USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 985 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 96 THR OG1 : rot 180:sc=-0.00657 USER MOD Set 1.2: A 97 ASN : amide:sc= 0.00467 X(o=-0.0019,f=0.33) USER MOD Set 2.1: A 65 LYS NZ :NH3+ 154:sc= -0.0182 (180deg=-0.346) USER MOD Set 2.2: A 68 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 23 TYR OH : rot 46:sc= -0.464 USER MOD Set 3.2: A 112 HIS : no HD1:sc= -16.6! C(o=-17!,f=-19!) USER MOD Set 4.1: A 20 THR OG1 : rot -75:sc= -0.384 USER MOD Set 4.2: A 108 MET CE :methyl 146:sc= -9.18! (180deg=-13.1!) USER MOD Single : A 1 PHE N :NH3+ -150:sc= 0.303 (180deg=0.049) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 12 TYR OH : rot 165:sc= -0.745 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot -82:sc= 0.995 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -2.13 X(o=-2.1,f=-1.9) USER MOD Single : A 30 ASN : amide:sc= -0.668 X(o=-0.67,f=-0.28) USER MOD Single : A 31 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00656) USER MOD Single : A 34 GLN : amide:sc= -1.46 K(o=-1.5,f=-2.7) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 MET CE :methyl -148:sc= -4.04! (180deg=-5.37!) USER MOD Single : A 54 SER OG : rot 98:sc= 0.0242 USER MOD Single : A 57 ASN :FLIP amide:sc= -1.08 F(o=-2.2,f=-1.1) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 157:sc= -0.0703 (180deg=-0.352) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -133:sc= -5.94! (180deg=-7.14!) USER MOD Single : A 73 THR OG1 : rot 56:sc= -5.02! USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -70:sc= -2.72! USER MOD Single : A 83 SER OG : rot -179:sc= -1.92! USER MOD Single : A 84 ASN : amide:sc= -0.406 K(o=-0.41,f=-5!) USER MOD Single : A 87 ASN : amide:sc= -2.81 K(o=-2.8,f=-4.6!) USER MOD Single : A 92 ASN : amide:sc= -0.0983 K(o=-0.098,f=-2) USER MOD Single : A 98 THR OG1 : rot -58:sc= -0.71 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 118 CYS SG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 1 13.088 8.509 36.747 1.00 0.00 N ATOM 2 CA PHE A 1 13.034 7.644 35.540 1.00 0.00 C ATOM 3 C PHE A 1 13.826 6.357 35.748 1.00 0.00 C ATOM 4 O PHE A 1 14.633 6.255 36.672 1.00 0.00 O ATOM 5 CB PHE A 1 13.603 8.427 34.355 1.00 0.00 C ATOM 6 CG PHE A 1 15.030 8.854 34.546 1.00 0.00 C ATOM 7 CD1 PHE A 1 16.058 7.927 34.481 1.00 0.00 C ATOM 8 CD2 PHE A 1 15.342 10.182 34.790 1.00 0.00 C ATOM 9 CE1 PHE A 1 17.373 8.317 34.656 1.00 0.00 C ATOM 10 CE2 PHE A 1 16.655 10.577 34.967 1.00 0.00 C ATOM 11 CZ PHE A 1 17.672 9.644 34.899 1.00 0.00 C ATOM 0 H1 PHE A 1 12.214 9.069 36.812 1.00 0.00 H new ATOM 0 H2 PHE A 1 13.183 7.915 