USER MOD reduce.3.24.130724 H: found=0, std=0, add=906, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 906 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 Single : A 678 LYS NZ :NH3+ -158:sc= 1.16 (180deg=0.844) USER MOD Single : A 688 GLN :FLIP amide:sc= -0.211 F(o=-2.6,f=-0.21) USER MOD Single : A 691 TYR OH : rot 180:sc= 0 USER MOD Single : A 698 GLN :FLIP amide:sc= -0.58 F(o=-1.7!,f=-0.58) USER MOD Single : A 699 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 702 MET CE :methyl -171:sc= -0.9 (180deg=-1.04) USER MOD Single : B 1 MET CE :methyl -164:sc= 0 (180deg=-0.0968) USER MOD Single : B 1 MET N :NH3+ -140:sc= 1.41 (180deg=0.533) USER MOD Single : B 2 GLN : amide:sc= -1.55 X(o=-1.5,f=-1.9) USER MOD Single : B 6 LYS NZ :NH3+ -109:sc= 0.375 (180deg=-0.337) USER MOD Single : B 7 THR OG1 : rot 180:sc= -0.331 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 LYS NZ :NH3+ 178:sc= 1.09 (180deg=1.02) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc=-0.00419 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 79:sc= -0.0623 USER MOD Single : B 25 ASN : amide:sc= -1.65! C(o=-1.7!,f=-3.2!) USER MOD Single : B 27 LYS NZ :NH3+ 173:sc= 1.19 (180deg=1.14) USER MOD Single : B 29 LYS NZ :NH3+ -137:sc= 1.64 (180deg=-1.19!) USER MOD Single : B 31 GLN : amide:sc= -0.686 K(o=-0.69,f=-1.5) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -0.171 K(o=-0.17,f=-4.7!) USER MOD Single : B 41 GLN : amide:sc= 0.0138 K(o=0.014,f=-5.1!) USER MOD Single : B 48 LYS NZ :NH3+ -160:sc= -1 (180deg=-1.83) USER MOD Single : B 49 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.093) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 165:sc= -2.38 USER MOD Single : B 60 ASN : amide:sc= -0.286 X(o=-0.29,f=-0.33) USER MOD Single : B 62 GLN : amide:sc= 1.03 K(o=1,f=-0.1) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot -119:sc= 0.602 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= 0.419 K(o=0.42,f=-2.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 675 18.859 1.432 9.697 1.00 0.00 N ATOM 2 CA ALA A 675 18.962 2.416 8.631 1.00 0.00 C ATOM 3 C ALA A 675 20.325 2.327 7.941 1.00 0.00 C ATOM 4 O ALA A 675 20.617 3.126 7.053 1.00 0.00 O ATOM 5 CB ALA A 675 18.728 3.808 9.219 1.00 0.00 C ATOM 0 HA ALA A 675 18.204 2.216 7.873 1.00 0.00 H new ATOM 0 HB1 ALA A 675 18.803 4.554 8.428 1.00 0.00 H new ATOM 0 HB2 ALA A 675 17.735 3.852 9.666 1.00 0.00 H new ATOM 0 HB3 ALA A 675 19.479 4.012 9.982 1.00 0.00 H new ATOM 11 N GLU A 676 21.160 1.359 8.342 1.00 0.00 N ATOM 12 CA GLU A 676 22.455 1.116 7.719 1.00 0.00 C ATOM 13 C GLU A 676 22.261 0.371 6.390 1.00 0.00 C ATOM 14 O GLU A 676 22.959 -0.598 6.100 1.00 0.00 O ATOM 15 CB GLU A 676 23.358 0.343 8.688 1.00 0.00 C ATOM 16 CG GLU A 676 24.819 0.394 8.230 1.00 0.00 C ATOM 17 CD GLU A 676 25.705 -0.532 9.058 1.00 0.00 C ATOM 18 OE1 GLU A 676 25.513 -1.765 8.960 1.00 0.00 O ATOM 19 OE2 GLU A 676 26.573 0.000 9.787 1.00 0.00 O ATOM 0 H GLU A 676 20.949 0.723 9.111 1.00 0.00 H new ATOM 0 HA GLU A 676 22.946 2.063 7.496 1.00 0.00 H new ATOM 0 HB2 GLU A 676 23.271 0.766 9.689 1.00 0.00 H new ATOM 0 HB3 GLU A 676 23.028 -0.694 8.751 1.00 0.00 H new ATOM 0 HG2 GLU A 676 24.880 0.112 7.179 1.00 0.00 H new ATOM 0 HG3 GLU A 676 25.189 1.416 8.308 1.00 0.00 H new ATOM 26 N GLU A 677 21.300 0.823 5.575 1.00 0.00 N ATOM 27 CA GLU A 677 20.922 0.174 4.322 1.00 0.00 C ATOM 28 C GLU A 677 20.643 -1.318 4.513 1.00 0.00 C ATOM 29 O GLU A 677 20.836 -2.119 3.600 1.00 0.00 O ATOM 30 CB GLU A 677 21.973 0.444 3.238 1.00 0.00 C ATOM 31 CG GLU A 677 22.132 1.947 2.999 1.00 0.00 C ATOM 32 CD GLU A 677 23.141 2.212 1.881 1.00 0.00 C ATOM 33 OE1 GLU A 677 24.343 2.329 2.204 1.00 0.00 O ATOM 34 OE2 GLU A 677 22.702 2.295 0.711 1.00 0.00 O ATOM 0 H GLU A 677 20.757 1.663 5.774 1.00 0.00 H new ATOM 0 HA GLU A 677 19.983 0.612 3.982 1.00 0.00 H new ATOM 0 HB2 GLU A 677 22.929 0.015 3.537 1.00 0.00 H new ATOM 0 HB3 GLU A 677 21.680 -0.048 2.310 1.00 0.00 H new ATOM 0 HG2 GLU A 677 21.168 2.383 2.737 1.00 0.00 H new ATOM 0 HG3 GLU A 677 22.462 2.433 3.917 1.00 0.00 H new ATOM 41 N LYS A 678 20.186 -1.682 5.716 1.00 0.00 N ATOM 42 CA LYS A 678 19.850 -3.036 6.104 1.00 0.00 C ATOM 43 C LYS A 678 18.632 -3.533 5.335 1.00 0.00 C ATOM 44 O LYS A 678 18.455 -4.735 5.150 1.00 0.00 O ATOM 45 CB LYS A 678 19.523 -2.958 7.589 1.00 0.00 C ATOM 46 CG LYS A 678 19.337 -4.333 8.210 1.00 0.00 C ATOM 47 CD LYS A 678 18.836 -4.114 9.630 1.00 0.00 C ATOM 48 CE LYS A 678 18.743 -5.462 10.322 1.00 0.00 C ATOM 49 NZ LYS A 678 18.137 -5.336 11.660 1.00 0.00 N ATOM 0 H LYS A 678 20.038 -1.008 6.467 1.00 0.00 H new ATOM 0 HA LYS A 678 20.667 -3.726 5.892 1.00 0.00 H new ATOM 0 HB2 LYS A 678 20.324 -2.432 8.108 1.00 0.00 H new ATOM 0 HB3 LYS A 678 18.614 -2.372 7.729 1.00 0.00 H new ATOM 0 HG2 LYS A 678 18.623 -4.923 7.635 1.00 0.00 H new ATOM 0 HG3 LYS A 678 20.277 -4.885 8.213 1.00 0.00 H new ATOM 0 HD2 LYS A 678 19.514 -3.455 10.173 1.00 0.00 H new ATOM 0 HD3 LYS A 678 17.861 -3.627 9.617 1.00 0.00 H new ATOM 0 HE2 LYS A 678 18.149 -6.145 9.714 1.00 0.00 H new ATOM 0 HE3 LYS A 678 19.738 -5.897 10.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 678 18.413 -6.151 12.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 678 18.469 -4.459 12.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 678 17.101 -5.309 11.571 1.00 0.00 H new ATOM 63 N LEU A 679 17.797 -2.590 4.892 1.00 0.00 N ATOM 64 CA LEU A 679 16.556 -2.860 4.219 1.00 0.00 C ATOM 65 C LEU A 679 16.810 -3.514 2.853 1.00 0.00 C ATOM 66 O LEU A 679 17.950 -3.571 2.394 1.00 0.00 O ATOM 67 CB LEU A 679 15.784 -1.547 4.082 1.00 0.00 C ATOM 68 CG LEU A 679 15.709 -0.652 5.329 1.00 0.00 C ATOM 69 CD1 LEU A 679 15.342 -1.452 6.579 1.00 0.00 C ATOM 70 CD2 LEU A 679 16.985 0.152 5.598 1.00 0.00 C ATOM 0 H LEU A 679 17.985 -1.594 5.002 1.00 0.00 H new ATOM 0 HA LEU A 679 15.961 -3.565 4.799 1.00 0.00 H new ATOM 0 HB2 LEU A 679 16.237 -0.969 3.276 1.00 0.00 H new ATOM 0 HB3 LEU A 679 14.766 -1.783 3.772 1.00 0.00 H new ATOM 0 HG LEU A 679 14.918 0.064 5.105 1.00 0.00 H new ATOM 0 HD11 LEU A 679 15.299 -0.784 7.439 1.00 0.00 H new ATOM 0 HD12 LEU A 679 14.370 -1.923 6.437 1.00 0.00 H new ATOM 0 HD13 LEU A 679 16.095 -2.220 6.754 1.00 0.00 H new ATOM 0 HD21 LEU A 679 16.851 0.758 6.494 1.00 0.00 H new ATOM 0 HD22 LEU A 679 17.822 -0.531 5.743 1.00 0.00 H new ATOM 0 HD23 LEU A 679 17.191 0.803 4.748 1.00 0.00 H new ATOM 82 N PRO A 680 15.754 -4.007 2.194 1.00 0.00 N ATOM 83 CA PRO A 680 15.797 -4.721 0.922 1.00 0.00 C ATOM 84 C PRO A 680 16.230 -3.853 -0.261 1.00 0.00 C ATOM 85 O PRO A 680 16.025 -4.236 -1.412 1.00 0.00 O ATOM 86 CB PRO A 680 14.376 -5.258 0.708 1.00 0.00 C ATOM 87 CG PRO A 680 13.726 -5.171 2.089 1.00 0.00 C ATOM 88 CD PRO A 680 14.391 -3.933 2.665 1.00 0.00 C ATOM 0 HA PRO A 680 16.548 -5.510 0.968 1.00 0.00 H new ATOM 0 HB2 PRO A 680 13.832 -4.663 -0.026 1.00 0.00 H new ATOM 0 HB3 PRO A 680 14.390 -6.284 0.339 1.00 0.00 H new ATOM 0 HG2 PRO A 680 12.643 -5.062 2.026 1.00 0.00 H new ATOM 0 HG3 PRO A 680 13.922 -6.059 2.691 1.00 0.00 H new ATOM 0 HD2 PRO A 680 13.901 -3.022 2.322 1.00 0.00 H new ATOM 0 HD3 PRO A 680 14.346 -3.928 3.754 1.00 0.00 H new ATOM 96 N PHE A 681 16.819 -2.689 0.015 1.00 0.00 N ATOM 97 CA PHE A 681 17.219 -1.706 -0.983 1.00 0.00 C ATOM 98 C PHE A 681 18.324 -2.260 -1.890 1.00 0.00 C ATOM 99 O PHE A 681 18.970 -3.250 -1.543 1.00 0.00 O ATOM 100 CB PHE A 681 17.745 -0.461 -0.251 1.00 0.00 C ATOM 101 CG PHE A 681 16.728 0.321 0.558 1.00 0.00 C ATOM 102 CD1 PHE A 681 15.409 -0.130 0.693 1.00 0.00 C ATOM 103 CD2 PHE A 681 17.118 1.520 1.179 1.00 0.00 C ATOM 104 CE1 PHE A 681 14.493 0.602 1.454 1.00 0.00 C ATOM 105 CE2 PHE A 681 16.191 2.259 1.931 1.00 0.00 C ATOM 106 CZ PHE A 681 14.878 1.792 2.076 1.00 0.00 C ATOM 0 H PHE A 681 17.036 -2.399 0.969 1.00 0.00 H new ATOM 0 HA PHE A 681 16.358 -1.459 -1.605 1.00 0.00 H new ATOM 0 HB2 PHE A 681 18.549 -0.771 0.417 1.00 0.00 H new ATOM 0 HB3 PHE A 681 18.184 0.210 -0.989 1.00 0.00 H new ATOM 0 HD1 PHE A 681 15.099 -1.044 0.209 1.00 0.00 H new ATOM 0 HD2 PHE A 681 18.133 1.874 1.077 1.00 0.00 H new ATOM 0 HE1 PHE A 681 13.480 0.245 1.562 1.00 0.00 H new ATOM 0 HE2 PHE A 681 16.490 3.186 2.397 1.00 0.00 H new ATOM 0 HZ PHE A 681 14.166 2.350 2.666 1.00 0.00 H new ATOM 116 N PRO A 682 18.561 -1.633 -3.055 1.00 0.00 N ATOM 117 CA PRO A 682 17.782 -0.544 -3.630 1.00 0.00 C ATOM 118 C PRO A 682 16.570 -0.926 -4.503 1.00 0.00 C ATOM 119 O PRO A 682 15.823 -0.014 -4.856 1.00 0.00 O ATOM 120 CB PRO A 682 18.799 0.176 -4.514 1.00 0.00 C ATOM 121 CG PRO A 682 19.617 -0.982 -5.080 1.00 0.00 C ATOM 122 CD PRO A 682 19.706 -1.939 -3.894 1.00 0.00 C ATOM 0 HA PRO A 682 17.333 0.024 -2.816 1.00 0.00 H new ATOM 0 HB2 PRO A 682 18.316 0.755 -5.301 1.00 0.00 H new ATOM 0 HB3 PRO A 682 19.417 0.869 -3.942 1.00 0.00 H new ATOM 0 HG2 PRO A 682 19.127 -1.444 -5.937 1.00 0.00 H new ATOM 0 HG3 PRO A 682 20.603 -0.657 -5.413 1.00 0.00 H new ATOM 0 HD2 PRO A 682 19.682 -2.977 -4.226 1.00 0.00 H new ATOM 0 HD3 PRO A 682 20.639 -1.800 -3.348 1.00 0.00 H new ATOM 130 N PRO A 683 16.308 -2.189 -4.886 1.00 0.00 N ATOM 131 CA PRO A 683 15.245 -2.479 -5.834 1.00 0.00 C ATOM 132 C PRO A 683 13.849 -2.400 -5.212 1.00 0.00 C ATOM 133 O PRO A 683 13.699 -2.342 -3.994 1.00 0.00 O ATOM 134 CB PRO A 683 15.520 -3.901 -6.324 1.00 0.00 C ATOM 135 CG PRO A 683 16.139 -4.553 -5.095 1.00 0.00 C ATOM 136 CD PRO A 683 16.981 -3.425 -4.516 1.00 0.00 C ATOM 0 HA PRO A 683 15.246 -1.741 -6.636 1.00 0.00 H new ATOM 0 HB2 PRO A 683 14.607 -4.407 -6.637 1.00 0.00 H new ATOM 0 HB3 PRO A 683 16.199 -3.913 -7.177 1.00 0.00 H new ATOM 0 HG2 PRO A 683 15.380 -4.896 -4.391 1.00 0.00 H new ATOM 0 HG3 PRO A 683 16.746 -5.420 -5.357 1.00 0.00 H new ATOM 0 HD2 PRO A 683 17.062 -3.516 -3.433 1.00 0.00 H new ATOM 0 HD3 PRO A 683 17.995 -3.451 -4.915 1.00 0.00 H new ATOM 144 N ASP A 684 12.841 -2.407 -6.092 1.00 0.00 N ATOM 145 CA ASP A 684 11.406 -2.430 -5.812 1.00 0.00 C ATOM 146 C ASP A 684 10.851 -1.277 -4.970 1.00 0.00 C ATOM 147 O ASP A 684 9.644 -1.050 -5.016 1.00 0.00 O ATOM 148 CB ASP A 684 11.024 -3.780 -5.202 1.00 0.00 C ATOM 149 CG ASP A 684 11.412 -4.941 -6.114 1.00 0.00 C ATOM 150 OD1 ASP A 684 10.889 -4.982 -7.251 1.00 0.00 O ATOM 151 OD2 ASP A 684 12.229 -5.779 -5.669 1.00 0.00 O ATOM 0 H ASP A 684 13.025 -2.396 -7.095 1.00 0.00 H new ATOM 0 HA ASP A 684 10.932 -2.284 -6.783 1.00 0.00 H new ATOM 0 HB2 ASP A 684 11.516 -3.895 -4.236 1.00 0.00 H new ATOM 0 HB3 ASP A 684 9.950 -3.805 -5.017 1.00 0.00 H new ATOM 156 N ILE A 685 11.675 -0.547 -4.212 1.00 0.00 N ATOM 157 CA ILE A 685 11.205 0.568 -3.395 1.00 0.00 C ATOM 158 C ILE A 685 12.305 1.595 -3.143 1.00 0.00 C ATOM 159 O ILE A 685 13.487 1.357 -3.389 1.00 0.00 O ATOM 160 CB ILE A 685 10.667 0.095 -2.027 1.00 0.00 C ATOM 161 CG1 ILE A 685 11.326 -1.177 -1.486 1.00 0.00 C ATOM 162 CG2 ILE A 685 9.150 -0.064 -2.043 1.00 0.00 C ATOM 163 CD1 ILE A 685 12.714 -0.851 -0.951 1.00 0.00 C ATOM 0 H ILE A 685 12.679 -0.713 -4.150 1.00 0.00 H new ATOM 0 HA ILE A 685 10.399 1.029 -3.966 1.00 0.00 H new ATOM 0 HB ILE A 685 10.941 0.893 -1.337 1.00 0.00 H new ATOM 0 HG12 ILE A 685 10.713 -1.607 -0.694 1.00 0.00 H new ATOM 0 HG13 ILE A 685 11.397 -1.925 -2.276 1.00 0.00 H new ATOM 0 HG21 ILE A 685 8.809 -0.398 -1.063 1.00 0.00 H new ATOM 0 HG22 ILE A 685 8.686 0.893 -2.282 1.00 0.00 H new ATOM 0 HG23 ILE A 685 8.869 -0.801 -2.796 1.00 0.00 H new ATOM 0 HD11 ILE A 685 13.179 -1.759 -0.567 1.00 0.00 H new ATOM 0 HD12 ILE A 685 13.327 -0.442 -1.754 1.00 0.00 H new ATOM 0 HD13 ILE A 685 12.632 -0.118 -0.148 1.00 0.00 H new ATOM 175 N ASP A 686 11.873 2.748 -2.636 1.00 0.00 N ATOM 176 CA ASP A 686 12.708 3.832 -2.148 1.00 0.00 C ATOM 177 C ASP A 686 11.945 4.439 -0.975 1.00 0.00 C ATOM 178 O ASP A 686 10.739 4.662 -1.091 1.00 0.00 O ATOM 179 CB ASP A 686 12.925 4.873 -3.244 1.00 0.00 C ATOM 180 CG ASP A 686 13.688 4.305 -4.440 1.00 0.00 C ATOM 181 OD1 ASP A 686 14.931 4.203 -4.335 1.00 0.00 O ATOM 182 OD2 ASP A 686 13.021 3.980 -5.448 1.00 0.00 O ATOM 0 H ASP A 686 10.878 2.957 -2.552 1.00 0.00 H new ATOM 0 HA ASP A 686 13.695 3.479 -1.847 1.00 0.00 H new ATOM 0 HB2 ASP A 686 11.959 5.252 -3.579 1.00 0.00 H new ATOM 0 HB3 ASP A 686 13.475 5.720 -2.834 1.00 0.00 H new ATOM 187 N PRO A 687 12.602 4.717 0.156 1.00 0.00 N ATOM 188 CA PRO A 687 11.908 5.179 1.344 1.00 0.00 C ATOM 189 C PRO A 687 11.264 6.532 1.103 1.00 0.00 C ATOM 190 O PRO A 687 10.280 6.872 1.748 1.00 0.00 O ATOM 191 CB PRO A 687 12.958 5.217 2.449 1.00 0.00 C ATOM 192 CG PRO A 687 14.293 5.290 1.711 1.00 0.00 C ATOM 193 CD PRO A 687 14.028 4.594 0.378 1.00 0.00 C ATOM 0 HA PRO A 687 11.087 4.518 1.623 1.00 0.00 H new ATOM 0 HB2 PRO A 687 12.817 6.080 3.100 1.00 0.00 H new ATOM 0 HB3 PRO A 687 12.902 4.330 3.080 1.00 0.00 H new ATOM 0 HG2 PRO A 687 14.610 6.322 1.564 1.00 0.00 H new ATOM 0 HG3 PRO A 687 15.084 4.790 2.270 1.00 0.00 H new ATOM 0 HD2 PRO A 687 14.593 5.062 -0.428 1.00 0.00 H new ATOM 0 HD3 PRO A 687 14.331 3.548 0.414 1.00 0.00 H new ATOM 201 N GLN A 688 11.814 7.302 0.168 1.00 0.00 N ATOM 202 CA GLN A 688 11.302 8.606 -0.226 1.00 0.00 C ATOM 203 C GLN A 688 9.982 8.479 -0.984 1.00 0.00 C ATOM 204 O GLN A 688 9.479 9.479 -1.494 1.00 0.00 O ATOM 205 CB GLN A 688 12.333 9.316 -1.105 1.00 0.00 C ATOM 206 CG GLN A 688 12.976 8.338 -2.092 1.00 0.00 C ATOM 207 CD GLN A 688 14.428 8.065 -1.719 1.00 0.00 C ATOM 208 OE1 GLN A 688 14.699 7.832 -0.433 