895 -7.499 1.188 -7.255 1.00 0.00 C ATOM 1649 C GLU A 895 -6.577 2.349 -6.913 1.00 0.00 C ATOM 1650 O GLU A 895 -5.407 2.354 -7.293 1.00 0.00 O ATOM 1651 CB GLU A 895 -8.294 1.489 -8.524 1.00 0.00 C ATOM 1652 CG GLU A 895 -8.969 0.261 -9.103 1.00 0.00 C ATOM 1653 CD GLU A 895 -7.978 -0.842 -9.419 1.00 0.00 C ATOM 1654 OE1 GLU A 895 -7.393 -0.832 -10.516 1.00 0.00 O ATOM 1655 OE2 GLU A 895 -7.778 -1.729 -8.564 1.00 0.00 O ATOM 0 H GLU A 895 -9.375 1.108 -6.323 1.00 0.00 H new ATOM 0 HA GLU A 895 -6.887 0.305 -7.438 1.00 0.00 H new ATOM 0 HB2 GLU A 895 -9.050 2.243 -8.303 1.00 0.00 H new ATOM 0 HB3 GLU A 895 -7.626 1.917 -9.272 1.00 0.00 H new ATOM 0 HG2 GLU A 895 -9.711 -0.111 -8.396 1.00 0.00 H new ATOM 0 HG3 GLU A 895 -9.505 0.537 -10.011 1.00 0.00 H new ATOM 1662 N GLY A 896 -7.105 3.320 -6.179 1.00 0.00 N ATOM 1663 CA GLY A 896 -6.289 4.425 -5.716 1.00 0.00 C ATOM 1664 C GLY A 896 -5.237 3.957 -4.732 1.00 0.00 C ATOM 1665 O GLY A 896 -4.085 4.376 -4.798 1.00 0.00 O ATOM 0 H GLY A 896 -8.084 3.362 -5.896 1.00 0.00 H new ATOM 0 HA2 GLY A 896 -5.806 4.905 -6.567 1.00 0.00 H new ATOM 0 HA3 GLY A 896 -6.923 5.176 -5.244 1.00 0.00 H new ATOM 1669 N LEU A 897 -5.642 3.071 -3.834 1.00 0.00 N ATOM 1670 CA LEU A 897 -4.739 2.488 -2.850 1.00 0.00 C ATOM 1671 C LEU A 897 -3.658 1.660 -3.541 1.00 0.00 C ATOM 1672 O LEU A 897 -2.466 1.825 -3.268 1.00 0.00 O ATOM 1673 CB LEU A 897 -5.548 1.635 -1.855 1.00 0.00 C ATOM 1674 CG LEU A 897 -4.765 0.981 -0.704 1.00 0.00 C ATOM 1675 CD1 LEU A 897 -4.187 -0.361 -1.122 1.00 0.00 C ATOM 1676 CD2 LEU A 897 -3.659 1.900 -0.214 1.00 0.00 C ATOM 0 H LEU A 897 -6.603 2.736 -3.766 1.00 0.00 H new ATOM 0 HA LEU A 897 -4.239 3.284 -2.299 1.00 0.00 H new ATOM 0 HB2 LEU A 897 -6.326 2.264 -1.422 1.00 0.00 H new ATOM 0 HB3 LEU A 897 -6.051 0.846 -2.415 1.00 0.00 H new ATOM 0 HG LEU A 897 -5.465 0.809 0.114 1.00 0.00 H new ATOM 0 HD11 LEU A 897 -3.640 -0.797 -0.287 1.00 0.00 H new ATOM 0 HD12 LEU A 897 -4.996 -1.030 -1.415 1.00 0.00 H new ATOM 0 HD13 LEU A 897 -3.510 -0.219 -1.965 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -3.119 1.417 0.600 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -2.971 2.109 -1.033 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -4.093 2.834 0.143 1.00 0.00 H new ATOM 1688 N ARG A 898 -4.077 0.780 -4.441 1.00 0.00 N ATOM 1689 CA ARG A 898 -3.146 -0.071 -5.167 1.00 0.00 C ATOM 1690 C