37.596 1.00 0.00 H new ATOM 0 H3 PHE A 1 13.905 9.149 36.679 1.00 0.00 H new ATOM 0 HA PHE A 1 11.998 7.365 35.346 1.00 0.00 H new ATOM 0 HB2 PHE A 1 13.533 7.813 33.457 1.00 0.00 H new ATOM 0 HB3 PHE A 1 12.988 9.311 34.185 1.00 0.00 H new ATOM 0 HD1 PHE A 1 15.830 6.889 34.292 1.00 0.00 H new ATOM 0 HD2 PHE A 1 14.551 10.916 34.842 1.00 0.00 H new ATOM 0 HE1 PHE A 1 18.166 7.585 34.603 1.00 0.00 H new ATOM 0 HE2 PHE A 1 16.886 11.615 35.158 1.00 0.00 H new ATOM 0 HZ PHE A 1 18.698 9.951 35.035 1.00 0.00 H new ATOM 22 N ALA A 2 13.589 5.376 34.883 1.00 0.00 N ATOM 23 CA ALA A 2 14.281 4.096 34.971 1.00 0.00 C ATOM 24 C ALA A 2 14.394 3.438 33.601 1.00 0.00 C ATOM 25 O ALA A 2 15.493 3.261 33.075 1.00 0.00 O ATOM 26 CB ALA A 2 13.559 3.174 35.943 1.00 0.00 C ATOM 0 H ALA A 2 12.923 5.443 34.113 1.00 0.00 H new ATOM 0 HA ALA A 2 15.290 4.280 35.341 1.00 0.00 H new ATOM 0 HB1 ALA A 2 14.085 2.221 36.000 1.00 0.00 H new ATOM 0 HB2 ALA A 2 13.534 3.634 36.931 1.00 0.00 H new ATOM 0 HB3 ALA A 2 12.540 3.005 35.595 1.00 0.00 H new ATOM 32 N LYS A 3 13.252 3.077 33.026 1.00 0.00 N ATOM 33 CA LYS A 3 13.224 2.438 31.715 1.00 0.00 C ATOM 34 C LYS A 3 12.705 3.401 30.652 1.00 0.00 C ATOM 35 O LYS A 3 13.152 3.375 29.505 1.00 0.00 O ATOM 36 CB LYS A 3 12.348 1.184 31.755 1.00 0.00 C ATOM 37 CG LYS A 3 12.664 0.259 32.918 1.00 0.00 C ATOM 38 CD LYS A 3 11.410 -0.424 33.443 1.00 0.00 C ATOM 39 CE LYS A 3 11.749 -1.678 34.234 1.00 0.00 C ATOM 40 NZ LYS A 3 12.359 -1.355 35.553 1.00 0.00 N ATOM 0 H LYS A 3 12.333 3.216 33.447 1.00 0.00 H new ATOM 0 HA LYS A 3 14.243 2.153 31.455 1.00 0.00 H new ATOM 0 HB2 LYS A 3 11.302 1.484 31.814 1.00 0.00 H new ATOM 0 HB3 LYS A 3 12.471 0.635 30.821 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.384 -0.495 32.600 1.00 0.00 H new ATOM 0 HG3 LYS A 3 13.133 0.829 33.721 1.00 0.00 H new ATOM 0 HD2 LYS A 3 10.855 0.268 34.076 1.00 0.00 H new ATOM 0 HD3 LYS A 3 10.759 -0.684 32.608 1.00 0.00 H new ATOM 0 HE2 LYS A 3 10.844 -2.266 34.387 1.00 0.00 H new ATOM 0 HE3 LYS A 3 12.437 -2.296 33.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 12.575 -2.237 36.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.236 -0.815 35.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 11.692 -0.787 36.114 1.00 0.00 H new ATOM 54 N LEU A 4 11.758 4.250 31.040 1.00 0.00 N ATOM 55 CA LEU A 4 11.177 5.221 30.121 1.00 0.00 C ATOM 56 C LEU A 4 10.517 4.522 28.937 1.00 0.00 C ATOM 57 O LEU A 4 11.043 4.530 27.823 1.00 0.00 O ATOM 58 CB LEU A 4 12.253 6.189 29.624 1.00 0.00 C ATOM 59 CG LEU A 4 11.765 7.613 29.348 1.00 0.00 C ATOM 60 CD1 LEU A 4 12.944 8.544 29.110 