1.00 0.00 O flip ATOM 209 NE2 GLN A 688 15.306 8.060 -2.579 1.00 0.00 N flip ATOM 0 H GLN A 688 12.650 7.027 -0.348 1.00 0.00 H new ATOM 0 HA GLN A 688 11.119 9.188 0.678 1.00 0.00 H new ATOM 0 HB2 GLN A 688 11.853 10.128 -1.652 1.00 0.00 H new ATOM 0 HB3 GLN A 688 13.103 9.765 -0.478 1.00 0.00 H new ATOM 0 HG2 GLN A 688 12.416 7.403 -2.100 1.00 0.00 H new ATOM 0 HG3 GLN A 688 12.926 8.748 -3.101 1.00 0.00 H new ATOM 0 HE21 GLN A 688 15.066 8.242 -3.554 1.00 0.00 H new ATOM 0 HE22 GLN A 688 16.274 7.874 -2.318 1.00 0.00 H new ATOM 218 N VAL A 689 9.414 7.271 -1.067 1.00 0.00 N ATOM 219 CA VAL A 689 8.199 7.043 -1.819 1.00 0.00 C ATOM 220 C VAL A 689 7.156 6.387 -0.911 1.00 0.00 C ATOM 221 O VAL A 689 6.009 6.194 -1.306 1.00 0.00 O ATOM 222 CB VAL A 689 8.528 6.221 -3.068 1.00 0.00 C ATOM 223 CG1 VAL A 689 7.305 6.110 -3.971 1.00 0.00 C ATOM 224 CG2 VAL A 689 9.630 6.898 -3.883 1.00 0.00 C ATOM 0 H VAL A 689 9.788 6.437 -0.615 1.00 0.00 H new ATOM 0 HA VAL A 689 7.766 7.982 -2.164 1.00 0.00 H new ATOM 0 HB VAL A 689 8.850 5.236 -2.731 1.00 0.00 H new ATOM 0 HG11 VAL A 689 7.557 5.523 -4.854 1.00 0.00 H new ATOM 0 HG12 VAL A 689 6.496 5.621 -3.429 1.00 0.00 H new ATOM 0 HG13 VAL A 689 6.987 7.107 -4.277 1.00 0.00 H new ATOM 0 HG21 VAL A 689 9.850 6.299 -4.766 1.00 0.00 H new ATOM 0 HG22 VAL A 689 9.298 7.890 -4.191 1.00 0.00 H new ATOM 0 HG23 VAL A 689 10.529 6.989 -3.274 1.00 0.00 H new ATOM 234 N PHE A 690 7.558 6.048 0.321 1.00 0.00 N ATOM 235 CA PHE A 690 6.631 5.602 1.347 1.00 0.00 C ATOM 236 C PHE A 690 6.775 6.438 2.624 1.00 0.00 C ATOM 237 O PHE A 690 5.965 6.313 3.537 1.00 0.00 O ATOM 238 CB PHE A 690 6.744 4.093 1.557 1.00 0.00 C ATOM 239 CG PHE A 690 8.082 3.535 1.976 1.00 0.00 C ATOM 240 CD1 PHE A 690 8.442 3.494 3.331 1.00 0.00 C ATOM 241 CD2 PHE A 690 8.949 3.021 1.003 1.00 0.00 C ATOM 242 CE1 PHE A 690 9.655 2.910 3.722 1.00 0.00 C ATOM 243 CE2 PHE A 690 10.168 2.451 1.389 1.00 0.00 C ATOM 244 CZ PHE A 690 10.520 2.395 2.748 1.00 0.00 C ATOM 0 H PHE A 690 8.531 6.078 0.625 1.00 0.00 H new ATOM 0 HA PHE A 690 5.608 5.774 1.012 1.00 0.00 H new ATOM 0 HB2 PHE A 690 6.011 3.805 2.311 1.00 0.00 H new ATOM 0 HB3 PHE A 690 6.454 3.604 0.627 1.00 0.00 H new ATOM 0 HD1 PHE A 690 7.782 3.914 4.076 1.00 0.00 H new ATOM 0 HD2 PHE A 690 8.678 3.064 -0.042 1.00 0.00 H new ATOM 0 HE1 PHE A 690 9.921 2.858 4.767 1.00 0.00 H new ATOM 0 HE2 PHE A 690 10.839 2.054 0.641 1.00 0.00 H new ATOM 0 HZ PHE A 690 11.461 1.953 3.043 1.00 0.00 H new ATOM 254 N TYR A 691 7.801 7.294 2.687 1.00 0.00 N ATOM 255 CA TYR A 691 7.928 8.370 3.659 1.00 0.00 C ATOM 256 C TYR A 691 6.874 9.443 3.362 1.00 0.00 C ATOM 257 O TYR A 691 6.683 10.359 4.159 1.00 0.00 O ATOM 258 CB TYR A 691 9.328 8.996 3.567 1.00 0.00 C ATOM 259 CG TYR A 691 10.463 8.210 4.198 1.00 0.00 C ATOM 260 CD1 TYR A 691 10.197 7.114 5.034 1.00 0.00 C ATOM 261 CD2 TYR A 691 11.797 8.587 3.961 1.00 0.00 C ATOM 262 CE1 TYR A 691 11.239 6.450 5.691 1.00 0.00 C ATOM 263 CE2 TYR A 691 12.845 7.939 4.629 1.00 0.00 C ATOM 264 CZ TYR A 691 12.570 6.870 5.506 1.00 0.00 C ATOM 265 OH TYR A 691 13.587 6.240 6.161 1.00 0.00 O ATOM 0 H TYR A 691 8.588 7.250 2.039 1.00 0.00 H new ATOM 0 HA TYR A 691 7.779 7.969 4.662 1.00 0.00 H new ATOM 0 HB2 TYR A 691 9.564 9.151 2.514 1.00 0.00 H new ATOM 0 HB3 TYR A 691 9.293 9.980 4.034 1.00 0.00 H new ATOM 0 HD1 TYR A 691 9.179 6.780 5.171 1.00 0.00 H new ATOM 0 HD2 TYR A 691 12.015 9.380 3.261 1.00 0.00 H new ATOM 0 HE1 TYR A 691 11.022 5.615 6.340 1.00 0.00 H new ATOM 0 HE2 TYR A 691 13.864 8.259 4.472 1.00 0.00 H new ATOM 0 HH TYR A 691 14.440 6.656 5.918 1.00 0.00 H new ATOM 275 N GLU A 692 6.184 9.331 2.217 1.00 0.00 N ATOM 276 CA GLU A 692 5.067 10.192 1.825 1.00 0.00 C ATOM 277 C GLU A 692 3.826 9.891 2.669 1.00 0.00 C ATOM 278 O GLU A 692 2.703 10.180 2.259 1.00 0.00 O ATOM 279 CB GLU A 692 4.745 9.981 0.339 1.00 0.00 C ATOM 280 CG GLU A 692 5.900 10.430 -0.560 1.00 0.00 C ATOM 281 CD GLU A 692 5.492 10.391 -2.032 1.00 0.00 C ATOM 282 OE1 GLU A 692 4.509 11.080 -2.383 1.00 0.00 O ATOM 283 OE2 GLU A 692 6.166 9.674 -2.804 1.00 0.00 O ATOM 0 H GLU A 692 6.397 8.617 1.521 1.00 0.00 H new ATOM 0 HA GLU A 692 5.357 11.229 1.992 1.00 0.00 H new ATOM 0 HB2 GLU A 692 4.532 8.927 0.159 1.00 0.00 H new ATOM 0 HB3 GLU A 692 3.844 10.537 0.079 1.00 0.00 H new ATOM 0 HG2 GLU A 692 6.205 11.441 -0.290 1.00 0.00 H new ATOM 0 HG3 GLU A 692 6.763 9.783 -0.400 1.00 0.00 H new ATOM 290 N LEU A 693 4.027 9.308 3.851 1.00 0.00 N ATOM 291 CA LEU A 693 2.989 8.776 4.711 1.00 0.00 C ATOM 292 C LEU A 693 3.399 8.979 6.166 1.00 0.00 C ATOM 293 O LEU A 693 4.545 9.330 6.441 1.00 0.00 O ATOM 294 CB LEU A 693 2.904 7.267 4.461 1.00 0.00 C ATOM 295 CG LEU A 693 2.279 6.903 3.112 1.00 0.00 C ATOM 296 CD1 LEU A 693 2.357 5.390 2.933 1.00 0.00 C ATOM 297 CD2 LEU A 693 0.813 7.326 3.049 1.00 0.00 C ATOM 0 H LEU A 693 4.961 9.192 4.245 1.00 0.00 H new ATOM 0 HA LEU A 693 2.039 9.271 4.509 1.00 0.00 H new ATOM 0 HB2 LEU A 693 3.906 6.841 4.514 1.00 0.00 H new ATOM 0 HB3 LEU A 693 2.320 6.808 5.258 1.00 0.00 H new ATOM 0 HG LEU A 693 2.824 7.423 2.324 1.00 0.00 H new ATOM 0 HD11 LEU A 693 1.915 5.114 1.976 1.00 0.00 H new ATOM 0 HD12 LEU A 693 3.400 5.074 2.956 1.00 0.00 H new ATOM 0 HD13 LEU A 693 1.811 4.900 3.739 1.00 0.00 H new ATOM 0 HD21 LEU A 693 0.397 7.054 2.079 1.00 0.00 H new ATOM 0 HD22 LEU A 693 0.255 6.822 3.838 1.00 0.00 H new ATOM 0 HD23 LEU A 693 0.739 8.405 3.186 1.00 0.00 H new ATOM 309 N PRO A 694 2.480 8.758 7.109 1.00 0.00 N ATOM 310 CA PRO A 694 2.813 8.687 8.514 1.00 0.00 C ATOM 311 C PRO A 694 3.551 7.388 8.758 1.00 0.00 C ATOM 312 O PRO A 694 3.219 6.342 8.200 1.00 0.00 O ATOM 313 CB PRO A 694 1.477 8.719 9.250 1.00 0.00 C ATOM 314 CG PRO A 694 0.531 8.060 8.251 1.00 0.00 C ATOM 315 CD PRO A 694 1.063 8.538 6.902 1.00 0.00 C ATOM 0 HA PRO A 694 3.453 9.502 8.853 1.00 0.00 H new ATOM 0 HB2 PRO A 694 1.519 8.170 10.191 1.00 0.00 H new ATOM 0 HB3 PRO A 694 1.170 9.737 9.488 1.00 0.00 H new ATOM 0 HG2 PRO A 694 0.554 6.973 8.331 1.00 0.00 H new ATOM 0 HG3 PRO A 694 -0.502 8.370 8.409 1.00 0.00 H new ATOM 0 HD2 PRO A 694 0.889 7.794 6.124 1.00 0.00 H new ATOM 0 HD3 PRO A 694 0.565 9.454 6.584 1.00 0.00 H new ATOM 323 N GLU A 695 4.564 7.489 9.611 1.00 0.00 N ATOM 324 CA GLU A 695 5.305 6.399 10.188 1.00 0.00 C ATOM 325 C GLU A 695 4.505 5.114 10.302 1.00 0.00 C ATOM 326 O GLU A 695 5.017 4.062 9.970 1.00 0.00 O ATOM 327 CB GLU A 695 5.759 6.857 11.566 1.00 0.00 C ATOM 328 CG GLU A 695 7.280 6.846 11.625 1.00 0.00 C ATOM 329 CD GLU A 695 7.783 7.214 13.018 1.00 0.00 C ATOM 330 OE1 GLU A 695 7.964 8.428 13.266 1.00 0.00 O ATOM 331 OE2 GLU A 695 7.984 6.282 13.827 1.00 0.00 O ATOM 0 H GLU A 695 4.903 8.396 9.931 1.00 0.00 H new ATOM 0 HA GLU A 695 6.144 6.160 9.534 1.00 0.00 H new ATOM 0 HB2 GLU A 695 5.383 7.859 11.771 1.00 0.00 H new ATOM 0 HB3 GLU A 695 5.349 6.200 12.333 1.00 0.00 H new ATOM 0 HG2 GLU A 695 7.650 5.858 11.352 1.00 0.00 H new ATOM 0 HG3 GLU A 695 7.680 7.549 10.894 1.00 0.00 H new ATOM 338 N GLU A 696 3.257 5.180 10.759 1.00 0.00 N ATOM 339 CA GLU A 696 2.391 4.032 10.950 1.00 0.00 C ATOM 340 C GLU A 696 2.400 3.073 9.753 1.00 0.00 C ATOM 341 O GLU A 696 2.031 1.911 9.898 1.00 0.00 O ATOM 342 CB GLU A 696 0.989 4.558 11.258 1.00 0.00 C ATOM 343 CG GLU A 696 -0.010 3.414 11.355 1.00 0.00 C ATOM 344 CD GLU A 696 -1.363 3.911 11.862 1.00 0.00 C ATOM 345 OE1 GLU A 696 -2.121 4.477 11.044 1.00 0.00 O ATOM 346 OE2 GLU A 696 -1.630 3.720 13.069 1.00 0.00 O ATOM 0 H GLU A 696 2.812 6.062 11.013 1.00 0.00 H new ATOM 0 HA GLU A 696 2.759 3.434 11.783 1.00 0.00 H new ATOM 0 HB2 GLU A 696 1.003 5.115 12.195 1.00 0.00 H new ATOM 0 HB3 GLU A 696 0.677 5.253 10.478 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -0.132 2.949 10.377 1.00 0.00 H new ATOM 0 HG3 GLU A 696 0.375 2.646 12.027 1.00 0.00 H new ATOM 353 N VAL A 697 2.823 3.549 8.577 1.00 0.00 N ATOM 354 CA VAL A 697 3.003 2.702 7.407 1.00 0.00 C ATOM 355 C VAL A 697 4.431 2.822 6.876 1.00 0.00 C ATOM 356 O VAL A 697 4.947 1.881 6.277 1.00 0.00 O ATOM 357 CB VAL A 697 1.959 3.078 6.349 1.00 0.00 C ATOM 358 CG1 VAL A 697 2.163 2.274 5.068 1.00 0.00 C ATOM 359 CG2 VAL A 697 0.554 2.789 6.875 1.00 0.00 C ATOM 0 H VAL A 697 3.048 4.531 8.416 1.00 0.00 H new ATOM 0 HA VAL A 697 2.853 1.657 7.677 1.00 0.00 H new ATOM 0 HB VAL A 697 2.075 4.140 6.134 1.00 0.00 H new ATOM 0 HG11 VAL A 697 1.409 2.560 4.335 1.00 0.00 H new ATOM 0 HG12 VAL A 697 3.156 2.476 4.666 1.00 0.00 H new ATOM 0 HG13 VAL A 697 2.070 1.210 5.287 1.00 0.00 H new ATOM 0 HG21 VAL A 697 -0.181 3.059 6.117 1.00 0.00 H new ATOM 0 HG22 VAL A 697 0.463 1.728 7.106 1.00 0.00 H new ATOM 0 HG23 VAL A 697 0.376 3.374 7.778 1.00 0.00 H new ATOM 369 N GLN A 698 5.087 3.970 7.091 1.00 0.00 N ATOM 370 CA GLN A 698 6.488 4.167 6.728 1.00 0.00 C ATOM 371 C GLN A 698 7.413 3.369 7.663 1.00 0.00 C ATOM 372 O GLN A 698 8.615 3.279 7.425 1.00 0.00 O ATOM 373 CB GLN A 698 6.779 5.674 6.713 1.00 0.00 C ATOM 374 CG GLN A 698 7.922 6.144 7.620 1.00 0.00 C ATOM 375 CD GLN A 698 7.989 7.669 7.654 1.00 0.00 C ATOM 376 OE1 GLN A 698 6.832 8.328 7.652 1.00 0.00 O flip ATOM 377 NE2 GLN A 698 9.070 8.254 7.677 1.00 0.00 N flip ATOM 0 H GLN A 698 4.656 4.787 7.523 1.00 0.00 H new ATOM 0 HA GLN A 698 6.687 3.780 5.729 1.00 0.00 H new ATOM 0 HB2 GLN A 698 7.008 5.970 5.689 1.00 0.00 H new ATOM 0 HB3 GLN A 698 5.871 6.203 7.002 1.00 0.00 H new ATOM 0 HG2 GLN A 698 7.775 5.759 8.629 1.00 0.00 H new ATOM 0 HG3 GLN A 698 8.869 5.741 7.260 1.00 0.00 H new ATOM 0 HE21 GLN A 698 9.939 7.720 7.678 1.00 0.00 H new ATOM 0 HE22 GLN A 698 9.098 9.273 7.695 1.00 0.00 H new ATOM 386 N LYS A 699 6.839 2.796 8.728 1.00 0.00 N ATOM 387 CA LYS A 699 7.529 2.011 9.745 1.00 0.00 C ATOM 388 C LYS A 699 7.068 0.560 9.687 1.00 0.00 C ATOM 389 O LYS A 699 7.725 -0.341 10.208 1.00 0.00 O ATOM 390 CB LYS A 699 7.233 2.635 11.118 1.00 0.00 C ATOM 391 CG LYS A 699 5.932 2.124 11.762 1.00 0.00 C ATOM 392 CD LYS A 699 5.469 3.014 12.916 1.00 0.00 C ATOM 393 CE LYS A 699 6.603 3.332 13.884 1.00 0.00 C ATOM 394 NZ LYS A 699 7.075 2.127 14.594 1.00 0.00 N ATOM 0 H LYS A 699 5.838 2.873 8.907 1.00 0.00 H new ATOM 0 HA LYS A 699 8.605 2.020 9.570 1.00 0.00 H new ATOM 0 HB2 LYS A 699 8.066 2.427 11.789 1.00 0.00 H new ATOM 0 HB3 LYS A 699 7.174 3.718 11.010 1.00 0.00 H new ATOM 0 HG2 LYS A 699 5.149 2.076 11.006 1.00 0.00 H new ATOM 0 HG3 LYS A 699 6.084 1.108 12.127 1.00 0.00 H new ATOM 0 HD2 LYS A 699 5.062 3.943 12.516 1.00 0.00 H new ATOM 0 HD3 LYS A 699 4.661 2.518 13.454 1.00 0.00 H new ATOM 0 HE2 LYS A 699 7.433 3.779 13.337 1.00 0.00 H new ATOM 0 HE3 LYS A 699 6.264 4.072 14.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 7.846 2.386 15.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 6.290 1.714 15.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 7.422 1.431 13.904 1.00 0.00 H new ATOM 408 N GLU A 700 5.921 0.335 9.043 1.00 0.00 N ATOM 409 CA GLU A 700 5.348 -0.989 8.925 1.00 0.00 C ATOM 410 C GLU A 700 6.205 -1.739 7.928 1.00 0.00 C ATOM 411 O GLU A 700 6.488 -2.920 8.097 1.00 0.00 O ATOM 412 CB GLU A 700 3.922 -0.874 8.393 1.00 0.00 C ATOM 413 CG GLU A 700 3.217 -2.221 8.466 1.00 0.00 C ATOM 414 CD GLU A 700 1.764 -2.113 8.004 1.00 0.00 C ATOM 415 OE1 GLU A 700 1.556 -1.873 6.792 1.00 0.00 O ATOM 416 OE2 GLU A 700 0.869 -2.271 8.863 1.00 0.00 O ATOM 0 H GLU A 700 5.372 1.068 8.594 1.00 0.00 H new ATOM 0 HA GLU A 700 5.319 -1.502 9.886 1.00 0.00 H new ATOM 0 HB2 GLU A 700 3.369 -0.135 8.973 1.00 0.00 H new ATOM 0 HB3 GLU A 700 3.939 -0.521 7.362 1.00 0.00 H new ATOM 0 HG2 GLU A 700 3.745 -2.945 7.845 1.00 0.00 H new ATOM 0 HG3 GLU A 700 3.249 -2.595 9.489 1.00 0.00 H new ATOM 423 N LEU A 701 6.618 -1.016 6.885 1.00 0.00 N ATOM 424 CA LEU A 701 7.558 -1.490 5.898 1.00 0.00 C ATOM 425 C LEU A 701 8.906 -1.759 6.564 1.00 0.00 C ATOM 426 O LEU A 701 9.556 -2.759 6.266 1.00 0.00 O ATOM 427 CB LEU A 701 7.674 -0.406 4.827 1.00 0.00 C ATOM 428 CG LEU A 701 6.817 -0.737 3.602 1.00 0.00 C ATOM 429 CD1 LEU A 701 5.336 -0.831 3.975 1.00 0.00 C ATOM 430 CD2 LEU A 701 6.987 0.354 2.548 1.00 0.00 C ATOM 0 H LEU A 701 6.294 -0.065 6.710 1.00 0.00 H new ATOM 0 HA LEU A 701 7.225 -2.423 5.444 1.00 0.00 H new ATOM 0 HB2 LEU A 701 7.363 0.553 5.242 1.00 0.00 H new ATOM 0 HB3 LEU A 701 8.716 -0.300 4.526 1.00 0.00 H new ATOM 0 HG LEU A 701 7.146 -1.700 3.211 1.00 0.00 H new ATOM 0 HD11 LEU A 701 4.751 -1.067 3.086 1.00 0.00 H new ATOM 0 HD12 LEU A 701 5.197 -1.615 4.719 1.00 0.00 H new ATOM 0 HD13 LEU A 701 5.003 0.122 4.386 1.00 0.00 H new ATOM 0 HD21 LEU A 701 6.376 0.117 1.677 1.00 0.00 H new ATOM 0 HD22 LEU A 701 6.672 1.312 2.962 1.00 0.00 H new ATOM 0 HD23 LEU A 701 8.034 0.414 2.252 1.00 0.00 H new ATOM 442 N MET A 702 9.328 -0.874 7.474 1.00 0.00 N ATOM 443 CA MET A 702 10.573 -1.049 8.206 1.00 0.00 C ATOM 444 C MET A 702 10.492 -2.221 9.184 1.00 0.00 C ATOM 445 O MET A 702 11.510 -2.598 9.764 1.00 0.00 O ATOM 446 CB MET A 702 10.906 0.221 8.990 1.00 0.00 C ATOM 447 CG MET A 702 11.315 1.336 8.031 1.00 0.00 C ATOM 448 SD MET A 702 12.911 1.024 7.238 1.00 0.00 S ATOM 449 CE MET A 702 12.529 1.660 5.593 1.00 0.00 C ATOM 0 H MET A 702 8.817 -0.026 7.717 1.00 0.00 H new ATOM 0 HA MET A 702 11.353 -1.257 7.473 1.00 0.00 H new ATOM 0 HB2 MET A 702 10.042 0.533 9.576 1.00 0.00 H new ATOM 0 HB3 MET A 702 11.714 0.022 9.694 1.00 0.00 H new ATOM 0 HG2 MET A 702 10.549 1.449 7.264 1.00 0.00 H new ATOM 0 HG3 MET