ARG A 898 -2.178 0.771 -5.989 1.00 0.00 C ATOM 1691 O ARG A 898 -0.980 0.494 -6.025 1.00 0.00 O ATOM 1692 CB ARG A 898 -3.903 -1.053 -6.065 1.00 0.00 C ATOM 1693 CG ARG A 898 -2.997 -2.048 -6.777 1.00 0.00 C ATOM 1694 CD ARG A 898 -3.783 -3.212 -7.363 1.00 0.00 C ATOM 1695 NE ARG A 898 -4.730 -2.800 -8.400 1.00 0.00 N ATOM 1696 CZ ARG A 898 -4.872 -3.431 -9.568 1.00 0.00 C ATOM 1697 NH1 ARG A 898 -4.112 -4.481 -9.865 1.00 0.00 N ATOM 1698 NH2 ARG A 898 -5.780 -3.019 -10.441 1.00 0.00 N ATOM 0 H ARG A 898 -5.057 0.637 -4.685 1.00 0.00 H new ATOM 0 HA ARG A 898 -2.569 -0.645 -4.442 1.00 0.00 H new ATOM 0 HB2 ARG A 898 -4.627 -1.600 -5.462 1.00 0.00 H new ATOM 0 HB3 ARG A 898 -4.468 -0.491 -6.809 1.00 0.00 H new ATOM 0 HG2 ARG A 898 -2.454 -1.539 -7.573 1.00 0.00 H new ATOM 0 HG3 ARG A 898 -2.254 -2.428 -6.076 1.00 0.00 H new ATOM 0 HD2 ARG A 898 -3.087 -3.938 -7.783 1.00 0.00 H new ATOM 0 HD3 ARG A 898 -4.326 -3.716 -6.563 1.00 0.00 H new ATOM 0 HE ARG A 898 -5.315 -1.984 -8.220 1.00 0.00 H new ATOM 0 HH11 ARG A 898 -3.414 -4.810 -9.198 1.00 0.00 H new ATOM 0 HH12 ARG A 898 -4.227 -4.957 -10.760 1.00 0.00 H new ATOM 0 HH21 ARG A 898 -6.372 -2.218 -10.221 1.00 0.00 H new ATOM 0 HH22 ARG A 898 -5.887 -3.503 -11.333 1.00 0.00 H new ATOM 1712 N MET A 899 -2.700 1.814 -6.622 1.00 0.00 N ATOM 1713 CA MET A 899 -1.880 2.715 -7.424 1.00 0.00 C ATOM 1714 C MET A 899 -0.913 3.506 -6.544 1.00 0.00 C ATOM 1715 O MET A 899 0.255 3.663 -6.889 1.00 0.00 O ATOM 1716 CB MET A 899 -2.768 3.670 -8.225 1.00 0.00 C ATOM 1717 CG MET A 899 -1.997 4.611 -9.138 1.00 0.00 C ATOM 1718 SD MET A 899 -3.081 5.668 -10.119 1.00 0.00 S ATOM 1719 CE MET A 899 -3.959 4.445 -11.092 1.00 0.00 C ATOM 0 H MET A 899 -3.690 2.058 -6.596 1.00 0.00 H new ATOM 0 HA MET A 899 -1.293 2.112 -8.117 1.00 0.00 H new ATOM 0 HB2 MET A 899 -3.463 3.085 -8.827 1.00 0.00 H new ATOM 0 HB3 MET A 899 -3.366 4.262 -7.532 1.00 0.00 H new ATOM 0 HG2 MET A 899 -1.335 5.234 -8.536 1.00 0.00 H new ATOM 0 HG3 MET A 899 -1.364 4.026 -9.806 1.00 0.00 H new ATOM 0 HE1 MET A 899 -4.360 4.914 -11.990 1.00 0.00 H new ATOM 0 HE2 MET A 899 -3.274 3.645 -11.375 1.00 0.00 H new ATOM 0 HE3 MET A 899 -4.777 4.031 -10.503 1.00 0.00 H new ATOM 1729 N ALA A 900 -1.403 3.991 -5.405 1.00 0.00 N ATOM 1730 CA ALA A 900 -0.570 4.744 -4.469 1.00 0.00 C ATOM 1731 C ALA A 900 0.557 3.872 -3.928 1.00 0.00 C ATOM 1732 O ALA A 900 1.703 