1.00 0.00 C ATOM 61 CD2 LEU A 4 10.821 7.630 28.155 1.00 0.00 C ATOM 0 H LEU A 4 11.377 4.285 31.986 1.00 0.00 H new ATOM 0 HA LEU A 4 10.413 5.783 30.659 1.00 0.00 H new ATOM 0 HB2 LEU A 4 13.052 6.232 30.365 1.00 0.00 H new ATOM 0 HB3 LEU A 4 12.688 5.786 28.709 1.00 0.00 H new ATOM 0 HG LEU A 4 11.220 7.967 30.223 1.00 0.00 H new ATOM 0 HD11 LEU A 4 12.578 9.552 28.915 1.00 0.00 H new ATOM 0 HD12 LEU A 4 13.584 8.554 29.993 1.00 0.00 H new ATOM 0 HD13 LEU A 4 13.517 8.194 28.251 1.00 0.00 H new ATOM 0 HD21 LEU A 4 10.483 8.650 27.973 1.00 0.00 H new ATOM 0 HD22 LEU A 4 11.342 7.257 27.273 1.00 0.00 H new ATOM 0 HD23 LEU A 4 9.960 6.995 28.363 1.00 0.00 H new ATOM 73 N VAL A 5 9.360 3.917 29.184 1.00 0.00 N ATOM 74 CA VAL A 5 8.626 3.214 28.140 1.00 0.00 C ATOM 75 C VAL A 5 8.064 4.189 27.110 1.00 0.00 C ATOM 76 O VAL A 5 7.103 4.907 27.381 1.00 0.00 O ATOM 77 CB VAL A 5 7.470 2.382 28.726 1.00 0.00 C ATOM 78 CG1 VAL A 5 8.008 1.266 29.608 1.00 0.00 C ATOM 79 CG2 VAL A 5 6.512 3.272 29.504 1.00 0.00 C ATOM 0 H VAL A 5 8.911 3.900 30.099 1.00 0.00 H new ATOM 0 HA VAL A 5 9.335 2.544 27.654 1.00 0.00 H new ATOM 0 HB VAL A 5 6.920 1.928 27.902 1.00 0.00 H new ATOM 0 HG11 VAL A 5 7.176 0.689 30.013 1.00 0.00 H new ATOM 0 HG12 VAL A 5 8.649 0.612 29.017 1.00 0.00 H new ATOM 0 HG13 VAL A 5 8.584 1.696 30.427 1.00 0.00 H new ATOM 0 HG21 VAL A 5 5.702 2.667 29.911 1.00 0.00 H new ATOM 0 HG22 VAL A 5 7.047 3.757 30.320 1.00 0.00 H new ATOM 0 HG23 VAL A 5 6.099 4.031 28.839 1.00 0.00 H new ATOM 89 N ARG A 6 8.672 4.208 25.929 1.00 0.00 N ATOM 90 CA ARG A 6 8.232 5.096 24.858 1.00 0.00 C ATOM 91 C ARG A 6 7.132 4.439 24.026 1.00 0.00 C ATOM 92 O ARG A 6 7.145 3.228 23.812 1.00 0.00 O ATOM 93 CB ARG A 6 9.415 5.470 23.961 1.00 0.00 C ATOM 94 CG ARG A 6 9.466 6.947 23.606 1.00 0.00 C ATOM 95 CD ARG A 6 10.894 7.469 23.588 1.00 0.00 C ATOM 96 NE ARG A 6 11.224 8.204 24.807 1.00 0.00 N ATOM 97 CZ ARG A 6 12.434 8.691 25.074 1.00 0.00 C ATOM 98 NH1 ARG A 6 13.430 8.523 24.213 1.00 0.00 N ATOM 99 NH2 ARG A 6 12.649 9.347 26.206 1.00 0.00 N ATOM 0 H ARG A 6 9.470 3.620 25.689 1.00 0.00 H new ATOM 0 HA ARG A 6 7.828 6.002 25.310 1.00 0.00 H new ATOM 0 HB2 ARG A 6 10.342 5.193 24.463 1.00 0.00 H new ATOM 0 HB3 ARG A 6 9.363 4.886 23.042 1.00 0.00 H new ATOM 0 HG2 ARG A 6 9.009 7.103 22.629 1.00 0.00 H new ATOM 0 HG3 ARG A 6 8.879 7.516 24.327 1.00 0.00 H new ATOM 0 HD2 ARG A 6 11.584 6.633 23.471 1.00 0.00 H new ATOM 0 HD3 ARG A 6 11.031 8.119 22.724 1.00 0.00 H new ATOM 0 HE ARG A 6 10.484 8.353 25.493 1.00 0.00 H new ATOM 0 HH11 ARG A 6 13.271 8.018 23.341 1.00 0.00 H new ATOM 0 HH12 ARG