A 702 11.363 2.279 8.576 1.00 0.00 H new ATOM 0 HE1 MET A 702 13.340 1.410 4.909 1.00 0.00 H new ATOM 0 HE2 MET A 702 11.602 1.212 5.236 1.00 0.00 H new ATOM 0 HE3 MET A 702 12.414 2.743 5.639 1.00 0.00 H new ATOM 459 N ALA A 703 9.301 -2.798 9.375 1.00 0.00 N ATOM 460 CA ALA A 703 9.129 -3.946 10.252 1.00 0.00 C ATOM 461 C ALA A 703 8.733 -5.184 9.457 1.00 0.00 C ATOM 462 O ALA A 703 8.914 -6.312 9.917 1.00 0.00 O ATOM 463 CB ALA A 703 8.025 -3.632 11.257 1.00 0.00 C ATOM 0 H ALA A 703 8.441 -2.481 8.928 1.00 0.00 H new ATOM 0 HA ALA A 703 10.073 -4.145 10.760 1.00 0.00 H new ATOM 0 HB1 ALA A 703 7.885 -4.484 11.922 1.00 0.00 H new ATOM 0 HB2 ALA A 703 8.305 -2.757 11.843 1.00 0.00 H new ATOM 0 HB3 ALA A 703 7.095 -3.430 10.725 1.00 0.00 H new ATOM 469 N GLU A 704 8.190 -4.974 8.258 1.00 0.00 N ATOM 470 CA GLU A 704 7.726 -6.007 7.380 1.00 0.00 C ATOM 471 C GLU A 704 8.928 -6.653 6.715 1.00 0.00 C ATOM 472 O GLU A 704 8.870 -7.799 6.280 1.00 0.00 O ATOM 473 CB GLU A 704 6.855 -5.286 6.355 1.00 0.00 C ATOM 474 CG GLU A 704 6.474 -6.272 5.283 1.00 0.00 C ATOM 475 CD GLU A 704 5.392 -5.706 4.369 1.00 0.00 C ATOM 476 OE1 GLU A 704 4.201 -5.843 4.733 1.00 0.00 O ATOM 477 OE2 GLU A 704 5.765 -5.140 3.318 1.00 0.00 O ATOM 0 H GLU A 704 8.064 -4.038 7.872 1.00 0.00 H new ATOM 0 HA GLU A 704 7.168 -6.793 7.889 1.00 0.00 H new ATOM 0 HB2 GLU A 704 5.963 -4.881 6.833 1.00 0.00 H new ATOM 0 HB3 GLU A 704 7.395 -4.444 5.922 1.00 0.00 H new ATOM 0 HG2 GLU A 704 7.354 -6.529 4.693 1.00 0.00 H new ATOM 0 HG3 GLU A 704 6.119 -7.194 5.743 1.00 0.00 H new ATOM 484 N TRP A 705 10.018 -5.893 6.648 1.00 0.00 N ATOM 485 CA TRP A 705 11.226 -6.276 5.952 1.00 0.00 C ATOM 486 C TRP A 705 12.159 -6.975 6.923 1.00 0.00 C ATOM 487 O TRP A 705 12.961 -7.821 6.531 1.00 0.00 O ATOM 488 CB TRP A 705 11.840 -4.992 5.423 1.00 0.00 C ATOM 489 CG TRP A 705 11.094 -4.366 4.291 1.00 0.00 C ATOM 490 CD1 TRP A 705 10.106 -4.936 3.563 1.00 0.00 C ATOM 491 CD2 TRP A 705 11.260 -3.029 3.737 1.00 0.00 C ATOM 492 NE1 TRP A 705 9.667 -4.054 2.597 1.00 0.00 N ATOM 493 CE2 TRP A 705 10.354 -2.859 2.654 1.00 0.00 C ATOM 494 CE3 TRP A 705 12.102 -1.950 4.050 1.00 0.00 C ATOM 495 CZ2 TRP A 705 10.301 -1.683 1.902 1.00 0.00 C ATOM 496 CZ3 TRP A 705 12.070 -0.774 3.294 1.00 0.00 C ATOM 497 CH2 TRP A 705 11.186 -0.646 2.215 1.00 0.00 C ATOM 0 H TRP A 705 10.079 -4.975 7.088 1.00 0.00 H new ATOM 0 HA TRP A 705 11.031 -6.966 5.131 1.00 0.00 H new ATOM 0 HB2 TRP A 705 11.905 -4.273 6.239 1.00 0.00 H new ATOM 0 HB3 TRP A 705 12.860 -5.199 5.098 1.00 0.00 H new ATOM 0 HD1 TRP A 705 9.719 -5.933 3.715 1.00 0.00 H new ATOM 0 HE1 TRP A 705 8.928 -4.260 1.925 1.00 0.00 H new ATOM 0 HE3 TRP A 705 12.783 -2.029 4.885 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 9.591 -1.577 1.095 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 12.732 0.042 3.544 1.00 0.00 H new ATOM 0 HH2 TRP A 705 11.188 0.257 1.622 1.00 0.00 H new ATOM 508 N GLU A 706 12.045 -6.612 8.197 1.00 0.00 N ATOM 509 CA GLU A 706 12.802 -7.241 9.259 1.00 0.00 C ATOM 510 C GLU A 706 12.347 -8.687 9.404 1.00 0.00 C ATOM 511 O GLU A 706 13.163 -9.586 9.609 1.00 0.00 O ATOM 512 CB GLU A 706 12.537 -6.463 10.539 1.00 0.00 C ATOM 513 CG GLU A 706 13.217 -5.099 10.468 1.00 0.00 C ATOM 514 CD GLU A 706 14.741 -5.200 10.504 1.00 0.00 C ATOM 515 OE1 GLU A 706 15.300 -5.190 11.624 1.00 0.00 O ATOM 516 OE2 GLU A 706 15.341 -5.286 9.411 1.00 0.00 O ATOM 0 H GLU A 706 11.422 -5.871 8.516 1.00 0.00 H new ATOM 0 HA GLU A 706 13.870 -7.237 9.041 1.00 0.00 H new ATOM 0 HB2 GLU A 706 11.464 -6.337 10.683 1.00 0.00 H new ATOM 0 HB3 GLU A 706 12.910 -7.021 11.398 1.00 0.00 H new ATOM 0 HG2 GLU A 706 12.912 -4.592 9.553 1.00 0.00 H new ATOM 0 HG3 GLU A 706 12.877 -4.484 11.301 1.00 0.00 H new ATOM 523 N ARG A 707 11.032 -8.907 9.291 1.00 0.00 N ATOM 524 CA ARG A 707 10.451 -10.245 9.305 1.00 0.00 C ATOM 525 C ARG A 707 10.459 -10.887 7.916 1.00 0.00 C ATOM 526 O ARG A 707 10.228 -12.089 7.800 1.00 0.00 O ATOM 527 CB ARG A 707 9.029 -10.175 9.870 1.00 0.00 C ATOM 528 CG ARG A 707 8.095 -9.435 8.911 1.00 0.00 C ATOM 529 CD ARG A 707 6.721 -9.233 9.545 1.00 0.00 C ATOM 530 NE ARG A 707 6.792 -8.287 10.666 1.00 0.00 N ATOM 531 CZ ARG A 707 5.839 -8.136 11.588 1.00 0.00 C ATOM 532 NH1 ARG A 707 4.718 -8.850 11.532 1.00 0.00 N ATOM 533 NH2 ARG A 707 6.003 -7.264 12.578 1.00 0.00 N ATOM 0 H ARG A 707 10.345 -8.160 9.188 1.00 0.00 H new ATOM 0 HA ARG A 707 11.064 -10.879 9.945 1.00 0.00 H new ATOM 0 HB2 ARG A 707 8.653 -11.183 10.044 1.00 0.00 H new ATOM 0 HB3 ARG A 707 9.042 -9.668 10.835 1.00 0.00 H new ATOM 0 HG2 ARG A 707 8.526 -8.469 8.649 1.00 0.00 H new ATOM 0 HG3 ARG A 707 7.994 -10.001 7.985 1.00 0.00 H new ATOM 0 HD2 ARG A 707 6.022 -8.862 8.796 1.00 0.00 H new ATOM 0 HD3 ARG A 707 6.334 -10.190 9.896 1.00 0.00 H new ATOM 0 HE ARG A 707 7.626 -7.706 10.745 1.00 0.00 H new ATOM 0 HH11 ARG A 707 4.579 -9.523 10.778 1.00 0.00 H new ATOM 0 HH12 ARG A 707 3.998 -8.725 12.243 1.00 0.00 H new ATOM 0 HH21 ARG A 707 6.858 -6.710 12.633 1.00 0.00 H new ATOM 0 HH22 ARG A 707 5.274 -7.149 13.282 1.00 0.00 H new ATOM 547 N ALA A 708 10.719 -10.107 6.860 1.00 0.00 N ATOM 548 CA ALA A 708 10.825 -10.637 5.505 1.00 0.00 C ATOM 549 C ALA A 708 12.044 -11.545 5.331 1.00 0.00 C ATOM 550 O ALA A 708 12.095 -12.329 4.385 1.00 0.00 O ATOM 551 CB ALA A 708 10.913 -9.479 4.509 1.00 0.00 C ATOM 0 H ALA A 708 10.860 -9.099 6.925 1.00 0.00 H new ATOM 0 HA ALA A 708 9.934 -11.237 5.318 1.00 0.00 H new ATOM 0 HB1 ALA A 708 10.992 -9.875 3.497 1.00 0.00 H new ATOM 0 HB2 ALA A 708 10.018 -8.862 4.588 1.00 0.00 H new ATOM 0 HB3 ALA A 708 11.792 -8.874 4.732 1.00 0.00 H new ATOM 557 N GLY A 709 13.024 -11.443 6.235 1.00 0.00 N ATOM 558 CA GLY A 709 14.247 -12.230 6.143 1.00 0.00 C ATOM 559 C GLY A 709 15.495 -11.366 6.313 1.00 0.00 C ATOM 560 O GLY A 709 16.611 -11.857 6.165 1.00 0.00 O ATOM 0 H GLY A 709 12.988 -10.818 7.041 1.00 0.00 H new ATOM 0 HA2 GLY A 709 14.237 -13.007 6.907 1.00 0.00 H new ATOM 0 HA3 GLY A 709 14.283 -12.733 5.177 1.00 0.00 H new ATOM 564 N ALA A 710 15.311 -10.082 6.620 1.00 0.00 N ATOM 565 CA ALA A 710 16.418 -9.133 6.690 1.00 0.00 C ATOM 566 C ALA A 710 16.980 -8.982 8.106 1.00 0.00 C ATOM 567 O ALA A 710 17.944 -8.249 8.313 1.00 0.00 O ATOM 568 CB ALA A 710 15.941 -7.780 6.164 1.00 0.00 C ATOM 0 H ALA A 710 14.399 -9.675 6.825 1.00 0.00 H new ATOM 0 HA ALA A 710 17.231 -9.519 6.075 1.00 0.00 H new ATOM 0 HB1 ALA A 710 16.760 -7.062 6.211 1.00 0.00 H new ATOM 0 HB2 ALA A 710 15.611 -7.887 5.131 1.00 0.00 H new ATOM 0 HB3 ALA A 710 15.111 -7.424 6.774 1.00 0.00 H new TER 574 ALA A 710 ATOM 575 N MET B 1 -12.131 12.543 -15.954 1.00 0.00 N ATOM 576 CA MET B 1 -11.861 12.360 -14.518 1.00 0.00 C ATOM 577 C MET B 1 -10.918 11.186 -14.293 1.00 0.00 C ATOM 578 O MET B 1 -11.125 10.117 -14.858 1.00 0.00 O ATOM 579 CB MET B 1 -13.154 12.139 -13.718 1.00 0.00 C ATOM 580 CG MET B 1 -13.830 10.794 -14.017 1.00 0.00 C ATOM 581 SD MET B 1 -14.514 10.631 -15.689 1.00 0.00 S ATOM 582 CE MET B 1 -15.185 8.955 -15.565 1.00 0.00 C ATOM 0 H1 MET B 1 -12.146 13.559 -16.178 1.00 0.00 H new ATOM 0 H2 MET B 1 -11.386 12.077 -16.510 1.00 0.00 H new ATOM 0 H3 MET B 1 -13.053 12.123 -16.190 1.00 0.00 H new ATOM 0 HA MET B 1 -11.391 13.277 -14.162 1.00 0.00 H new ATOM 0 HB2 MET B 1 -12.928 12.196 -12.653 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.852 12.946 -13.939 1.00 0.00 H new ATOM 0 HG2 MET B 1 -13.103 9.997 -13.859 1.00 0.00 H new ATOM 0 HG3 MET B 1 -14.633 10.641 -13.296 1.00 0.00 H new ATOM 0 HE1 MET B 1 -15.391 8.571 -16.564 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.460 8.309 -15.070 1.00 0.00 H new ATOM 0 HE3 MET B 1 -16.108 8.975 -14.986 1.00 0.00 H new ATOM 594 N GLN B 2 -9.886 11.374 -13.468 1.00 0.00 N ATOM 595 CA GLN B 2 -8.937 10.332 -13.110 1.00 0.00 C ATOM 596 C GLN B 2 -8.122 10.778 -11.895 1.00 0.00 C ATOM 597 O GLN B 2 -7.937 11.978 -11.702 1.00 0.00 O ATOM 598 CB GLN B 2 -8.033 10.072 -14.318 1.00 0.00 C ATOM 599 CG GLN B 2 -7.505 11.392 -14.889 1.00 0.00 C ATOM 600 CD GLN B 2 -6.595 11.228 -16.102 1.00 0.00 C ATOM 601 OE1 GLN B 2 -5.701 12.042 -16.318 1.00 0.00 O ATOM 602 NE2 GLN B 2 -6.802 10.190 -16.906 1.00 0.00 N ATOM 0 H GLN B 2 -9.688 12.271 -13.026 1.00 0.00 H new ATOM 0 HA GLN B 2 -9.455 9.410 -12.845 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -7.198 9.436 -14.024 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -8.588 9.533 -15.086 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -8.352 12.020 -15.166 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -6.959 11.920 -14.108 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -7.552 9.529 -16.703 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -6.211 10.054 -17.726 1.00 0.00 H new ATOM 611 N ILE B 3 -7.637 9.827 -11.090 1.00 0.00 N ATOM 612 CA ILE B 3 -6.845 10.150 -9.903 1.00 0.00 C ATOM 613 C ILE B 3 -5.388 9.761 -10.114 1.00 0.00 C ATOM 614 O ILE B 3 -5.082 8.930 -10.964 1.00 0.00 O ATOM 615 CB ILE B 3 -7.436 9.524 -8.623 1.00 0.00 C ATOM 616 CG1 ILE B 3 -7.033 8.062 -8.405 1.00 0.00 C ATOM 617 CG2 ILE B 3 -8.960 9.636 -8.551 1.00 0.00 C ATOM 618 CD1 ILE B 3 -7.472 7.117 -9.516 1.00 0.00 C ATOM 0 H ILE B 3 -7.780 8.828 -11.240 1.00 0.00 H new ATOM 0 HA ILE B 3 -6.885 11.229 -9.756 1.00 0.00 H new ATOM 0 HB ILE B 3 -6.998 10.119 -7.821 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -5.949 8.007 -8.305 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.458 7.717 -7.462 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.315 9.178 -7.628 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -9.249 10.687 -8.569 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -9.403 9.123 -9.405 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -7.146 6.104 -9.282 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -8.558 7.138 -9.603 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -7.026 7.432 -10.459 1.00 0.00 H new ATOM 630 N PHE B 4 -4.494 10.372 -9.333 1.00 0.00 N ATOM 631 CA PHE B 4 -3.057 10.234 -9.506 1.00 0.00 C ATOM 632 C PHE B 4 -2.506 9.377 -8.372 1.00 0.00 C ATOM 633 O PHE B 4 -2.101 9.885 -7.328 1.00 0.00 O ATOM 634 CB PHE B 4 -2.396 11.611 -9.472 1.00 0.00 C ATOM 635 CG PHE B 4 -2.563 12.481 -10.704 1.00 0.00 C ATOM 636 CD1 PHE B 4 -3.752 12.477 -11.445 1.00 0.00 C ATOM 637 CD2 PHE B 4 -1.506 13.309 -11.109 1.00 0.00 C ATOM 638 CE1 PHE B 4 -3.874 13.268 -12.595 1.00 0.00 C ATOM 639 CE2 PHE B 4 -1.628 14.107 -12.255 1.00 0.00 C ATOM 640 CZ PHE B 4 -2.812 14.084 -13.001 1.00 0.00 C ATOM 0 H PHE B 4 -4.756 10.981 -8.557 1.00 0.00 H new ATOM 0 HA PHE B 4 -2.846 9.763 -10.466 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -2.791 12.156 -8.615 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -1.329 11.471 -9.297 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -4.580 11.860 -11.128 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -0.592 13.332 -10.534 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -4.789 13.248 -13.169 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -0.808 14.740 -12.562 1.00 0.00 H new ATOM 0 HZ PHE B 4 -2.906 14.694 -13.887 1.00 0.00 H new ATOM 650 N VAL B 5 -2.490 8.065 -8.572 1.00 0.00 N ATOM 651 CA VAL B 5 -2.034 7.135 -7.550 1.00 0.00 C ATOM 652 C VAL B 5 -0.517 6.960 -7.633 1.00 0.00 C ATOM 653 O VAL B 5 -0.011 6.296 -8.538 1.00 0.00 O ATOM 654 CB VAL B 5 -2.740 5.782 -7.686 1.00 0.00 C ATOM 655 CG1 VAL B 5 -2.581 5.022 -6.373 1.00 0.00 C ATOM 656 CG2 VAL B 5 -4.238 5.939 -7.960 1.00 0.00 C ATOM 0 H VAL B 5 -2.790 7.620 -9.439 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.286 7.549 -6.574 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.290 5.251 -8.525 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -3.078 4.055 -6.450 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -1.522 4.870 -6.166 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -3.030 5.597 -5.563 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -4.697 4.954 -8.049 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -4.703 6.483 -7.138 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.382 6.492 -8.888 1.00 0.00 H new ATOM 666 N LYS B 6 0.217 7.556 -6.690 1.00 0.00 N ATOM 667 CA LYS B 6 1.665 7.439 -6.615 1.00 0.00 C ATOM 668 C LYS B 6 2.027 6.039 -6.140 1.00 0.00 C ATOM 669 O LYS B 6 1.541 5.581 -5.108 1.00 0.00 O ATOM 670 CB LYS B 6 2.190 8.491 -5.639 1.00 0.00 C ATOM 671 CG LYS B 6 3.662 8.245 -5.293 1.00 0.00 C ATOM 672 CD LYS B 6 4.642 8.624 -6.397 1.00 0.00 C ATOM 673 CE LYS B 6 4.708 10.136 -6.586 1.00 0.00 C ATOM 674 NZ LYS B 6 5.216 10.815 -5.377 1.00 0.00 N ATOM 0 H LYS B 6 -0.185 8.136 -5.954 1.00 0.00 H new ATOM 0 HA LYS B 6 2.116 7.603 -7.594 1.00 0.00 H new ATOM 0 HB2 LYS B 6 2.078 9.483 -6.076 1.00 0.00 H new ATOM 0 HB3 LYS B 6 1.592 8.475 -4.728 1.00 0.00 H new ATOM 0 HG2 LYS B 6 3.910 8.810 -4.394 1.00 0.00 H new ATOM 0 HG3 LYS B 6 3.794 7.190 -5.053 1.00 0.00 H new ATOM 0 HD2 LYS B 6 5.633 8.243 -6.153 1.00 0.00 H new ATOM 0 HD3 LYS B 6 4.340 8.152 -7.332 1.00 0.00 H new ATOM 0 HE2 LYS B 6 5.353 10.369 -7.433 1.00 0.00 H new ATOM 0 HE3 LYS B 6 3.715 10.516 -6.827 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 4.440 11.335 -4.919 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 5.597 10.108 -4.716 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 5.969 11.481 -5.643 1.00 0.00 H new ATOM 688 N THR B 7 2.888 5.378 -6.906 1.00 0.00 N ATOM 689 CA THR B 7 