4.311 -3.822 1.00 0.00 O ATOM 1733 CB ALA A 900 -1.413 5.290 -3.327 1.00 0.00 C ATOM 0 H ALA A 900 -2.372 3.876 -5.108 1.00 0.00 H new ATOM 0 HA ALA A 900 -0.127 5.583 -5.005 1.00 0.00 H new ATOM 0 HB1 ALA A 900 -0.777 5.848 -2.640 1.00 0.00 H new ATOM 0 HB2 ALA A 900 -2.183 5.951 -3.726 1.00 0.00 H new ATOM 0 HB3 ALA A 900 -1.884 4.463 -2.795 1.00 0.00 H new ATOM 1739 N THR A 901 0.226 2.634 -3.594 1.00 0.00 N ATOM 1740 CA THR A 901 1.220 1.685 -3.122 1.00 0.00 C ATOM 1741 C THR A 901 2.191 1.336 -4.241 1.00 0.00 C ATOM 1742 O THR A 901 3.400 1.248 -4.032 1.00 0.00 O ATOM 1743 CB THR A 901 0.560 0.398 -2.609 1.00 0.00 C ATOM 1744 OG1 THR A 901 -0.426 0.720 -1.623 1.00 0.00 O ATOM 1745 CG2 THR A 901 1.601 -0.538 -2.014 1.00 0.00 C ATOM 0 H THR A 901 -0.723 2.264 -3.641 1.00 0.00 H new ATOM 0 HA THR A 901 1.760 2.155 -2.300 1.00 0.00 H new ATOM 0 HB THR A 901 0.081 -0.106 -3.448 1.00 0.00 H new ATOM 0 HG1 THR A 901 -1.200 1.136 -2.058 1.00 0.00 H new ATOM 0 HG21 THR A 901 1.113 -1.445 -1.656 1.00 0.00 H new ATOM 0 HG22 THR A 901 2.335 -0.798 -2.777 1.00 0.00 H new ATOM 0 HG23 THR A 901 2.102 -0.043 -1.182 1.00 0.00 H new ATOM 1753 N ASN A 902 1.647 1.153 -5.437 1.00 0.00 N ATOM 1754 CA ASN A 902 2.451 0.861 -6.607 1.00 0.00 C ATOM 1755 C ASN A 902 3.421 2.016 -6.877 1.00 0.00 C ATOM 1756 O ASN A 902 4.538 1.813 -7.353 1.00 0.00 O ATOM 1757 CB ASN A 902 1.555 0.632 -7.828 1.00 0.00 C ATOM 1758 CG ASN A 902 2.339 0.202 -9.052 1.00 0.00 C ATOM 1759 OD1 ASN A 902 2.780 1.031 -9.850 1.00 0.00 O ATOM 1760 ND2 ASN A 902 2.505 -1.101 -9.211 1.00 0.00 N ATOM 0 H ASN A 902 0.645 1.203 -5.618 1.00 0.00 H new ATOM 0 HA ASN A 902 3.023 -0.048 -6.420 1.00 0.00 H new ATOM 0 HB2 ASN A 902 0.811 -0.129 -7.591 1.00 0.00 H new ATOM 0 HB3 ASN A 902 1.011 1.550 -8.053 1.00 0.00 H new ATOM 0 HD21 ASN A 902 3.016 -1.455 -10.020 1.00 0.00 H new ATOM 0 HD22 ASN A 902 2.122 -1.751 -8.525 1.00 0.00 H new ATOM 1767 N ALA A 903 2.976 3.231 -6.560 1.00 0.00 N ATOM 1768 CA ALA A 903 3.814 4.418 -6.677 1.00 0.00 C ATOM 1769 C ALA A 903 4.974 4.356 -5.692 1.00 0.00 C ATOM 1770 O ALA A 903 6.112 4.649 -6.043 1.00 0.00 O ATOM 1771 CB ALA A 903 2.990 5.678 -6.455 1.00 0.00 C ATOM 0 H ALA A 903 2.033 3.417 -6.218 1.00 0.00 H new ATOM 0 HA ALA A 903 4.224 4.449 -7.686 1.00 0.00 H new ATOM 0 HB1 ALA A 903 3.633 6.554 -6.546 1.00 0.00 H new ATOM 0 HB2 ALA A 903 2.197 5.730 -7.201 1.00 