A 6 14.355 8.899 24.423 1.00 0.00 H new ATOM 0 HH21 ARG A 6 11.888 9.478 26.872 1.00 0.00 H new ATOM 0 HH22 ARG A 6 13.576 9.720 26.411 1.00 0.00 H new ATOM 113 N PRO A 7 6.161 5.235 23.544 1.00 0.00 N ATOM 114 CA PRO A 7 5.050 4.723 22.734 1.00 0.00 C ATOM 115 C PRO A 7 5.495 4.324 21.327 1.00 0.00 C ATOM 116 O PRO A 7 5.862 5.179 20.521 1.00 0.00 O ATOM 117 CB PRO A 7 4.085 5.907 22.671 1.00 0.00 C ATOM 118 CG PRO A 7 4.949 7.107 22.834 1.00 0.00 C ATOM 119 CD PRO A 7 6.066 6.693 23.752 1.00 0.00 C ATOM 0 HA PRO A 7 4.614 3.821 23.162 1.00 0.00 H new ATOM 0 HB2 PRO A 7 3.549 5.931 21.722 1.00 0.00 H new ATOM 0 HB3 PRO A 7 3.335 5.849 23.460 1.00 0.00 H new ATOM 0 HG2 PRO A 7 5.338 7.441 21.872 1.00 0.00 H new ATOM 0 HG3 PRO A 7 4.385 7.939 23.256 1.00 0.00 H new ATOM 0 HD2 PRO A 7 7.000 7.196 23.500 1.00 0.00 H new ATOM 0 HD3 PRO A 7 5.843 6.936 24.791 1.00 0.00 H new ATOM 127 N PRO A 8 5.470 3.016 21.011 1.00 0.00 N ATOM 128 CA PRO A 8 5.872 2.518 19.691 1.00 0.00 C ATOM 129 C PRO A 8 5.129 3.217 18.558 1.00 0.00 C ATOM 130 O PRO A 8 4.071 3.809 18.769 1.00 0.00 O ATOM 131 CB PRO A 8 5.501 1.034 19.738 1.00 0.00 C ATOM 132 CG PRO A 8 5.504 0.687 21.186 1.00 0.00 C ATOM 133 CD PRO A 8 5.046 1.924 21.907 1.00 0.00 C ATOM 0 HA PRO A 8 6.929 2.699 19.494 1.00 0.00 H new ATOM 0 HB2 PRO A 8 4.523 0.856 19.291 1.00 0.00 H new ATOM 0 HB3 PRO A 8 6.219 0.429 19.185 1.00 0.00 H new ATOM 0 HG2 PRO A 8 4.838 -0.152 21.388 1.00 0.00 H new ATOM 0 HG3 PRO A 8 6.500 0.390 21.514 1.00 0.00 H new ATOM 0 HD2 PRO A 8 3.967 1.925 22.059 1.00 0.00 H new ATOM 0 HD3 PRO A 8 5.506 2.010 22.891 1.00 0.00 H new ATOM 141 N VAL A 9 5.690 3.144 17.355 1.00 0.00 N ATOM 142 CA VAL A 9 5.079 3.771 16.189 1.00 0.00 C ATOM 143 C VAL A 9 4.641 2.725 15.169 1.00 0.00 C ATOM 144 O VAL A 9 5.371 2.420 14.226 1.00 0.00 O ATOM 145 CB VAL A 9 6.045 4.760 15.511 1.00 0.00 C ATOM 146 CG1 VAL A 9 6.230 6.001 16.370 1.00 0.00 C ATOM 147 CG2 VAL A 9 7.385 4.093 15.231 1.00 0.00 C ATOM 0 H VAL A 9 6.566 2.657 17.163 1.00 0.00 H new ATOM 0 HA VAL A 9 4.205 4.316 16.545 1.00 0.00 H new ATOM 0 HB VAL A 9 5.611 5.066 14.559 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.916 6.688 15.874 1.00 0.00 H new ATOM 0 HG12 VAL A 9 5.267 6.491 16.514 1.00 0.00 H new ATOM 0 HG13 VAL A 9 6.640 5.715 17.339 1.00 0.00 H new ATOM 0 HG21 VAL A 9 8.054 4.808 14.752 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.826 3.755 16.169 1.00 0.00 H new ATOM 0 HG23 VAL A 9 7.235 3.238 14.572 1.00 0.00 H new ATOM 157 N GLN A 10 3.445 2.180 15.365 1.00 0.00 N ATOM 158 CA GLN A 10 2.908 1.168 14.463 1.00 0.00 C ATOM 159 C GLN A 10 1.454 