3.317 4.010 -6.652 1.00 0.00 C ATOM 690 C THR B 7 4.639 4.038 -5.886 1.00 0.00 C ATOM 691 O THR B 7 5.282 5.083 -5.797 1.00 0.00 O ATOM 692 CB THR B 7 3.457 3.280 -7.991 1.00 0.00 C ATOM 693 OG1 THR B 7 3.429 1.889 -7.775 1.00 0.00 O ATOM 694 CG2 THR B 7 4.773 3.621 -8.679 1.00 0.00 C ATOM 0 H THR B 7 3.315 5.787 -7.737 1.00 0.00 H new ATOM 0 HA THR B 7 2.584 3.477 -6.046 1.00 0.00 H new ATOM 0 HB THR B 7 2.629 3.596 -8.625 1.00 0.00 H new ATOM 0 HG1 THR B 7 3.517 1.423 -8.633 1.00 0.00 H new ATOM 0 HG21 THR B 7 4.838 3.085 -9.626 1.00 0.00 H new ATOM 0 HG22 THR B 7 4.819 4.694 -8.865 1.00 0.00 H new ATOM 0 HG23 THR B 7 5.605 3.328 -8.039 1.00 0.00 H new ATOM 702 N LEU B 8 5.039 2.890 -5.339 1.00 0.00 N ATOM 703 CA LEU B 8 6.220 2.726 -4.494 1.00 0.00 C ATOM 704 C LEU B 8 7.554 2.944 -5.221 1.00 0.00 C ATOM 705 O LEU B 8 8.593 2.546 -4.697 1.00 0.00 O ATOM 706 CB LEU B 8 6.157 1.318 -3.894 1.00 0.00 C ATOM 707 CG LEU B 8 5.037 1.159 -2.860 1.00 0.00 C ATOM 708 CD1 LEU B 8 5.069 -0.279 -2.348 1.00 0.00 C ATOM 709 CD2 LEU B 8 5.220 2.107 -1.674 1.00 0.00 C ATOM 0 H LEU B 8 4.530 2.017 -5.478 1.00 0.00 H new ATOM 0 HA LEU B 8 6.197 3.499 -3.726 1.00 0.00 H new ATOM 0 HB2 LEU B 8 6.010 0.594 -4.695 1.00 0.00 H new ATOM 0 HB3 LEU B 8 7.113 1.085 -3.425 1.00 0.00 H new ATOM 0 HG LEU B 8 4.086 1.397 -3.336 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.280 -0.420 -1.609 1.00 0.00 H new ATOM 0 HD12 LEU B 8 4.913 -0.965 -3.180 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.037 -0.480 -1.889 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.406 1.963 -0.964 1.00 0.00 H new ATOM 0 HD22 LEU B 8 6.170 1.897 -1.184 1.00 0.00 H new ATOM 0 HD23 LEU B 8 5.215 3.138 -2.028 1.00 0.00 H new ATOM 721 N THR B 9 7.561 3.562 -6.408 1.00 0.00 N ATOM 722 CA THR B 9 8.798 3.813 -7.149 1.00 0.00 C ATOM 723 C THR B 9 8.912 5.265 -7.623 1.00 0.00 C ATOM 724 O THR B 9 9.870 5.610 -8.314 1.00 0.00 O ATOM 725 CB THR B 9 8.916 2.854 -8.335 1.00 0.00 C ATOM 726 OG1 THR B 9 7.862 3.092 -9.243 1.00 0.00 O ATOM 727 CG2 THR B 9 8.865 1.400 -7.873 1.00 0.00 C ATOM 0 H THR B 9 6.719 3.898 -6.876 1.00 0.00 H new ATOM 0 HA THR B 9 9.624 3.635 -6.460 1.00 0.00 H new ATOM 0 HB THR B 9 9.876 3.030 -8.821 1.00 0.00 H new ATOM 0 HG1 THR B 9 7.940 2.478 -10.003 1.00 0.00 H new ATOM 0 HG21 THR B 9 8.951 0.741 -8.737 1.00 0.00 H new ATOM 0 HG22 THR B 9 9.689 1.207 -7.186 1.00 0.00 H new ATOM 0 HG23 THR B 9 7.918 1.212 -7.366 1.00 0.00 H new ATOM 735 N GLY B 10 7.946 6.118 -7.261 1.00 0.00 N ATOM 736 CA GLY B 10 7.984 7.539 -7.584 1.00 0.00 C ATOM 737 C GLY B 10 7.129 7.876 -8.804 1.00 0.00 C ATOM 738 O GLY B 10 7.028 9.042 -9.184 1.00 0.00 O ATOM 0 H GLY B 10 7.118 5.837 -6.736 1.00 0.00 H new ATOM 0 HA2 GLY B 10 7.634 8.114 -6.727 1.00 0.00 H new ATOM 0 HA3 GLY B 10 9.015 7.840 -7.770 1.00 0.00 H new ATOM 742 N LYS B 11 6.516 6.858 -9.418 1.00 0.00 N ATOM 743 CA LYS B 11 5.695 7.006 -10.602 1.00 0.00 C ATOM 744 C LYS B 11 4.257 7.244 -10.177 1.00 0.00 C ATOM 745 O LYS B 11 3.829 6.774 -9.126 1.00 0.00 O ATOM 746 CB LYS B 11 5.869 5.727 -11.431 1.00 0.00 C ATOM 747 CG LYS B 11 4.895 5.591 -12.600 1.00 0.00 C ATOM 748 CD LYS B 11 3.585 4.900 -12.201 1.00 0.00 C ATOM 749 CE LYS B 11 2.652 4.860 -13.414 1.00 0.00 C ATOM 750 NZ LYS B 11 3.166 3.959 -14.464 1.00 0.00 N ATOM 0 H LYS B 11 6.584 5.894 -9.092 1.00 0.00 H new ATOM 0 HA LYS B 11 5.988 7.860 -11.213 1.00 0.00 H new ATOM 0 HB2 LYS B 11 6.888 5.696 -11.818 1.00 0.00 H new ATOM 0 HB3 LYS B 11 5.751 4.865 -10.774 1.00 0.00 H new ATOM 0 HG2 LYS B 11 4.672 6.581 -12.999 1.00 0.00 H new ATOM 0 HG3 LYS B 11 5.371 5.024 -13.400 1.00 0.00 H new ATOM 0 HD2 LYS B 11 3.786 3.889 -11.847 1.00 0.00 H new ATOM 0 HD3 LYS B 11 3.111 5.437 -11.379 1.00 0.00 H new ATOM 0 HE2 LYS B 11 1.662 4.528 -13.102 1.00 0.00 H new ATOM 0 HE3 LYS B 11 2.538 5.865 -13.820 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 2.493 3.930 -15.256 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 4.085 4.309 -14.803 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 3.283 3.002 -14.074 1.00 0.00 H new ATOM 764 N THR B 12 3.503 7.974 -10.997 1.00 0.00 N ATOM 765 CA THR B 12 2.127 8.317 -10.686 1.00 0.00 C ATOM 766 C THR B 12 1.219 7.684 -11.725 1.00 0.00 C ATOM 767 O THR B 12 1.225 8.073 -12.892 1.00 0.00 O ATOM 768 CB THR B 12 1.982 9.836 -10.664 1.00 0.00 C ATOM 769 OG1 THR B 12 2.723 10.359 -9.587 1.00 0.00 O ATOM 770 CG2 THR B 12 0.520 10.241 -10.504 1.00 0.00 C ATOM 0 H THR B 12 3.832 8.340 -11.890 1.00 0.00 H new ATOM 0 HA THR B 12 1.844 7.937 -9.704 1.00 0.00 H new ATOM 0 HB THR B 12 2.354 10.232 -11.609 1.00 0.00 H new ATOM 0 HG1 THR B 12 2.633 11.335 -9.571 1.00 0.00 H new ATOM 0 HG21 THR B 12 0.443 11.328 -10.491 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.060 9.846 -11.338 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.131 9.839 -9.569 1.00 0.00 H new ATOM 778 N ILE B 13 0.437 6.697 -11.290 1.00 0.00 N ATOM 779 CA ILE B 13 -0.530 6.018 -12.126 1.00 0.00 C ATOM 780 C ILE B 13 -1.738 6.936 -12.241 1.00 0.00 C ATOM 781 O ILE B 13 -2.064 7.651 -11.295 1.00 0.00 O ATOM 782 CB ILE B 13 -0.944 4.689 -11.478 1.00 0.00 C ATOM 783 CG1 ILE B 13 0.253 3.932 -10.882 1.00 0.00 C ATOM 784 CG2 ILE B 13 -1.613 3.817 -12.539 1.00 0.00 C ATOM 785 CD1 ILE B 13 -0.214 2.761 -10.021 1.00 0.00 C ATOM 0 H ILE B 13 0.464 6.348 -10.332 1.00 0.00 H new ATOM 0 HA ILE B 13 -0.110 5.798 -13.108 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.629 4.911 -10.660 1.00 0.00 H new ATOM 0 HG12 ILE B 13 0.892 3.565 -11.685 1.00 0.00 H new ATOM 0 HG13 ILE B 13 0.855 4.613 -10.281 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -1.913 2.868 -12.094 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -2.492 4.329 -12.929 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -0.911 3.630 -13.352 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.653 2.242 -9.611 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.833 3.134 -9.205 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.796 2.070 -10.631 1.00 0.00 H new ATOM 797 N THR B 14 -2.402 6.918 -13.394 1.00 0.00 N ATOM 798 CA THR B 14 -3.548 7.782 -13.619 1.00 0.00 C ATOM 799 C THR B 14 -4.631 7.047 -14.402 1.00 0.00 C ATOM 800 O THR B 14 -4.445 6.738 -15.577 1.00 0.00 O ATOM 801 CB THR B 14 -3.111 9.055 -14.348 1.00 0.00 C ATOM 802 OG1 THR B 14 -1.991 9.629 -13.709 1.00 0.00 O ATOM 803 CG2 THR B 14 -4.249 10.067 -14.319 1.00 0.00 C ATOM 0 H THR B 14 -2.164 6.315 -14.182 1.00 0.00 H new ATOM 0 HA THR B 14 -3.969 8.065 -12.654 1.00 0.00 H new ATOM 0 HB THR B 14 -2.852 8.796 -15.375 1.00 0.00 H new ATOM 0 HG1 THR B 14 -1.722 10.441 -14.187 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.942 10.975 -14.837 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.124 9.645 -14.814 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.497 10.306 -13.285 1.00 0.00 H new ATOM 811 N LEU B 15 -5.756 6.774 -13.741 1.00 0.00 N ATOM 812 CA LEU B 15 -6.881 6.040 -14.299 1.00 0.00 C ATOM 813 C LEU B 15 -8.182 6.662 -13.835 1.00 0.00 C ATOM 814 O LEU B 15 -8.272 7.275 -12.772 1.00 0.00 O ATOM 815 CB LEU B 15 -6.790 4.523 -14.009 1.00 0.00 C ATOM 816 CG LEU B 15 -6.457 4.043 -12.588 1.00 0.00 C ATOM 817 CD1 LEU B 15 -5.095 4.508 -12.087 1.00 0.00 C ATOM 818 CD2 LEU B 15 -7.525 4.444 -11.580 1.00 0.00 C ATOM 0 H LEU B 15 -5.909 7.067 -12.776 1.00 0.00 H new ATOM 0 HA LEU B 15 -6.848 6.121 -15.385 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -7.746 4.079 -14.288 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -6.038 4.107 -14.679 1.00 0.00 H new ATOM 0 HG LEU B 15 -6.427 2.956 -12.669 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -4.930 4.131 -11.078 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -4.315 4.129 -12.748 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -5.064 5.598 -12.076 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -7.245 4.083 -10.590 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -7.615 5.530 -11.558 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -8.481 4.007 -11.869 1.00 0.00 H new ATOM 830 N GLU B 16 -9.197 6.491 -14.673 1.00 0.00 N ATOM 831 CA GLU B 16 -10.458 7.164 -14.513 1.00 0.00 C ATOM 832 C GLU B 16 -11.323 6.406 -13.530 1.00 0.00 C ATOM 833 O GLU B 16 -11.207 5.192 -13.388 1.00 0.00 O ATOM 834 CB GLU B 16 -11.165 7.221 -15.860 1.00 0.00 C ATOM 835 CG GLU B 16 -10.298 7.901 -16.915 1.00 0.00 C ATOM 836 CD GLU B 16 -9.079 7.082 -17.333 1.00 0.00 C ATOM 837 OE1 GLU B 16 -9.251 5.877 -17.623 1.00 0.00 O ATOM 838 OE2 GLU B 16 -7.975 7.671 -17.355 1.00 0.00 O ATOM 0 H GLU B 16 -9.157 5.875 -15.485 1.00 0.00 H new ATOM 0 HA GLU B 16 -10.285 8.173 -14.138 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -11.412 6.211 -16.186 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.106 7.762 -15.756 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -10.907 8.104 -17.796 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -9.962 8.864 -16.530 1.00 0.00 H new ATOM 845 N VAL B 17 -12.198 7.132 -12.849 1.00 0.00 N ATOM 846 CA VAL B 17 -13.062 6.529 -11.849 1.00 0.00 C ATOM 847 C VAL B 17 -14.245 7.432 -11.547 1.00 0.00 C ATOM 848 O VAL B 17 -14.315 8.567 -12.016 1.00 0.00 O ATOM 849 CB VAL B 17 -12.235 6.180 -10.604 1.00 0.00 C ATOM 850 CG1 VAL B 17 -11.520 7.408 -10.047 1.00 0.00 C ATOM 851 CG2 VAL B 17 -13.010 5.438 -9.522 1.00 0.00 C ATOM 0 H VAL B 17 -12.327 8.136 -12.971 1.00 0.00 H new ATOM 0 HA VAL B 17 -13.483 5.599 -12.231 1.00 0.00 H new ATOM 0 HB VAL B 17 -11.482 5.471 -10.947 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -10.944 7.125 -9.166 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -10.849 7.813 -10.805 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -12.256 8.164 -9.772 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -12.351 5.231 -8.679 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -13.845 6.052 -9.187 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -13.389 4.499 -9.925 1.00 0.00 H new ATOM 861 N GLU B 18 -15.172 6.907 -10.757 1.00 0.00 N ATOM 862 CA GLU B 18 -16.445 7.560 -10.492 1.00 0.00 C ATOM 863 C GLU B 18 -16.824 7.455 -9.021 1.00 0.00 C ATOM 864 O GLU B 18 -16.337 6.572 -8.318 1.00 0.00 O ATOM 865 CB GLU B 18 -17.537 6.898 -11.340 1.00 0.00 C ATOM 866 CG GLU B 18 -17.242 7.046 -12.831 1.00 0.00 C ATOM 867 CD GLU B 18 -18.355 6.433 -13.682 1.00 0.00 C ATOM 868 OE1 GLU B 18 -19.500 6.928 -13.578 1.00 0.00 O ATOM 869 OE2 GLU B 18 -18.057 5.477 -14.434 1.00 0.00 O ATOM 0 H GLU B 18 -15.061 6.012 -10.280 1.00 0.00 H new ATOM 0 HA GLU B 18 -16.349 8.615 -10.748 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -17.610 5.841 -11.084 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -18.503 7.349 -11.111 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -17.132 8.102 -13.079 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -16.294 6.563 -13.066 1.00 0.00 H new ATOM 876 N PRO B 19 -17.700 8.349 -8.548 1.00 0.00 N ATOM 877 CA PRO B 19 -18.227 8.328 -7.193 1.00 0.00 C ATOM 878 C PRO B 19 -19.193 7.167 -6.994 1.00 0.00 C ATOM 879 O PRO B 19 -19.842 7.077 -5.952 1.00 0.00 O ATOM 880 CB PRO B 19 -18.939 9.663 -7.016 1.00 0.00 C ATOM 881 CG PRO B 19 -19.372 10.027 -8.433 1.00 0.00 C ATOM 882 CD PRO B 19 -18.256 9.457 -9.302 1.00 0.00 C ATOM 0 HA PRO B 19 -17.434 8.190 -6.458 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -19.794 9.576 -6.345 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -18.277 10.418 -6.592 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -20.339 9.589 -8.683 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -19.468 11.105 -8.559 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -18.642 9.121 -10.265 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -17.496 10.211 -9.508 1.00 0.00 H new ATOM 890 N SER B 20 -19.291 6.278 -7.985 1.00 0.00 N ATOM 891 CA SER B 20 -20.140 5.102 -7.909 1.00 0.00 C ATOM 892 C SER B 20 -19.307 3.839 -8.087 1.00 0.00 C ATOM 893 O SER B 20 -19.832 2.733 -7.976 1.00 0.00 O ATOM 894 CB SER B 20 -21.260 5.190 -8.942 1.00 0.00 C ATOM 895 OG SER B 20 -22.014 6.370 -8.745 1.00 0.00 O ATOM 0 H SER B 20 -18.779 6.360 -8.863 1.00 0.00 H new ATOM 0 HA SER B 20 -20.603 5.057 -6.923 1.00 0.00 H new ATOM 0 HB2 SER B 20 -20.839 5.182 -9.947 1.00 0.00 H new ATOM 0 HB3 SER B 20 -21.908 4.318 -8.861 1.00 0.00 H new ATOM 0 HG SER B 20 -22.729 6.417 -9.414 1.00 0.00 H new ATOM 901 N ASP B 21 -18.009 3.998 -8.364 1.00 0.00 N ATOM 902 CA ASP B 21 -17.073 2.905 -8.297 1.00 0.00 C ATOM 903 C ASP B 21 -16.616 2.836 -6.845 1.00 0.00 C ATOM 904 O ASP B 21 -16.993 3.657 -6.010 1.00 0.00 O ATOM 905 CB ASP B 21 -15.877 3.144 -9.215 1.00 0.00 C ATOM 906 CG ASP B 21 -16.261 3.311 -10.682 1.00 0.00 C ATOM 907 OD1 ASP B 21 -17.363 2.854 -11.059 1.00 0.00 O ATOM 908 OD2 ASP B 21 -15.440 3.900 -11.419 1.00 0.00 O ATOM 0 H ASP B 21 -17.593 4.888 -8.638 1.00 0.00 H new ATOM 0 HA ASP B 21 -17.537 1.974 -8.623 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -15.346 4.036 -8.883 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -15.184 2.308 -9.122 1.00 0.00 H new ATOM 913 N THR B 22 -15.793 1.844 -6.563 1.00 0.00 N ATOM 914 CA THR B 22 -15.341 1.496 -5.227 1.00 0.00 C ATOM 915 C THR B 22 -13.843 1.238 -5.254 1.00 0.00 C ATOM 916 O THR B 22 -13.252 1.147 -6.330 1.00 0.00 O ATOM 917 CB THR B 22 -16.122 0.269 -4.730 1.00 0.00 C ATOM 918 OG1 THR B 22 -15.580 -0.206 -3.516 1.00 0.00 O ATOM 919 CG2 THR B 22 -16.089 -0.870 -5.750 1.00 0.00 