0.00 H new ATOM 0 HB3 ALA A 903 2.549 5.654 -5.458 1.00 0.00 H new ATOM 1777 N ALA A 904 4.686 3.963 -4.458 1.00 0.00 N ATOM 1778 CA ALA A 904 5.737 3.769 -3.464 1.00 0.00 C ATOM 1779 C ALA A 904 6.708 2.686 -3.925 1.00 0.00 C ATOM 1780 O ALA A 904 7.906 2.751 -3.657 1.00 0.00 O ATOM 1781 CB ALA A 904 5.141 3.406 -2.114 1.00 0.00 C ATOM 0 H ALA A 904 3.742 3.773 -4.122 1.00 0.00 H new ATOM 0 HA ALA A 904 6.284 4.706 -3.355 1.00 0.00 H new ATOM 0 HB1 ALA A 904 5.942 3.266 -1.388 1.00 0.00 H new ATOM 0 HB2 ALA A 904 4.484 4.208 -1.779 1.00 0.00 H new ATOM 0 HB3 ALA A 904 4.569 2.483 -2.205 1.00 0.00 H new ATOM 1787 N ALA A 905 6.170 1.702 -4.637 1.00 0.00 N ATOM 1788 CA ALA A 905 6.963 0.609 -5.185 1.00 0.00 C ATOM 1789 C ALA A 905 7.963 1.117 -6.223 1.00 0.00 C ATOM 1790 O ALA A 905 9.139 0.755 -6.196 1.00 0.00 O ATOM 1791 CB ALA A 905 6.042 -0.439 -5.796 1.00 0.00 C ATOM 0 H ALA A 905 5.174 1.640 -4.850 1.00 0.00 H new ATOM 0 HA ALA A 905 7.532 0.155 -4.374 1.00 0.00 H new ATOM 0 HB1 ALA A 905 6.639 -1.254 -6.205 1.00 0.00 H new ATOM 0 HB2 ALA A 905 5.374 -0.828 -5.028 1.00 0.00 H new ATOM 0 HB3 ALA A 905 5.453 0.014 -6.593 1.00 0.00 H new ATOM 1797 N GLN A 906 7.493 1.967 -7.130 1.00 0.00 N ATOM 1798 CA GLN A 906 8.343 2.519 -8.182 1.00 0.00 C ATOM 1799 C GLN A 906 9.294 3.581 -7.627 1.00 0.00 C ATOM 1800 O GLN A 906 10.325 3.881 -8.226 1.00 0.00 O ATOM 1801 CB GLN A 906 7.496 3.091 -9.326 1.00 0.00 C ATOM 1802 CG GLN A 906 6.550 4.197 -8.900 1.00 0.00 C ATOM 1803 CD GLN A 906 5.574 4.601 -9.986 1.00 0.00 C ATOM 1804 OE1 GLN A 906 5.133 5.750 -10.043 1.00 0.00 O ATOM 1805 NE2 GLN A 906 5.221 3.661 -10.847 1.00 0.00 N ATOM 0 H GLN A 906 6.526 2.290 -7.159 1.00 0.00 H new ATOM 0 HA GLN A 906 8.948 1.705 -8.580 1.00 0.00 H new ATOM 0 HB2 GLN A 906 8.161 3.474 -10.100 1.00 0.00 H new ATOM 0 HB3 GLN A 906 6.917 2.284 -9.774 1.00 0.00 H new ATOM 0 HG2 GLN A 906 5.992 3.871 -8.022 1.00 0.00 H new ATOM 0 HG3 GLN A 906 7.132 5.069 -8.601 1.00 0.00 H new ATOM 0 HE21 GLN A 906 5.610 2.722 -10.764 1.00 0.00 H new ATOM 0 HE22 GLN A 906 4.560 3.875 -11.594 1.00 0.00 H new ATOM 1814 N ASN A 907 8.937 4.156 -6.483 1.00 0.00 N ATOM 1815 CA ASN A 907 9.782 5.157 -5.835 1.00 0.00 C ATOM 1816 C ASN A 907 10.958 4.508 -5.110 1.00 0.00 C ATOM 1817 O ASN A 907 11.846 5.200 -4.609 1.00 0.00 O ATOM 1818 CB ASN A 907 8.975 6.019 -4.860 1.00 0.00 C ATOM 1819 CG ASN A 907 