C ATOM 0 H THR B 22 -15.406 1.235 -7.284 1.00 0.00 H new ATOM 0 HA THR B 22 -15.528 2.317 -4.535 1.00 0.00 H new ATOM 0 HB THR B 22 -17.154 0.589 -4.583 1.00 0.00 H new ATOM 0 HG1 THR B 22 -15.886 0.361 -2.777 1.00 0.00 H new ATOM 0 HG21 THR B 22 -16.651 -1.720 -5.364 1.00 0.00 H new ATOM 0 HG22 THR B 22 -16.536 -0.534 -6.686 1.00 0.00 H new ATOM 0 HG23 THR B 22 -15.056 -1.169 -5.928 1.00 0.00 H new ATOM 927 N ILE B 23 -13.219 1.120 -4.081 1.00 0.00 N ATOM 928 CA ILE B 23 -11.798 0.849 -3.996 1.00 0.00 C ATOM 929 C ILE B 23 -11.482 -0.467 -4.701 1.00 0.00 C ATOM 930 O ILE B 23 -10.409 -0.624 -5.276 1.00 0.00 O ATOM 931 CB ILE B 23 -11.379 0.795 -2.525 1.00 0.00 C ATOM 932 CG1 ILE B 23 -11.808 2.042 -1.751 1.00 0.00 C ATOM 933 CG2 ILE B 23 -9.864 0.664 -2.441 1.00 0.00 C ATOM 934 CD1 ILE B 23 -11.425 3.340 -2.472 1.00 0.00 C ATOM 0 H ILE B 23 -13.685 1.210 -3.178 1.00 0.00 H new ATOM 0 HA ILE B 23 -11.239 1.644 -4.489 1.00 0.00 H new ATOM 0 HB ILE B 23 -11.874 -0.065 -2.075 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -12.887 2.019 -1.600 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -11.347 2.029 -0.763 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -9.560 0.625 -1.395 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -9.549 -0.250 -2.945 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -9.397 1.523 -2.923 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -11.752 4.195 -1.880 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -10.343 3.380 -2.600 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -11.907 3.369 -3.449 1.00 0.00 H new ATOM 946 N GLU B 24 -12.422 -1.417 -4.663 1.00 0.00 N ATOM 947 CA GLU B 24 -12.265 -2.681 -5.362 1.00 0.00 C ATOM 948 C GLU B 24 -12.144 -2.437 -6.866 1.00 0.00 C ATOM 949 O GLU B 24 -11.467 -3.191 -7.562 1.00 0.00 O ATOM 950 CB GLU B 24 -13.457 -3.581 -5.028 1.00 0.00 C ATOM 951 CG GLU B 24 -13.484 -4.794 -5.954 1.00 0.00 C ATOM 952 CD GLU B 24 -14.474 -5.845 -5.464 1.00 0.00 C ATOM 953 OE1 GLU B 24 -15.694 -5.585 -5.569 1.00 0.00 O ATOM 954 OE2 GLU B 24 -14.007 -6.906 -4.990 1.00 0.00 O ATOM 0 H GLU B 24 -13.300 -1.327 -4.152 1.00 0.00 H new ATOM 0 HA GLU B 24 -11.351 -3.181 -5.040 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -13.394 -3.909 -3.990 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -14.385 -3.018 -5.128 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -13.755 -4.479 -6.962 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -12.487 -5.231 -6.014 1.00 0.00 H new ATOM 961 N ASN B 25 -12.797 -1.387 -7.375 1.00 0.00 N ATOM 962 CA ASN B 25 -12.689 -1.030 -8.778 1.00 0.00 C ATOM 963 C ASN B 25 -11.335 -0.390 -9.035 1.00 0.00 C ATOM 964 O ASN B 25 -10.671 -0.729 -10.010 1.00 0.00 O ATOM 965 CB ASN B 25 -13.792 -0.044 -9.186 1.00 0.00 C ATOM 966 CG ASN B 25 -14.193 -0.232 -10.641 1.00 0.00 C ATOM 967 OD1 ASN B 25 -13.363 -0.511 -11.501 1.00 0.00 O ATOM 968 ND2 ASN B 25 -15.481 -0.081 -10.922 1.00 0.00 N ATOM 0 H ASN B 25 -13.404 -0.775 -6.830 1.00 0.00 H new ATOM 0 HA ASN B 25 -12.798 -1.939 -9.369 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -14.663 -0.185 -8.546 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -13.444 0.978 -9.032 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -15.811 -0.197 -11.880 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -16.141 0.151 -10.180 1.00 0.00 H new ATOM 975 N VAL B 26 -10.917 0.533 -8.161 1.00 0.00 N ATOM 976 CA VAL B 26 -9.665 1.255 -8.339 1.00 0.00 C ATOM 977 C VAL B 26 -8.506 0.266 -8.391 1.00 0.00 C ATOM 978 O VAL B 26 -7.586 0.447 -9.184 1.00 0.00 O ATOM 979 CB VAL B 26 -9.487 2.271 -7.205 1.00 0.00 C ATOM 980 CG1 VAL B 26 -8.148 2.993 -7.321 1.00 0.00 C ATOM 981 CG2 VAL B 26 -10.596 3.320 -7.269 1.00 0.00 C ATOM 0 H VAL B 26 -11.435 0.794 -7.322 1.00 0.00 H new ATOM 0 HA VAL B 26 -9.684 1.803 -9.281 1.00 0.00 H new ATOM 0 HB VAL B 26 -9.526 1.725 -6.263 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -8.048 3.708 -6.504 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -7.337 2.266 -7.269 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -8.101 3.521 -8.273 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -10.464 4.039 -6.461 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -10.551 3.839 -8.227 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -11.565 2.832 -7.166 1.00 0.00 H new ATOM 991 N LYS B 27 -8.544 -0.779 -7.560 1.00 0.00 N ATOM 992 CA LYS B 27 -7.525 -1.818 -7.608 1.00 0.00 C ATOM 993 C LYS B 27 -7.543 -2.530 -8.956 1.00 0.00 C ATOM 994 O LYS B 27 -6.496 -2.953 -9.440 1.00 0.00 O ATOM 995 CB LYS B 27 -7.749 -2.831 -6.482 1.00 0.00 C ATOM 996 CG LYS B 27 -7.558 -2.206 -5.100 1.00 0.00 C ATOM 997 CD LYS B 27 -7.998 -3.210 -4.033 1.00 0.00 C ATOM 998 CE LYS B 27 -7.777 -2.632 -2.636 1.00 0.00 C ATOM 999 NZ LYS B 27 -8.322 -3.532 -1.601 1.00 0.00 N ATOM 0 H LYS B 27 -9.265 -0.923 -6.853 1.00 0.00 H new ATOM 0 HA LYS B 27 -6.551 -1.347 -7.477 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -8.756 -3.240 -6.558 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -7.057 -3.664 -6.601 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -6.513 -1.933 -4.952 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -8.142 -1.289 -5.018 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -9.051 -3.457 -4.169 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -7.436 -4.137 -4.143 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -6.711 -2.479 -2.466 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -8.255 -1.655 -2.562 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -8.057 -3.179 -0.659 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -9.359 -3.564 -1.680 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -7.935 -4.488 -1.734 1.00 0.00 H new ATOM 1013 N ALA B 28 -8.717 -2.666 -9.576 1.00 0.00 N ATOM 1014 CA ALA B 28 -8.837 -3.317 -10.869 1.00 0.00 C ATOM 1015 C ALA B 28 -8.311 -2.414 -11.985 1.00 0.00 C ATOM 1016 O ALA B 28 -7.753 -2.914 -12.960 1.00 0.00 O ATOM 1017 CB ALA B 28 -10.309 -3.676 -11.110 1.00 0.00 C ATOM 0 H ALA B 28 -9.601 -2.329 -9.194 1.00 0.00 H new ATOM 0 HA ALA B 28 -8.235 -4.226 -10.873 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -10.410 -4.166 -12.079 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -10.652 -4.350 -10.325 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -10.912 -2.768 -11.098 1.00 0.00 H new ATOM 1023 N LYS B 29 -8.473 -1.088 -11.865 1.00 0.00 N ATOM 1024 CA LYS B 29 -7.915 -0.166 -12.851 1.00 0.00 C ATOM 1025 C LYS B 29 -6.401 -0.086 -12.699 1.00 0.00 C ATOM 1026 O LYS B 29 -5.689 0.092 -13.682 1.00 0.00 O ATOM 1027 CB LYS B 29 -8.542 1.226 -12.717 1.00 0.00 C ATOM 1028 CG LYS B 29 -10.030 1.118 -12.402 1.00 0.00 C ATOM 1029 CD LYS B 29 -10.822 2.374 -12.723 1.00 0.00 C ATOM 1030 CE LYS B 29 -12.260 2.160 -12.245 1.00 0.00 C ATOM 1031 NZ LYS B 29 -13.149 3.202 -12.784 1.00 0.00 N ATOM 0 H LYS B 29 -8.981 -0.639 -11.103 1.00 0.00 H new ATOM 0 HA LYS B 29 -8.149 -0.546 -13.846 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -8.037 1.783 -11.928 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -8.401 1.785 -13.642 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -10.450 0.283 -12.963 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -10.151 0.885 -11.344 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -10.381 3.240 -12.229 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -10.802 2.574 -13.794 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -12.611 1.177 -12.560 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -12.292 2.176 -11.156 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -13.794 3.529 -12.036 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.579 4.002 -13.125 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -13.703 2.812 -13.572 1.00 0.00 H new ATOM 1045 N ILE B 30 -5.899 -0.221 -11.469 1.00 0.00 N ATOM 1046 CA ILE B 30 -4.463 -0.265 -11.218 1.00 0.00 C ATOM 1047 C ILE B 30 -3.906 -1.608 -11.684 1.00 0.00 C ATOM 1048 O ILE B 30 -2.749 -1.693 -12.090 1.00 0.00 O ATOM 1049 CB ILE B 30 -4.205 -0.055 -9.722 1.00 0.00 C ATOM 1050 CG1 ILE B 30 -4.565 1.387 -9.352 1.00 0.00 C ATOM 1051 CG2 ILE B 30 -2.737 -0.326 -9.376 1.00 0.00 C ATOM 1052 CD1 ILE B 30 -4.667 1.555 -7.836 1.00 0.00 C ATOM 0 H ILE B 30 -6.473 -0.302 -10.629 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.961 0.527 -11.773 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.822 -0.753 -9.156 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.810 2.067 -9.747 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.513 1.659 -9.816 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.580 -0.170 -8.309 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.487 -1.355 -9.633 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -2.099 0.354 -9.940 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -4.924 2.588 -7.601 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -5.440 0.892 -7.448 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.710 1.305 -7.377 1.00 0.00 H new ATOM 1064 N GLN B 31 -4.722 -2.664 -11.629 1.00 0.00 N ATOM 1065 CA GLN B 31 -4.322 -3.965 -12.135 1.00 0.00 C ATOM 1066 C GLN B 31 -4.237 -3.935 -13.665 1.00 0.00 C ATOM 1067 O GLN B 31 -3.693 -4.837 -14.296 1.00 0.00 O ATOM 1068 CB GLN B 31 -5.305 -5.031 -11.647 1.00 0.00 C ATOM 1069 CG GLN B 31 -4.778 -6.363 -12.156 1.00 0.00 C ATOM 1070 CD GLN B 31 -5.307 -7.580 -11.423 1.00 0.00 C ATOM 1071 OE1 GLN B 31 -6.472 -7.639 -11.035 1.00 0.00 O ATOM 1072 NE2 GLN B 31 -4.437 -8.568 -11.234 1.00 0.00 N ATOM 0 H GLN B 31 -5.663 -2.636 -11.237 1.00 0.00 H new ATOM 0 HA GLN B 31 -3.332 -4.216 -11.755 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -5.372 -5.029 -10.559 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -6.308 -4.839 -12.028 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -5.028 -6.456 -13.213 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -3.690 -6.358 -12.085 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -3.479 -8.476 -11.573 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -4.727 -9.418 -10.750 1.00 0.00 H new ATOM 1081 N ASP B 32 -4.780 -2.883 -14.267 1.00 0.00 N ATOM 1082 CA ASP B 32 -4.728 -2.676 -15.704 1.00 0.00 C ATOM 1083 C ASP B 32 -3.500 -1.850 -16.058 1.00 0.00 C ATOM 1084 O ASP B 32 -2.837 -2.094 -17.065 1.00 0.00 O ATOM 1085 CB ASP B 32 -5.968 -1.889 -16.115 1.00 0.00 C ATOM 1086 CG ASP B 32 -6.411 -2.247 -17.530 1.00 0.00 C ATOM 1087 OD1 ASP B 32 -7.035 -3.320 -17.686 1.00 0.00 O ATOM 1088 OD2 ASP B 32 -6.125 -1.445 -18.447 1.00 0.00 O ATOM 0 H ASP B 32 -5.272 -2.145 -13.764 1.00 0.00 H new ATOM 0 HA ASP B 32 -4.684 -3.638 -16.215 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -6.779 -2.093 -15.416 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.759 -0.821 -16.057 1.00 0.00 H new ATOM 1093 N LYS B 33 -3.215 -0.866 -15.203 1.00 0.00 N ATOM 1094 CA LYS B 33 -2.122 0.072 -15.380 1.00 0.00 C ATOM 1095 C LYS B 33 -0.765 -0.505 -15.001 1.00 0.00 C ATOM 1096 O LYS B 33 0.246 -0.110 -15.579 1.00 0.00 O ATOM 1097 CB LYS B 33 -2.409 1.277 -14.488 1.00 0.00 C ATOM 1098 CG LYS B 33 -3.536 2.155 -15.032 1.00 0.00 C ATOM 1099 CD LYS B 33 -3.117 2.851 -16.324 1.00 0.00 C ATOM 1100 CE LYS B 33 -4.121 3.963 -16.609 1.00 0.00 C ATOM 1101 NZ LYS B 33 -3.887 4.586 -17.926 1.00 0.00 N ATOM 0 H LYS B 33 -3.753 -0.702 -14.352 1.00 0.00 H new ATOM 0 HA LYS B 33 -2.067 0.333 -16.437 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -2.673 0.930 -13.489 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -1.503 1.875 -14.389 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -4.420 1.545 -15.215 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -3.812 2.901 -14.287 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -2.112 3.261 -16.227 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -3.092 2.139 -17.149 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.132 3.558 -16.573 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.054 4.723 -15.830 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.589 5.337 -18.084 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -2.931 4.994 -17.952 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -3.976 3.866 -18.671 1.00 0.00 H new ATOM 1115 N GLU B 34 -0.733 -1.432 -14.043 1.00 0.00 N ATOM 1116 CA GLU B 34 0.517 -2.007 -13.555 1.00 0.00 C ATOM 1117 C GLU B 34 0.476 -3.531 -13.438 1.00 0.00 C ATOM 1118 O GLU B 34 1.518 -4.160 -13.276 1.00 0.00 O ATOM 1119 CB GLU B 34 0.805 -1.422 -12.178 1.00 0.00 C ATOM 1120 CG GLU B 34 1.158 0.065 -12.234 1.00 0.00 C ATOM 1121 CD GLU B 34 2.464 0.335 -12.981 1.00 0.00 C ATOM 1122 OE1 GLU B 34 3.326 -0.572 -13.008 1.00 0.00 O ATOM 1123 OE2 GLU B 34 2.591 1.456 -13.522 1.00 0.00 O ATOM 0 H GLU B 34 -1.567 -1.802 -13.587 1.00 0.00 H new ATOM 0 HA GLU B 34 1.294 -1.762 -14.279 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -0.067 -1.561 -11.538 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.628 -1.970 -11.719 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.348 0.608 -12.720 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.238 0.453 -11.219 1.00 0.00 H new ATOM 1130 N GLY B 35 -0.712 -4.133 -13.520 1.00 0.00 N ATOM 1131 CA GLY B 35 -0.848 -5.584 -13.417 1.00 0.00 C ATOM 1132 C GLY B 35 -0.698 -6.063 -11.977 1.00 0.00 C ATOM 1133 O GLY B 35 -0.464 -7.246 -11.741 1.00 0.00 O ATOM 0 H GLY B 35 -1.593 -3.637 -13.657 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -1.822 -5.887 -13.802 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -0.095 -6.065 -14.041 1.00 0.00 H new ATOM 1137 N ILE B 36 -0.832 -5.149 -11.013 1.00 0.00 N ATOM 1138 CA ILE B 36 -0.660 -5.476 -9.605 1.00 0.00 C ATOM 1139 C ILE B 36 -1.896 -6.228 -9.125 1.00 0.00 C ATOM 1140 O ILE B 36 -3.016 -5.828 -9.441 1.00 0.00 O ATOM 1141 CB ILE B 36 -0.468 -4.188 -8.802 1.00 0.00 C ATOM 1142 CG1 ILE B 36 0.867 -3.550 -9.197 1.00 0.00 C ATOM 1143 CG2 ILE B 36 -0.464 -4.462 -7.295 1.00 0.00 C ATOM 1144 CD1 ILE B 36 0.902 -2.073 -8.804 1.00 0.00 C ATOM 0 H ILE B 36 -1.061 -4.171 -11.189 1.00 0.00 H new ATOM 0 HA ILE B 36 0.220 -6.104 -9.465 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.298 -3.518 -9.025 1.00 0.00 H new ATOM 0 HG12 ILE B 36 1.686 -4.080 -8.710 1.00 0.00 H new ATOM 0 HG13 ILE B 36 1.018 -3.648 -10.272 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -0.326 -3.525 -6.755 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.414 -4.911 -7.004 1.00 0.00 H new ATOM 0 HG23 ILE B 36 0.350 -5.145 -7.051 1.00 0.00 H new ATOM 0 HD11 ILE B 36 1.860 -1.642 -9.095 1.00 0.00 H new ATOM 0 HD12 ILE B 36 0.096 -1.542 -9.311 1.00 0.00 H new ATOM 0 HD13 ILE B 36 0.775 -1.980 -7.725 1.00 0.00 H new ATOM 1156 N PRO B 37 -1.716 -7.313 -8.366 1.00 0.00 N ATOM 1157 CA PRO B 37 -2.817 -8.105 -7.865 1.00 0.00 C ATOM 1158 C PRO B 37 -3.586 -7.323 -6.806 1.00 0.00 C ATOM 1159 O PRO B 37 -2.991 -6.869 -5.829 1.00 0.00 O ATOM 1160 CB PRO B 37 -2.175 -9.358 -7.269 1.00 0.00 C ATOM 1161 CG PRO B 37 -0.758 -8.915 -6.906 1.00 0.00 C ATOM 1162 CD PRO B 37 -0.434 -7.845 -7.944 1.00 0.00 C ATOM 0 HA PRO B 37 -3.533 -8.360 -8.646 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -2.720 -9.707 -6.392 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -2.165 -10.180 -7.985 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -0.711 -8.516 -5.893 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -0.054 -9.746 -6.955 1.00 0.00 H new ATOM 0 HD2 PRO B 37 0.194 -7.063 -7.518 1.00 0.00 H new ATOM 0 HD3 PRO B 37 0.112 -8.269 -8.787 1.00 0.00 H new ATOM 1170 N PRO B 38 -4.905 -7.160 -6.977 1.00 0.00 N ATOM 1171 CA PRO B 38 -5.779 -6.548 -5.987 1.00 0.00 C ATOM 1172 C PRO B 38 -5.646 -7.211 -4.617 1.00 0.00 C ATOM 1173 O PRO B 38 -5.972 -6.598 -3.603 1.00 0.00 O ATOM 1174 CB PRO B 38 -7.200 -6.692 -6.540 1.00 0.00 C ATOM 1175 CG PRO B 38 -7.074 -7.769 -7.616 1.00 0.00 C ATOM 1176 CD PRO B 38 -5.671 -7.549 -8.144 1.00 0.00 C ATOM 0 HA PRO B 38 -5.514 -5.503 -5.828 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -7.903 -6.987 -5.761 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -7.563 -5.752 -6.957 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -7.199 -8.770 -7.204 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -7.824 -7.650 -8.398 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -5.271 -8.455 -8.598 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -5.651 -6.773 -8.909 1.00 0.00 H new ATOM 1184 N ASP B 39 -5.169 -8.457 -4.581 1.00 0.00 N ATOM 1185 CA ASP B 39 -4.932 -9.168 -3.335 1.00 0.00 C ATOM 1186 C ASP B 39 -3.809 -8.525 -2.515 1.00 0.00 C ATOM 1187 O ASP B 39 -3.780 -8.681 -1.296 1.00 0.00 O ATOM 1188 CB ASP B 39 -4.606 -10.627 -3.643 1.00 0.00 C ATOM 1189 CG ASP B 39 -4.503 -11.453 -2.362 1.00 0.00 C ATOM 1190 OD1 ASP B 39 -5.572 -11.782 -1.801 1.00 0.00 O ATOM 1191 OD2 ASP B 39 -3.357 -11.750 -1.957 1.00 0.00 O ATOM 0 H ASP B 39 -4.938 -8.996 -5.416 1.00 0.00 H new ATOM 0 HA ASP B 39 -5.837 -9.114 -2.730 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -5.378 -11.046 -4.288 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -3.666 -10.684 -4.192 1.00 0.00 H new ATOM 1196 N GLN B 40 -2.885 -7.802 -3.163 1.00 0.00 N ATOM 1197 CA GLN B 40 -1.846 -7.074 -2.441 1.00 0.00 C ATOM 1198 C GLN B 40 -2.148 -5.586 -2.351 1.00 0.00 C ATOM 1199 O GLN B 40 -1.558 -4.902 -1.515 1.00 0.00 O ATOM 1200 CB GLN B 40 -0.497 -7.175 -3.146 1.00 0.00 C ATOM 1201 CG GLN B 40 0.150 -8.547 -3.003 1.00 0.00 C ATOM 1202 CD GLN B 40 1.629 -8.469 -3.372 1.00 0.00 C ATOM 1203 OE1 GLN B 40 2.290 -7.468 -3.119 1.00 0.00 O ATOM 1204 NE2 GLN B 40 2.157 -9.525 -3.975 1.00 0.00 N ATOM 0 H GLN B 40 -2.840 -7.709 -4.178 1.00 0.00 H new ATOM 0 HA GLN B 40 -1.817 -7.530 -1.451 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -0.629 -6.951 -4.204 1.00 0.00 H new ATOM 0 HB3 GLN B 40 0.175 -6.419 -2.741 1.00 0.00 H new ATOM 0 HG2 GLN B 40 0.041 -8.904 -1.979 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -0.356 -9.266 -3.647 1.00 0.00 H new ATOM 0 HE21 GLN B 40 1.579 -10.342 -4.171 1.00 0.00 H new ATOM 0 HE22 GLN B 40 3.141 -9.520 -4.243 1.00 0.00 H new ATOM 1213 N GLN B 41 -3.045 -5.070 -3.188 1.00 0.00 N ATOM 1214 CA GLN B 41 -3.224 -3.634 -3.252 1.00 0.00 C ATOM 1215 C GLN B 41 -3.812 -3.060 -1.972 1.00 0.00 C ATOM 1216 O GLN B 41 -4.781 -3.569 -1.416 1.00 0.00 O ATOM 1217 CB GLN B 41 -4.088 -3.237 -4.443 1.00 0.00 C ATOM 1218 CG GLN B 41 -3.315 -3.459 -5.740 1.00 0.00 C ATOM 1219 CD GLN B 41 -4.001 -2.777 -6.913 1.00 0.00 C ATOM 1220 OE1 GLN B 41 -4.392 -1.619 -6.815 1.00 0.00 O ATOM 1221 NE2 GLN B 41 -4.153 -3.480 -8.029 1.00 0.00 N ATOM 0 H GLN B 41 -3.641 -5.613 -3.813 1.00 0.00 H new ATOM 0 HA GLN B 41 -2.228 -3.210 -3.377 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -5.005 -3.826 -4.451 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -4.381 -2.191 -4.358 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -2.302 -3.072 -5.633 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -3.229 -4.528 -5.937 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -3.816 -4.441 -8.076 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -4.607 -3.059 -8.839 1.00 0.00 H new ATOM 1230 N ARG B 42 -3.181 -1.970 -1.538 1.00 0.00 N ATOM 1231 CA ARG B 42 -3.648 -1.088 -0.483 1.00 0.00 C ATOM 1232 C ARG B 42 -3.417 0.327 -0.991 1.00 0.00 C ATOM 1233 O ARG B 42 -2.476 0.555 -1.750 1.00 0.00 O ATOM 1234 CB ARG B 42 -2.821 -1.296 0.786 1.00 0.00 C ATOM 1235 CG ARG B 42 -3.074 -2.651 1.444 1.00 0.00 C ATOM 1236 CD ARG B 42 -2.083 -2.844 2.592 1.00 0.00 C ATOM 1237 NE ARG B 42 -2.158 -1.751 3.573 1.00 0.00 N ATOM 1238 CZ ARG B 42 -1.265 -1.567 4.548 1.00 0.00 C ATOM 1239 NH1 ARG B 42 -0.225 -2.384 4.688 1.00 0.00 N ATOM 1240 NH2 ARG B 42 -1.404 -0.556 5.399 1.00 0.00 N ATOM 0 H ARG B 42 -2.290 -1.669 -1.934 1.00 0.00 H new ATOM 0 HA ARG B 42 -4.694 -1.281 -0.245 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -1.762 -1.208 0.542 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -3.051 -0.503 1.498 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -4.097 -2.702 1.818 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -2.962 -3.451 0.712 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -2.285 -3.793 3.090 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -1.071 -2.903 2.191 1.00 0.00 H new ATOM 0 HE ARG B 42 -2.937 -1.096 3.504 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -0.100 -3.166 4.045 1.00 0.00 H new ATOM 0 HH12 ARG B 42 0.448 -2.229 5.439 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -2.195 0.082 5.308 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -0.720 -0.418 6.143 1.00 0.00 H new ATOM 1254 N LEU B 43 -4.260 1.272 -0.582 1.00 0.00 N ATOM 1255 CA LEU B 43 -4.102 2.651 -1.005 1.00 0.00 C ATOM 1256 C LEU B 43 -4.501 3.593 0.122 1.00 0.00 C ATOM 1257 O LEU B 43 -5.195 3.196 1.058 1.00 0.00 O ATOM 1258 CB LEU B 43 -4.882 2.909 -2.303 1.00 0.00 C ATOM 1259 CG LEU B 43 -6.384 3.146 -2.115 1.00 0.00 C ATOM 1260 CD1 LEU B 43 -7.029 3.287 -3.493 1.00 0.00 C ATOM 1261 CD2 LEU B 43 -7.081 2.004 -1.386 1.00 0.00 C ATOM 0 H LEU B 43 -5.053 1.105 0.038 1.00 0.00 H new ATOM 0 HA LEU B 43 -3.053 2.846 -1.228 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -4.451 3.777 -2.802 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -4.744 2.057 -2.969 1.00 0.00 H new ATOM 0 HG LEU B 43 -6.496 4.046 -1.510 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -8.100 3.456 -3.378 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -6.583 4.131 -4.019 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -6.866 2.374 -4.066 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -8.142 2.231 -1.284 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -6.961 1.082 -1.955 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -6.640 1.880 -0.397 1.00 0.00 H new ATOM 1273 N ILE B 44 -4.062 4.847 0.036 1.00 0.00 N ATOM 1274 CA ILE B 44 -4.234 5.791 1.124 1.00 0.00 C ATOM 1275 C ILE B 44 -4.487 7.198 0.588 1.00 0.00 C ATOM 1276 O ILE B 44 -4.063 7.549 -0.513 1.00 0.00 O ATOM 1277 CB ILE B 44 -2.970 5.745 2.005 1.00 0.00 C ATOM 1278 CG1 ILE B 44 -2.830 4.357 2.660 1.00 0.00 C ATOM 1279 CG2 ILE B 44 -3.027 6.838 3.072 1.00 0.00 C ATOM 1280 CD1 ILE B 44 -1.733 4.317 3.725 1.00 0.00 C ATOM 0 H ILE B 44 -3.584 5.228 -0.781 1.00 0.00 H new ATOM 0 HA ILE B 44 -5.105 5.519 1.721 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.097 5.922 1.377 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.781 4.075 3.112 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -2.611 3.617 1.891 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -2.128 6.794 3.687 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -3.089 7.814 2.590 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -3.904 6.687 3.701 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -1.678 3.316 4.153 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -0.775 4.570 3.270 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -1.963 5.036 4.511 1.00 0.00 H new ATOM 1292 N PHE B 45 -5.186 7.997 1.397 1.00 0.00 N ATOM 1293 CA PHE B 45 -5.472 9.397 1.150 1.00 0.00 C ATOM 1294 C PHE B 45 -5.508 10.083 2.513 1.00 0.00 C ATOM 1295 O PHE B 45 -6.395 9.806 3.315 1.00 0.00 O ATOM 1296 CB PHE B 45 -6.822 9.502 0.436 1.00 0.00 C ATOM 1297 CG PHE B 45 -7.266 10.919 0.162 1.00 0.00 C ATOM 1298 CD1 PHE B 45 -6.681 11.640 -0.889 1.00 0.00 C ATOM 1299 CD2 PHE B 45 -8.262 11.513 0.950 1.00 0.00 C ATOM 1300 CE1 PHE B 45 -7.099 12.952 -1.155 1.00 0.00 C ATOM 1301 CE2 PHE B 45 -8.678 12.826 0.683 1.00 0.00 C ATOM 1302 CZ PHE B 45 -8.095 13.546 -0.369 1.00 0.00 C ATOM 0 H PHE B 45 -5.581 7.665 2.277 1.00 0.00 H new ATOM 0 HA PHE B 45 -4.721 9.871 0.517 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -6.764 8.962 -0.509 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -7.581 9.006 1.041 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -5.910 11.185 -1.493 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -8.709 10.960 1.763 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -6.652 13.506 -1.968 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -9.448 13.282 1.288 1.00 0.00 H new ATOM 0 HZ PHE B 45 -8.413 14.558 -0.573 1.00 0.00 H new ATOM 1312 N ALA B 46 -4.549 10.973 2.787 1.00 0.00 N ATOM 1313 CA ALA B 46 -4.423 11.645 4.074 1.00 0.00 C ATOM 1314 C ALA B 46 -4.344 10.648 5.238 1.00 0.00 C ATOM 1315 O ALA B 46 -4.567 11.018 6.391 1.00 0.00 O ATOM 1316 CB ALA B 46 -5.558 12.659 4.239 1.00 0.00 C ATOM 0 H ALA B 46 -3.834 11.246 2.112 1.00 0.00 H new ATOM 0 HA ALA B 46 -3.479 12.190 4.094 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -5.461 13.160 5.202 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -5.505 13.397 3.439 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -6.517 12.143 4.193 1.00 0.00 H new ATOM 1322 N GLY B 47 -4.031 9.382 4.937 1.00 0.00 N ATOM 1323 CA GLY B 47 -3.896 8.339 5.942 1.00 0.00 C ATOM 1324 C GLY B 47 -5.242 7.823 6.445 1.00 0.00 C ATOM 1325 O GLY B 47 -5.297 7.208 7.508 1.00 0.00 O ATOM 0 H GLY B 47 -3.865 9.058 3.984 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -3.328 7.509 5.523 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -3.322 8.725 6.785 1.00 0.00 H new ATOM 1329 N LYS B 48 -6.328 8.065 5.701 1.00 0.00 N ATOM 1330 CA LYS B 48 -7.657 7.585 6.082 1.00 0.00 C ATOM 1331 C LYS B 48 -7.887 6.149 5.623 1.00 0.00 C ATOM 1332 O LYS B 48 -9.025 5.722 5.439 1.00 0.00 O ATOM 1333 CB LYS B 48 -8.745 8.538 5.586 1.00 0.00 C ATOM 1334 CG LYS B 48 -8.936 8.490 4.068 1.00 0.00 C ATOM 1335 CD LYS B 48 -10.368 8.105 3.688 1.00 0.00 C ATOM 1336 CE LYS B 48 -11.360 9.257 3.884 1.00 0.00 C ATOM 1337 NZ LYS B 48 -11.616 9.557 5.307 1.00 0.00 N ATOM 0 H LYS B 48 -6.309 8.593 4.828 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.713 7.573 7.170 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.688 8.289 6.073 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -8.492 9.556 5.883 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -8.695 9.463 3.640 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -8.239 7.771 3.636 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.390 7.785 2.646 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.683 7.253 4.290 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -10.974 10.150 3.393 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -12.302 9.007 3.395 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.510 10.081 5.396 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.681 8.668 5.843 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -10.838 10.133 5.686 1.00 0.00 H new ATOM 1351 N GLN B 49 -6.771 5.440 5.448 1.00 0.00 N ATOM 1352 CA GLN B 49 -6.636 4.071 4.965 1.00 0.00 C ATOM 1353 C GLN B 49 -7.971 3.481 4.502 1.00 0.00 C ATOM 1354 O GLN B 49 -8.718 2.902 5.289 1.00 0.00 O ATOM 1355 CB GLN B 49 -5.966 3.222 6.047 1.00 0.00 C ATOM 1356 CG