8.049 6.985 -5.574 1.00 0.00 C ATOM 1820 OD1 ASN A 907 8.318 7.402 -6.701 1.00 0.00 O ATOM 1821 ND2 ASN A 907 6.958 7.354 -4.924 1.00 0.00 N ATOM 0 H ASN A 907 8.071 3.948 -5.986 1.00 0.00 H new ATOM 0 HA ASN A 907 10.176 5.801 -6.621 1.00 0.00 H new ATOM 0 HB2 ASN A 907 8.388 5.373 -4.207 1.00 0.00 H new ATOM 0 HB3 ASN A 907 9.659 6.579 -4.223 1.00 0.00 H new ATOM 0 HD21 ASN A 907 6.304 8.007 -5.355 1.00 0.00 H new ATOM 0 HD22 ASN A 907 6.771 6.986 -3.991 1.00 0.00 H new ATOM 1828 N ALA A 908 10.968 3.180 -5.064 1.00 0.00 N ATOM 1829 CA ALA A 908 12.075 2.432 -4.472 1.00 0.00 C ATOM 1830 C ALA A 908 13.253 2.356 -5.444 1.00 0.00 C ATOM 1831 O ALA A 908 13.896 1.314 -5.572 1.00 0.00 O ATOM 1832 CB ALA A 908 11.615 1.030 -4.091 1.00 0.00 C ATOM 0 H ALA A 908 10.218 2.595 -5.432 1.00 0.00 H new ATOM 0 HA ALA A 908 12.404 2.953 -3.573 1.00 0.00 H new ATOM 0 HB1 ALA A 908 12.447 0.481 -3.651 1.00 0.00 H new ATOM 0 HB2 ALA A 908 10.802 1.098 -3.368 1.00 0.00 H new ATOM 0 HB3 ALA A 908 11.266 0.507 -4.981 1.00 0.00 H new ATOM 1838 N ILE A 909 13.540 3.486 -6.089 1.00 0.00 N ATOM 1839 CA ILE A 909 14.546 3.574 -7.135 1.00 0.00 C ATOM 1840 C ILE A 909 14.304 2.517 -8.213 1.00 0.00 C ATOM 1841 O ILE A 909 14.894 1.433 -8.204 1.00 0.00 O ATOM 1842 CB ILE A 909 15.971 3.463 -6.561 1.00 0.00 C ATOM 1843 CG1 ILE A 909 16.218 4.584 -5.544 1.00 0.00 C ATOM 1844 CG2 ILE A 909 17.011 3.514 -7.675 1.00 0.00 C ATOM 1845 CD1 ILE A 909 17.580 4.521 -4.884 1.00 0.00 C ATOM 0 H ILE A 909 13.074 4.372 -5.895 1.00 0.00 H new ATOM 0 HA ILE A 909 14.457 4.557 -7.597 1.00 0.00 H new ATOM 0 HB ILE A 909 16.065 2.502 -6.055 1.00 0.00 H new ATOM 0 HG12 ILE A 909 16.111 5.546 -6.045 1.00 0.00 H new ATOM 0 HG13 ILE A 909 15.449 4.539 -4.773 1.00 0.00 H new ATOM 0 HG21 ILE A 909 18.009 3.434 -7.245 1.00 0.00 H new ATOM 0 HG22 ILE A 909 16.846 2.687 -8.365 1.00 0.00 H new ATOM 0 HG23 ILE A 909 16.922 4.458 -8.213 1.00 0.00 H new ATOM 0 HD11 ILE A 909 17.681 5.345 -4.178 1.00 0.00 H new ATOM 0 HD12 ILE A 909 17.684 3.574 -4.354 1.00 0.00 H new ATOM 0 HD13 ILE A 909 18.357 4.598 -5.645 1.00 0.00 H new ATOM 1857 N LYS A 910 13.392 2.833 -9.114 1.00 0.00 N ATOM 1858 CA LYS A 910 13.058 1.950 -10.217 1.00 0.00 C ATOM 1859 C LYS A 910 13.284 2.677 -11.530 1.00 0.00 C ATOM 1860 O LYS A 910 12.385 3.339 -12.046 1.00 0.00 O ATOM 1861 CB LYS A 910 11.602 1.485 -10.123 1.00 0.00 C ATOM 1862 CG LYS A 910 11.270 0.727 -8.848 1.00 0.00 C ATOM 1863 CD LYS A 910 11.953 -0.626 -8.800 1.00 0.00 C ATOM 1864 CE LYS A 910 11.600 -1.380 -7.530 1.00 0.00 C ATOM 1865 NZ LYS A 910 12.136 -2.764 -7.542 1.00 0.00 N ATOM 0 H LYS A 910 12.864 3.705 -9.102 1.00 0.00 H new ATOM 0 HA LYS A 910 13.700 1.070 -10.168 1.00 0.00 H new ATOM 0 HB2 LYS A 910 10.949 2.355 -10.195 1.00 0.00 H new ATOM 0 HB3 LYS A 910 11.380 0.848 -10.979 1.00 0.00 H new ATOM 0 HG2 LYS A 910 11.575 1.318 -7.984 1.00 0.00 H new ATOM 0 HG3 LYS A 910 10.191 0.592 -8.777 1.00 0.00 H new ATOM 0 HD2 LYS A 910 11.658 -1.215 -9.668 1.00 0.00 H new ATOM 0 HD3 LYS A 910 13.033 -0.492 -8.857 1.00 0.00 H new ATOM 0 HE2 LYS A 910 11.997 -0.844 -6.667 1.00 0.00 H new ATOM 0 HE3 LYS A 910 10.516 -1.411 -7.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 910 11.603 -3.349 -6.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 910 12.042 -3.165 -8.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 910 13.140 -2.750 -7.270 1.00 0.00 H new ATOM 1879 N LYS A 911 14.500 2.597 -12.036 1.00 0.00 N ATOM 1880 CA LYS A 911 14.864 3.275 -13.265 1.00 0.00 C ATOM 1881 C LYS A 911 15.713 2.358 -14.129 1.00 0.00 C ATOM 1882 O LYS A 911 16.924 2.237 -13.856 1.00 0.00 O ATOM 1883 CB LYS A 911 15.616 4.577 -12.958 1.00 0.00 C ATOM 1884 CG LYS A 911 14.739 5.652 -12.325 1.00 0.00 C ATOM 1885 CD LYS A 911 13.718 6.185 -13.318 1.00 0.00 C ATOM 1886 CE LYS A 911 12.671 7.060 -12.643 1.00 0.00 C ATOM 1887 NZ LYS A 911 11.737 6.266 -11.797 1.00 0.00 N ATOM 1888 OXT LYS A 911 15.154 1.735 -15.053 1.00 0.00 O ATOM 0 H LYS A 911 15.258 2.064 -11.610 1.00 0.00 H new ATOM 0 HA LYS A 911 13.955 3.529 -13.811 1.00 0.00 H new ATOM 0 HB2 LYS A 911 16.448 4.357 -12.289 1.00 0.00 H new ATOM 0 HB3 LYS A 911 16.044 4.966 -13.882 1.00 0.00 H new ATOM 0 HG2 LYS A 911 14.225 5.240 -11.456 1.00 0.00 H new ATOM 0 HG3 LYS A 911 15.364 6.470 -11.967 1.00 0.00 H new ATOM 0 HD2 LYS A 911 14.229 6.761 -14.090 1.00 0.00 H new ATOM 0 HD3 LYS A 911 13.226 5.350 -13.816 1.00 0.00 H new ATOM 0 HE2 LYS A 911 13.168 7.810 -12.028 1.00 0.00 H new ATOM 0 HE3 LYS A 911 12.103 7.597 -13.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 911 10.758 6.441 -12.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 911 11.955 5.254 -11.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 911 11.845 6.548 -10.802 1.00 0.00 H new TER 1902 LYS A 911