GLN B 49 -4.762 3.957 6.654 1.00 0.00 C ATOM 1357 CD GLN B 49 -3.861 2.997 7.424 1.00 0.00 C ATOM 1358 OE1 GLN B 49 -4.334 2.078 8.087 1.00 0.00 O ATOM 1359 NE2 GLN B 49 -2.550 3.202 7.339 1.00 0.00 N ATOM 0 H GLN B 49 -5.860 5.848 5.660 1.00 0.00 H new ATOM 0 HA GLN B 49 -6.002 4.073 4.078 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -6.687 2.989 6.830 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -5.641 2.273 5.621 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -4.190 4.440 5.862 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -5.112 4.745 7.321 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -2.190 3.975 6.779 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -1.904 2.586 7.833 1.00 0.00 H new ATOM 1368 N LEU B 50 -8.251 3.645 3.206 1.00 0.00 N ATOM 1369 CA LEU B 50 -9.542 3.363 2.599 1.00 0.00 C ATOM 1370 C LEU B 50 -9.964 1.897 2.743 1.00 0.00 C ATOM 1371 O LEU B 50 -9.153 1.023 3.051 1.00 0.00 O ATOM 1372 CB LEU B 50 -9.516 3.789 1.125 1.00 0.00 C ATOM 1373 CG LEU B 50 -9.284 5.295 0.940 1.00 0.00 C ATOM 1374 CD1 LEU B 50 -7.847 5.743 1.216 1.00 0.00 C ATOM 1375 CD2 LEU B 50 -9.619 5.708 -0.488 1.00 0.00 C ATOM 0 H LEU B 50 -7.562 3.988 2.537 1.00 0.00 H new ATOM 0 HA LEU B 50 -10.293 3.942 3.135 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -8.730 3.240 0.608 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -10.460 3.512 0.656 1.00 0.00 H new ATOM 0 HG LEU B 50 -9.936 5.774 1.670 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -7.766 6.819 1.063 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -7.582 5.501 2.245 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -7.168 5.228 0.536 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -9.450 6.778 -0.606 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -8.982 5.161 -1.184 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -10.664 5.480 -0.697 1.00 0.00 H new ATOM 1387 N GLU B 51 -11.257 1.646 2.513 1.00 0.00 N ATOM 1388 CA GLU B 51 -11.881 0.336 2.663 1.00 0.00 C ATOM 1389 C GLU B 51 -11.924 -0.401 1.326 1.00 0.00 C ATOM 1390 O GLU B 51 -11.081 -0.187 0.459 1.00 0.00 O ATOM 1391 CB GLU B 51 -13.292 0.499 3.240 1.00 0.00 C ATOM 1392 CG GLU B 51 -13.219 1.200 4.591 1.00 0.00 C ATOM 1393 CD GLU B 51 -14.598 1.350 5.225 1.00 0.00 C ATOM 1394 OE1 GLU B 51 -15.301 0.322 5.337 1.00 0.00 O ATOM 1395 OE2 GLU B 51 -14.938 2.497 5.595 1.00 0.00 O ATOM 0 H GLU B 51 -11.911 2.368 2.210 1.00 0.00 H new ATOM 0 HA GLU B 51 -11.285 -0.262 3.352 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -13.911 1.076 2.553 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -13.764 -0.477 3.351 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -12.571 0.634 5.260 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -12.767 2.184 4.466 1.00 0.00 H new ATOM 1402 N ASP B 52 -12.919 -1.276 1.167 1.00 0.00 N ATOM 1403 CA ASP B 52 -13.074 -2.111 -0.020 1.00 0.00 C ATOM 1404 C ASP B 52 -14.552 -2.305 -0.388 1.00 0.00 C ATOM 1405 O ASP B 52 -14.889 -3.209 -1.150 1.00 0.00 O ATOM 1406 CB ASP B 52 -12.374 -3.449 0.229 1.00 0.00 C ATOM 1407 CG ASP B 52 -12.026 -4.169 -1.070 1.00 0.00 C ATOM 1408 OD1 ASP B 52 -11.150 -3.645 -1.797 1.00 0.00 O ATOM 1409 OD2 ASP B 52 -12.632 -5.233 -1.329 1.00 0.00 O ATOM 0 H ASP B 52 -13.646 -1.424 1.867 1.00 0.00 H new ATOM 0 HA ASP B 52 -12.612 -1.615 -0.873 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -11.463 -3.279 0.803 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -13.018 -4.087 0.834 1.00 0.00 H new ATOM 1414 N GLY B 53 -15.437 -1.459 0.151 1.00 0.00 N ATOM 1415 CA GLY B 53 -16.877 -1.554 -0.070 1.00 0.00 C ATOM 1416 C GLY B 53 -17.548 -0.179 -0.027 1.00 0.00 C ATOM 1417 O GLY B 53 -18.736 -0.068 0.276 1.00 0.00 O ATOM 0 H GLY B 53 -15.168 -0.684 0.757 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -17.067 -2.022 -1.036 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -17.320 -2.199 0.689 1.00 0.00 H new ATOM 1421 N ARG B 54 -16.770 0.865 -0.329 1.00 0.00 N ATOM 1422 CA ARG B 54 -17.169 2.262 -0.280 1.00 0.00 C ATOM 1423 C ARG B 54 -17.097 2.892 -1.668 1.00 0.00 C ATOM 1424 O ARG B 54 -17.098 2.177 -2.666 1.00 0.00 O ATOM 1425 CB ARG B 54 -16.191 2.939 0.665 1.00 0.00 C ATOM 1426 CG ARG B 54 -16.425 2.524 2.106 1.00 0.00 C ATOM 1427 CD ARG B 54 -17.770 3.087 2.562 1.00 0.00 C ATOM 1428 NE ARG B 54 -17.724 3.533 3.956 1.00 0.00 N ATOM 1429 CZ ARG B 54 -18.147 2.820 5.005 1.00 0.00 C ATOM 1430 NH1 ARG B 54 -18.649 1.597 4.843 1.00 0.00 N ATOM 1431 NH2 ARG B 54 -18.070 3.331 6.231 1.00 0.00 N ATOM 0 H ARG B 54 -15.802 0.746 -0.627 1.00 0.00 H new ATOM 0 HA ARG B 54 -18.198 2.371 0.062 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -15.171 2.687 0.375 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -16.290 4.021 0.577 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -16.421 1.437 2.192 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -15.623 2.898 2.743 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -18.051 3.923 1.921 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -18.541 2.325 2.449 1.00 0.00 H new ATOM 0 HE ARG B 54 -17.339 4.459 4.141 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -18.715 1.192 3.909 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -18.968 1.065 5.653 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -17.688 4.267 6.371 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -18.393 2.787 7.031 1.00 0.00 H new ATOM 1445 N THR B 55 -17.037 4.226 -1.744 1.00 0.00 N ATOM 1446 CA THR B 55 -16.968 4.928 -3.023 1.00 0.00 C ATOM 1447 C THR B 55 -16.098 6.172 -2.917 1.00 0.00 C ATOM 1448 O THR B 55 -15.858 6.663 -1.820 1.00 0.00 O ATOM 1449 CB THR B 55 -18.362 5.352 -3.488 1.00 0.00 C ATOM 1450 OG1 THR B 55 -19.001 6.098 -2.474 1.00 0.00 O ATOM 1451 CG2 THR B 55 -19.225 4.145 -3.838 1.00 0.00 C ATOM 0 H THR B 55 -17.035 4.840 -0.929 1.00 0.00 H new ATOM 0 HA THR B 55 -16.533 4.237 -3.745 1.00 0.00 H new ATOM 0 HB THR B 55 -18.241 5.962 -4.383 1.00 0.00 H new ATOM 0 HG1 THR B 55 -19.892 6.368 -2.779 1.00 0.00 H new ATOM 0 HG21 THR B 55 -20.208 4.483 -4.164 1.00 0.00 H new ATOM 0 HG22 THR B 55 -18.751 3.579 -4.640 1.00 0.00 H new ATOM 0 HG23 THR B 55 -19.333 3.508 -2.960 1.00 0.00 H new ATOM 1459 N LEU B 56 -15.627 6.681 -4.061 1.00 0.00 N ATOM 1460 CA LEU B 56 -14.726 7.832 -4.100 1.00 0.00 C ATOM 1461 C LEU B 56 -15.393 9.017 -3.402 1.00 0.00 C ATOM 1462 O LEU B 56 -14.751 9.786 -2.689 1.00 0.00 O ATOM 1463 CB LEU B 56 -14.426 8.200 -5.558 1.00 0.00 C ATOM 1464 CG LEU B 56 -13.552 7.211 -6.342 1.00 0.00 C ATOM 1465 CD1 LEU B 56 -12.083 7.357 -5.955 1.00 0.00 C ATOM 1466 CD2 LEU B 56 -13.947 5.744 -6.168 1.00 0.00 C ATOM 0 H LEU B 56 -15.860 6.307 -4.981 1.00 0.00 H new ATOM 0 HA LEU B 56 -13.794 7.584 -3.592 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.374 8.312 -6.085 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -13.937 9.174 -5.572 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.713 7.472 -7.388 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -11.484 6.646 -6.524 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -11.748 8.371 -6.175 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -11.966 7.159 -4.890 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.278 5.115 -6.756 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -13.872 5.469 -5.116 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -14.973 5.601 -6.508 1.00 0.00 H new ATOM 1478 N SER B 57 -16.701 9.142 -3.621 1.00 0.00 N ATOM 1479 CA SER B 57 -17.542 10.145 -2.984 1.00 0.00 C ATOM 1480 C SER B 57 -17.514 10.030 -1.460 1.00 0.00 C ATOM 1481 O SER B 57 -17.608 11.038 -0.762 1.00 0.00 O ATOM 1482 CB SER B 57 -18.977 9.950 -3.467 1.00 0.00 C ATOM 1483 OG SER B 57 -19.780 11.040 -3.071 1.00 0.00 O ATOM 0 H SER B 57 -17.213 8.534 -4.260 1.00 0.00 H new ATOM 0 HA SER B 57 -17.162 11.131 -3.253 1.00 0.00 H new ATOM 0 HB2 SER B 57 -18.992 9.854 -4.553 1.00 0.00 H new ATOM 0 HB3 SER B 57 -19.382 9.024 -3.059 1.00 0.00 H new ATOM 0 HG SER B 57 -20.697 10.903 -3.388 1.00 0.00 H new ATOM 1489 N ASP B 58 -17.384 8.804 -0.944 1.00 0.00 N ATOM 1490 CA ASP B 58 -17.364 8.562 0.494 1.00 0.00 C ATOM 1491 C ASP B 58 -16.143 9.190 1.169 1.00 0.00 C ATOM 1492 O ASP B 58 -16.120 9.328 2.392 1.00 0.00 O ATOM 1493 CB ASP B 58 -17.403 7.058 0.775 1.00 0.00 C ATOM 1494 CG ASP B 58 -17.724 6.778 2.242 1.00 0.00 C ATOM 1495 OD1 ASP B 58 -18.855 7.116 2.658 1.00 0.00 O ATOM 1496 OD2 ASP B 58 -16.842 6.228 2.936 1.00 0.00 O ATOM 0 H ASP B 58 -17.291 7.960 -1.510 1.00 0.00 H new ATOM 0 HA ASP B 58 -18.250 9.036 0.916 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.152 6.586 0.140 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.442 6.613 0.519 1.00 0.00 H new ATOM 1501 N TYR B 59 -15.129 9.576 0.386 1.00 0.00 N ATOM 1502 CA TYR B 59 -13.931 10.213 0.903 1.00 0.00 C ATOM 1503 C TYR B 59 -13.817 11.649 0.388 1.00 0.00 C ATOM 1504 O TYR B 59 -12.786 12.292 0.576 1.00 0.00 O ATOM 1505 CB TYR B 59 -12.709 9.407 0.473 1.00 0.00 C ATOM 1506 CG TYR B 59 -12.967 7.950 0.184 1.00 0.00 C ATOM 1507 CD1 TYR B 59 -13.200 7.039 1.222 1.00 0.00 C ATOM 1508 CD2 TYR B 59 -12.976 7.516 -1.146 1.00 0.00 C ATOM 1509 CE1 TYR B 59 -13.452 5.695 0.933 1.00 0.00 C ATOM 1510 CE2 TYR B 59 -13.216 6.173 -1.446 1.00 0.00 C ATOM 1511 CZ TYR B 59 -13.473 5.266 -0.407 1.00 0.00 C ATOM 1512 OH TYR B 59 -13.743 3.971 -0.699 1.00 0.00 O ATOM 0 H TYR B 59 -15.125 9.451 -0.626 1.00 0.00 H new ATOM 0 HA TYR B 59 -13.987 10.245 1.991 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -12.286 9.868 -0.420 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -11.954 9.477 1.256 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -13.185 7.376 2.248 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -12.797 8.222 -1.944 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -13.629 4.991 1.732 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -13.204 5.835 -2.472 1.00 0.00 H new ATOM 0 HH TYR B 59 -13.955 3.888 -1.652 1.00 0.00 H new ATOM 1522 N ASN B 60 -14.875 12.145 -0.263 1.00 0.00 N ATOM 1523 CA ASN B 60 -14.894 13.426 -0.954 1.00 0.00 C ATOM 1524 C ASN B 60 -13.710 13.559 -1.912 1.00 0.00 C ATOM 1525 O ASN B 60 -13.252 14.663 -2.204 1.00 0.00 O ATOM 1526 CB ASN B 60 -14.982 14.561 0.062 1.00 0.00 C ATOM 1527 CG ASN B 60 -15.355 15.876 -0.610 1.00 0.00 C ATOM 1528 OD1 ASN B 60 -16.407 15.984 -1.233 1.00 0.00 O ATOM 1529 ND2 ASN B 60 -14.499 16.886 -0.489 1.00 0.00 N ATOM 0 H ASN B 60 -15.763 11.647 -0.322 1.00 0.00 H new ATOM 0 HA ASN B 60 -15.784 13.486 -1.581 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -15.724 14.315 0.822 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -14.025 14.670 0.573 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -14.708 17.786 -0.921 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -13.634 16.761 0.036 1.00 0.00 H new ATOM 1536 N ILE B 61 -13.211 12.422 -2.401 1.00 0.00 N ATOM 1537 CA ILE B 61 -12.134 12.380 -3.376 1.00 0.00 C ATOM 1538 C ILE B 61 -12.643 12.883 -4.725 1.00 0.00 C ATOM 1539 O ILE B 61 -13.682 12.440 -5.216 1.00 0.00 O ATOM 1540 CB ILE B 61 -11.595 10.948 -3.461 1.00 0.00 C ATOM 1541 CG1 ILE B 61 -10.551 10.793 -2.349 1.00 0.00 C ATOM 1542 CG2 ILE B 61 -10.980 10.645 -4.830 1.00 0.00 C ATOM 1543 CD1 ILE B 61 -10.044 9.359 -2.208 1.00 0.00 C ATOM 0 H ILE B 61 -13.550 11.500 -2.125 1.00 0.00 H new ATOM 0 HA ILE B 61 -11.315 13.033 -3.072 1.00 0.00 H new ATOM 0 HB ILE B 61 -12.412 10.238 -3.334 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -9.708 11.453 -2.554 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -10.985 11.115 -1.402 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.611 9.619 -4.844 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.737 10.769 -5.604 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.153 11.330 -5.017 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -9.308 9.311 -1.406 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -10.879 8.699 -1.974 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -9.583 9.043 -3.143 1.00 0.00 H new ATOM 1555 N GLN B 62 -11.893 13.815 -5.315 1.00 0.00 N ATOM 1556 CA GLN B 62 -12.135 14.344 -6.645 1.00 0.00 C ATOM 1557 C GLN B 62 -11.184 13.655 -7.625 1.00 0.00 C ATOM 1558 O GLN B 62 -10.569 12.648 -7.278 1.00 0.00 O ATOM 1559 CB GLN B 62 -11.920 15.856 -6.629 1.00 0.00 C ATOM 1560 CG GLN B 62 -12.646 16.481 -5.439 1.00 0.00 C ATOM 1561 CD GLN B 62 -14.138 16.163 -5.420 1.00 0.00 C ATOM 1562 OE1 GLN B 62 -14.817 16.233 -6.443 1.00 0.00 O ATOM 1563 NE2 GLN B 62 -14.657 15.809 -4.247 1.00 0.00 N ATOM 0 H GLN B 62 -11.079 14.230 -4.862 1.00 0.00 H new ATOM 0 HA GLN B 62 -13.160 14.151 -6.961 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -10.854 16.078 -6.571 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -12.287 16.292 -7.558 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -12.192 16.124 -4.515 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -12.510 17.562 -5.464 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -14.062 15.762 -3.420 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -15.649 15.585 -4.175 1.00 0.00 H new ATOM 1572 N LYS B 63 -11.057 14.181 -8.849 1.00 0.00 N ATOM 1573 CA LYS B 63 -10.190 13.588 -9.860 1.00 0.00 C ATOM 1574 C LYS B 63 -8.712 13.598 -9.438 1.00 0.00 C ATOM 1575 O LYS B 63 -8.252 12.660 -8.799 1.00 0.00 O ATOM 1576 CB LYS B 63 -10.476 14.222 -11.226 1.00 0.00 C ATOM 1577 CG LYS B 63 -10.266 15.738 -11.295 1.00 0.00 C ATOM 1578 CD LYS B 63 -11.102 16.301 -12.442 1.00 0.00 C ATOM 1579 CE LYS B 63 -12.566 16.435 -12.013 1.00 0.00 C ATOM 1580 NZ LYS B 63 -13.384 17.042 -13.082 1.00 0.00 N ATOM 0 H LYS B 63 -11.548 15.020 -9.159 1.00 0.00 H new ATOM 0 HA LYS B 63 -10.421 12.527 -9.959 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -9.836 13.748 -11.970 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -11.507 14.000 -11.504 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -10.557 16.202 -10.353 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -9.211 15.966 -11.450 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -10.713 17.274 -12.742 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -11.028 15.647 -13.311 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -12.965 15.453 -11.760 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -12.629 17.046 -11.112 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -14.371 17.120 -12.762 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -13.017 17.989 -13.305 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -13.342 16.445 -13.933 1.00 0.00 H new ATOM 1594 N GLU B 64 -7.954 14.637 -9.775 1.00 0.00 N ATOM 1595 CA GLU B 64 -6.526 14.740 -9.490 1.00 0.00 C ATOM 1596 C GLU B 64 -6.208 14.873 -7.992 1.00 0.00 C ATOM 1597 O GLU B 64 -5.150 15.383 -7.633 1.00 0.00 O ATOM 1598 CB GLU B 64 -5.943 15.909 -10.292 1.00 0.00 C ATOM 1599 CG GLU B 64 -6.619 17.228 -9.914 1.00 0.00 C ATOM 1600 CD GLU B 64 -6.022 18.393 -10.699 1.00 0.00 C ATOM 1601 OE1 GLU B 64 -6.508 18.640 -11.827 1.00 0.00 O ATOM 1602 OE2 GLU B 64 -5.083 19.031 -10.172 1.00 0.00 O ATOM 0 H GLU B 64 -8.324 15.451 -10.266 1.00 0.00 H new ATOM 0 HA GLU B 64 -6.057 13.805 -9.797 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -4.871 15.981 -10.109 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -6.072 15.723 -11.358 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -7.689 17.162 -10.111 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -6.503 17.407 -8.845 1.00 0.00 H new ATOM 1609 N SER B 65 -7.110 14.425 -7.111 1.00 0.00 N ATOM 1610 CA SER B 65 -6.919 14.494 -5.665 1.00 0.00 C ATOM 1611 C SER B 65 -5.656 13.772 -5.192 1.00 0.00 C ATOM 1612 O SER B 65 -5.217 13.995 -4.065 1.00 0.00 O ATOM 1613 CB SER B 65 -8.141 13.895 -4.974 1.00 0.00 C ATOM 1614 OG SER B 65 -9.225 14.790 -5.081 1.00 0.00 O ATOM 0 H SER B 65 -7.997 14.003 -7.387 1.00 0.00 H new ATOM 0 HA SER B 65 -6.797 15.545 -5.402 1.00 0.00 H new ATOM 0 HB2 SER B 65 -8.398 12.939 -5.430 1.00 0.00 H new ATOM 0 HB3 SER B 65 -7.919 13.699 -3.925 1.00 0.00 H new ATOM 0 HG SER B 65 -9.516 15.060 -4.185 1.00 0.00 H new ATOM 1620 N THR B 66 -5.080 12.918 -6.047 1.00 0.00 N ATOM 1621 CA THR B 66 -3.879 12.132 -5.778 1.00 0.00 C ATOM 1622 C THR B 66 -4.078 11.121 -4.646 1.00 0.00 C ATOM 1623 O THR B 66 -4.845 11.342 -3.711 1.00 0.00 O ATOM 1624 CB THR B 66 -2.693 13.064 -5.497 1.00 0.00 C ATOM 1625 OG1 THR B 66 -2.560 13.985 -6.560 1.00 0.00 O ATOM 1626 CG2 THR B 66 -1.364 12.312 -5.361 1.00 0.00 C ATOM 0 H THR B 66 -5.456 12.752 -6.981 1.00 0.00 H new ATOM 0 HA THR B 66 -3.662 11.545 -6.671 1.00 0.00 H new ATOM 0 HB THR B 66 -2.903 13.562 -4.551 1.00 0.00 H new ATOM 0 HG1 THR B 66 -1.804 14.583 -6.382 1.00 0.00 H new ATOM 0 HG21 THR B 66 -0.562 13.023 -5.163 1.00 0.00 H new ATOM 0 HG22 THR B 66 -1.431 11.602 -4.537 1.00 0.00 H new ATOM 0 HG23 THR B 66 -1.153 11.776 -6.286 1.00 0.00 H new ATOM 1634 N LEU B 67 -3.370 9.994 -4.741 1.00 0.00 N ATOM 1635 CA LEU B 67 -3.378 8.918 -3.756 1.00 0.00 C ATOM 1636 C LEU B 67 -2.002 8.264 -3.724 1.00 0.00 C ATOM 1637 O LEU B 67 -1.093 8.676 -4.444 1.00 0.00 O ATOM 1638 CB LEU B 67 -4.438 7.867 -4.115 1.00 0.00 C ATOM 1639 CG LEU B 67 -5.831 8.268 -3.608 1.00 0.00 C ATOM 1640 CD1 LEU B 67 -6.662 8.899 -4.722 1.00 0.00 C ATOM 1641 CD2 LEU B 67 -6.580 7.031 -3.119 1.00 0.00 C ATOM 0 H LEU B 67 -2.756 9.802 -5.533 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.618 9.333 -2.777 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -4.468 7.736 -5.197 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -4.157 6.906 -3.685 1.00 0.00 H new ATOM 0 HG LEU B 67 -5.691 8.987 -2.800 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -7.643 9.173 -4.334 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -6.157 9.791 -5.092 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -6.781 8.185 -5.537 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -7.567 7.322 -2.761 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -6.686 6.322 -3.940 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -6.022 6.565 -2.307 1.00 0.00 H new ATOM 1653 N HIS B 68 -1.848 7.237 -2.886 1.00 0.00 N ATOM 1654 CA HIS B 68 -0.627 6.470 -2.779 1.00 0.00 C ATOM 1655 C HIS B 68 -1.013 5.003 -2.673 1.00 0.00 C ATOM 1656 O HIS B 68 -2.102 4.700 -2.185 1.00 0.00 O ATOM 1657 CB HIS B 68 0.106 6.898 -1.505 1.00 0.00 C ATOM 1658 CG HIS B 68 0.617 8.314 -1.543 1.00 0.00 C ATOM 1659 ND1 HIS B 68 -0.050 9.434 -1.031 1.00 0.00 N ATOM 1660 CD2 HIS B 68 1.808 8.707 -2.078 1.00 0.00 C ATOM 1661 CE1 HIS B 68 0.768 10.471 -1.270 1.00 0.00 C ATOM 1662 NE2 HIS B 68 1.890 10.066 -1.891 1.00 0.00 N ATOM 0 H HIS B 68 -2.585 6.918 -2.257 1.00 0.00 H new ATOM 0 HA HIS B 68 0.019 6.631 -3.642 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -0.568 6.788 -0.655 1.00 0.00 H new ATOM 0 HB3 HIS B 68 0.945 6.223 -1.336 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.542 8.075 -2.555 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.554 11.494 -1.000 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.667 10.664 -2.174 1.00 0.00 H new ATOM 1670 N LEU B 69 -0.139 4.098 -3.113 1.00 0.00 N ATOM 1671 CA LEU B 69 -0.342 2.682 -2.840 1.00 0.00 C ATOM 1672 C LEU B 69 0.824 2.122 -2.030 1.00 0.00 C ATOM 1673 O LEU B 69 1.901 2.712 -1.958 1.00 0.00 O ATOM 1674 CB LEU B 69 -0.705 1.840 -4.079 1.00 0.00 C ATOM 1675 CG LEU B 69 0.256 1.746 -5.265 1.00 0.00 C ATOM 1676 CD1 LEU B 69 0.058 2.938 -6.189 1.00 0.00 C ATOM 1677 CD2 LEU B 69 1.705 1.587 -4.813 1.00 0.00 C ATOM 0 H LEU B 69 0.700 4.317 -3.650 1.00 0.00 H new ATOM 0 HA LEU B 69 -1.237 2.603 -2.223 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -0.889 0.823 -3.733 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -1.651 2.223 -4.462 1.00 0.00 H new ATOM 0 HG LEU B 69 0.023 0.844 -5.830 1.00 0.00 H new ATOM 0 HD11 LEU B 69 0.746 2.864 -7.031 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -0.968 2.946 -6.558 1.00 0.00 H new ATOM 0 HD13 LEU B 69 0.254 3.860 -5.641 1.00 0.00 H new ATOM 0 HD21 LEU B 69 2.354 1.524 -5.687 1.00 0.00 H new ATOM 0 HD22 LEU B 69 1.994 2.446 -4.208 1.00 0.00 H new ATOM 0 HD23 LEU B 69 1.804 0.677 -4.221 1.00 0.00 H new ATOM 1689 N VAL B 70 0.583 0.965 -1.417 1.00 0.00 N ATOM 1690 CA VAL B 70 1.514 0.339 -0.498 1.00 0.00 C ATOM 1691 C VAL B 70 1.217 -1.160 -0.456 1.00 0.00 C ATOM 1692 O VAL B 70 0.554 -1.664 0.446 1.00 0.00 O ATOM 1693 CB VAL B 70 1.437 1.053 0.864 1.00 0.00 C ATOM 1694 CG1 VAL B 70 -0.001 1.291 1.339 1.00 0.00 C ATOM 1695 CG2 VAL B 70 2.244 0.311 1.932 1.00 0.00 C ATOM 0 H VAL B 70 -0.277 0.434 -1.550 1.00 0.00 H new ATOM 0 HA VAL B 70 2.550 0.439 -0.823 1.00 0.00 H new ATOM 0 HB VAL B 70 1.884 2.035 0.712 1.00 0.00 H new ATOM 0 HG11 VAL B 70 0.014 1.797 2.304 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -0.526 1.910 0.612 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -0.514 0.335 1.439 1.00 0.00 H new ATOM 0 HG21 VAL B 70 2.168 0.843 2.881 1.00 0.00 H new ATOM 0 HG22 VAL B 70 1.851 -0.699 2.049 1.00 0.00 H new ATOM 0 HG23 VAL B 70 3.289 0.260 1.628 1.00 0.00 H new ATOM 1705 N LEU B 71 1.721 -1.874 -1.470 1.00 0.00 N ATOM 1706 CA LEU B 71 1.465 -3.291 -1.681 1.00 0.00 C ATOM 1707 C LEU B 71 1.854 -4.128 -0.465 1.00 0.00 C ATOM 1708 O LEU B 71 2.645 -3.693 0.371 1.00 0.00 O ATOM 1709 CB LEU B 71 2.221 -3.755 -2.930 1.00 0.00 C ATOM 1710 CG LEU B 71 1.951 -2.857 -4.142 1.00 0.00 C ATOM 1711 CD1 LEU B 71 2.595 -3.482 -5.377 1.00 0.00 C ATOM 1712 CD2 LEU B 71 0.455 -2.683 -4.389 1.00 0.00 C ATOM 0 H LEU B 71 2.331 -1.467 -2.179 1.00 0.00 H new ATOM 0 HA LEU B 71 0.394 -3.433 -1.827 1.00 0.00 H new ATOM 0 HB2 LEU B 71 3.291 -3.767 -2.721 1.00 0.00 H new ATOM 0 HB3 LEU B 71 1.931 -4.779 -3.168 1.00 0.00 H new ATOM 0 HG LEU B 71 2.377 -1.874 -3.941 1.00 0.00 H new ATOM 0 HD11 LEU B 71 2.408 -2.849 -6.245 1.00 0.00 H new ATOM 0 HD12 LEU B 71 3.670 -3.574 -5.220 1.00 0.00 H new ATOM 0 HD13 LEU B 71 2.168 -4.470 -5.549 1.00 0.00 H new ATOM 0 HD21 LEU B 71 0.302 -2.040 -5.256 1.00 0.00 H new ATOM 0 HD22 LEU B 71 0.001 -3.657 -4.574 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -0.008 -2.228 -3.513 1.00 0.00 H new ATOM 1724 N ARG B 72 1.294 -5.340 -0.367 1.00 0.00 N ATOM 1725 CA ARG B 72 1.489 -6.184 0.805 1.00 0.00 C ATOM 1726 C ARG B 72 2.800 -6.954 0.742 1.00 0.00 C ATOM 1727 O ARG B 72 3.362 -7.264 1.789 1.00 0.00 O ATOM 1728 CB ARG B 72 0.303 -7.145 0.902 1.00 0.00 C ATOM 1729 CG ARG B 72 -0.905 -6.387 1.457 1.00 0.00 C ATOM 1730 CD ARG B 72 -2.158 -7.259 1.488 1.00 0.00 C ATOM 1731 NE ARG B 72 -1.904 -8.562 2.121 1.00 0.00 N ATOM 1732 CZ ARG B 72 -2.857 -9.343 2.639 1.00 0.00 C ATOM 1733 NH1 ARG B 72 -4.135 -8.974 2.602 1.00 0.00 N ATOM 1734 NH2 ARG B 72 -2.532 -10.503 3.201 1.00 0.00 N ATOM 0 H ARG B 72 0.703 -5.753 -1.089 1.00 0.00 H new ATOM 0 HA ARG B 72 1.543 -5.554 1.693 1.00 0.00 H new ATOM 0 HB2 ARG B 72 0.071 -7.557 -0.080 1.00 0.00 H new ATOM 0 HB3 ARG B 72 0.551 -7.986 1.550 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -0.682 -6.036 2.464 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -1.092 -5.504 0.846 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -2.948 -6.740 2.030 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -2.518 -7.414 0.471 1.00 0.00 H new ATOM 0 HE ARG B 72 -0.939 -8.890 2.168 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -4.397 -8.086 2.175 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -4.852 -9.579 3.001 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -1.556 -10.797 3.237 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -3.259 -11.099 3.597 1.00 0.00 H new ATOM 1748 N LEU B 73 3.279 -7.259 -0.471 1.00 0.00 N ATOM 1749 CA LEU B 73 4.496 -8.024 -0.745 1.00 0.00 C ATOM 1750 C LEU B 73 4.532 -9.423 -0.115 1.00 0.00 C ATOM 1751 O LEU B 73 5.357 -10.239 -0.519 1.00 0.00 O ATOM 1752 CB LEU B 73 5.714 -7.216 -0.299 1.00 0.00 C ATOM 1753 CG LEU B 73 5.756 -5.806 -0.899 1.00 0.00 C ATOM 1754 CD1 LEU B 73 7.000 -5.083 -0.387 1.00 0.00 C ATOM 1755 CD2 LEU B 73 5.804 -5.848 -2.426 1.00 0.00 C ATOM 0 H LEU B 73 2.805 -6.964 -1.325 1.00 0.00 H new ATOM 0 HA LEU B 73 4.510 -8.193 -1.822 1.00 0.00 H new ATOM 0 HB2 LEU B 73 5.714 -7.141 0.788 1.00 0.00 H new ATOM 0 HB3 LEU B 73 6.620 -7.751 -0.582 1.00 0.00 H new ATOM 0 HG LEU B 73 4.850 -5.281 -0.597 1.00 0.00 H new ATOM 0 HD11 LEU B 73 7.037 -4.079 -0.810 1.00 0.00 H new ATOM 0 HD12 LEU B 73 6.961 -5.018 0.700 1.00 0.00 H new ATOM 0 HD13 LEU B 73 7.891 -5.635 -0.686 1.00 0.00 H new ATOM 0 HD21 LEU B 73 5.833 -4.831 -2.817 1.00 0.00 H new ATOM 0 HD22 LEU B 73 6.696 -6.386 -2.747 1.00 0.00 H new ATOM 0 HD23 LEU B 73 4.917 -6.357 -2.804 1.00 0.00 H new ATOM 1767 N ARG B 74 3.649 -9.689 0.857 1.00 0.00 N ATOM 1768 CA ARG B 74 3.530 -10.906 1.663 1.00 0.00 C ATOM 1769 C ARG B 74 4.781 -11.224 2.474 1.00 0.00 C ATOM 1770 O ARG B 74 4.715 -11.342 3.697 1.00 0.00 O ATOM 1771 CB ARG B 74 3.196 -12.108 0.789 1.00 0.00 C ATOM 1772 CG ARG B 74 1.753 -12.168 0.316 1.00 0.00 C ATOM 1773 CD ARG B 74 1.428 -11.071 -0.681 1.00 0.00 C ATOM 1774 NE ARG B 74 0.211 -11.450 -1.395 1.00 0.00 N ATOM 1775 CZ ARG B 74 0.180 -12.051 -2.589 1.00 0.00 C ATOM 1776 NH1 ARG B 74 1.305 -12.372 -3.223 1.00 0.00 N ATOM 1777 NH2 ARG B 74 -0.984 -12.335 -3.158 1.00 0.00 N ATOM 0 H ARG B 74 2.943 -9.001 1.119 1.00 0.00 H new ATOM 0 HA ARG B 74 2.720 -10.708 2.365 1.00 0.00 H new ATOM 0 HB2 ARG B 74 3.850 -12.099 -0.083 1.00 0.00 H new ATOM 0 HB3 ARG B 74 3.420 -13.018 1.346 1.00 0.00 H new ATOM 0 HG2 ARG B 74 1.563 -13.139 -0.141 1.00 0.00 H new ATOM 0 HG3 ARG B 74 1.087 -12.084 1.175 1.00 0.00 H new ATOM 0 HD2 ARG B 74 1.287 -10.120 -0.167 1.00 0.00 H new ATOM 0 HD3 ARG B 74 2.253 -10.936 -1.381 1.00 0.00 H new ATOM 0 HE ARG B 74 -0.682 -11.240 -0.949 1.00 0.00 H new ATOM 0 HH11 ARG B 74 2.208 -12.160 -2.799 1.00 0.00 H new ATOM 0 HH12 ARG B 74 1.264 -12.830 -4.133 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -1.855 -12.095 -2.685 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -1.008 -12.793 -4.069 1.00 0.00 H new ATOM 1791 N GLY B 75 5.916 -11.362 1.795 1.00 0.00 N ATOM 1792 CA GLY B 75 7.175 -11.723 2.420 1.00 0.00 C ATOM 1793 C GLY B 75 8.356 -11.721 1.453 1.00 0.00 C ATOM 1794 O GLY B 75 9.503 -11.665 1.897 1.00 0.00 O ATOM 0 H GLY B 75 5.984 -11.224 0.787 1.00 0.00 H new ATOM 0 HA2 GLY B 75 7.380 -11.027 3.234 1.00 0.00 H new ATOM 0 HA3 GLY B 75 7.080 -12.714 2.864 1.00 0.00 H new ATOM 1798 N GLY B 76 8.101 -11.780 0.141 1.00 0.00 N ATOM 1799 CA GLY B 76 9.154 -11.755 -0.866 1.00 0.00 C ATOM 1800 C GLY B 76 8.568 -11.850 -2.269 1.00 0.00 C ATOM 1801 O GLY B 76 7.969 -12.905 -2.572 1.00 0.00 O ATOM 1802 OXT GLY B 76 8.725 -10.868 -3.027 1.00 0.00 O ATOM 0 H GLY B 76 7.160 -11.846 -0.246 1.00 0.00 H new ATOM 0 HA2 GLY B 76 9.732 -10.836 -0.771 1.00 0.00 H new ATOM 0 HA3 GLY B 76 9.842 -12.583 -0.698 1.00 0.00 H new TER 1806 GLY B 76