1.469 14.109 1.00 0.00 C ATOM 160 O GLN A 10 1.051 1.358 12.951 1.00 0.00 O ATOM 161 CB GLN A 10 3.012 -0.219 15.098 1.00 0.00 C ATOM 162 CG GLN A 10 2.257 -0.345 16.411 1.00 0.00 C ATOM 163 CD GLN A 10 2.440 -1.704 17.059 1.00 0.00 C ATOM 164 OE1 GLN A 10 3.030 -2.612 16.472 1.00 0.00 O ATOM 165 NE2 GLN A 10 1.932 -1.850 18.278 1.00 0.00 N ATOM 0 H GLN A 10 2.829 2.422 16.141 1.00 0.00 H new ATOM 0 HA GLN A 10 3.498 1.186 13.547 1.00 0.00 H new ATOM 0 HB2 GLN A 10 2.630 -0.960 14.396 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.063 -0.453 15.269 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.597 0.430 17.098 1.00 0.00 H new ATOM 0 HG3 GLN A 10 1.196 -0.170 16.234 1.00 0.00 H new ATOM 0 HE21 GLN A 10 1.451 -1.071 18.727 1.00 0.00 H new ATOM 0 HE22 GLN A 10 2.023 -2.742 18.765 1.00 0.00 H new ATOM 174 N ILE A 11 0.673 1.851 15.114 1.00 0.00 N ATOM 175 CA ILE A 11 -0.737 2.168 14.912 1.00 0.00 C ATOM 176 C ILE A 11 -1.048 3.577 15.403 1.00 0.00 C ATOM 177 O ILE A 11 -0.446 4.057 16.364 1.00 0.00 O ATOM 178 CB ILE A 11 -1.635 1.145 15.622 1.00 0.00 C ATOM 179 CG1 ILE A 11 -3.114 1.405 15.317 1.00 0.00 C ATOM 180 CG2 ILE A 11 -1.382 1.162 17.122 1.00 0.00 C ATOM 181 CD1 ILE A 11 -3.723 0.388 14.377 1.00 0.00 C ATOM 0 H ILE A 11 0.993 1.949 16.078 1.00 0.00 H new ATOM 0 HA ILE A 11 -0.942 2.121 13.843 1.00 0.00 H new ATOM 0 HB ILE A 11 -1.385 0.154 15.243 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -3.675 1.406 16.252 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.218 2.399 14.882 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.028 0.431 17.608 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.339 0.913 17.318 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -1.598 2.155 17.516 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.771 0.633 14.205 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -3.187 0.402 13.428 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -3.651 -0.606 14.820 1.00 0.00 H new ATOM 193 N TYR A 12 -1.959 4.250 14.710 1.00 0.00 N ATOM 194 CA TYR A 12 -2.313 5.623 15.044 1.00 0.00 C ATOM 195 C TYR A 12 -3.795 5.884 14.796 1.00 0.00 C ATOM 196 O TYR A 12 -4.564 6.090 15.735 1.00 0.00 O ATOM 197 CB TYR A 12 -1.454 6.589 14.212 1.00 0.00 C ATOM 198 CG TYR A 12 -0.130 5.990 13.772 1.00 0.00 C ATOM 199 CD1 TYR A 12 -0.094 4.844 12.983 1.00 0.00 C ATOM 200 CD2 TYR A 12 1.078 6.547 14.170 1.00 0.00 C ATOM 201 CE1 TYR A 12 1.101 4.272 12.605 1.00 0.00 C ATOM 202 CE2 TYR A 12 2.283 5.984 13.787 1.00 0.00 C ATOM 203 CZ TYR A 12 2.289 4.846 13.007 1.00 0.00 C ATOM 204 OH TYR A 12 3.485 4.280 12.631 1.00 0.00 O ATOM 0 H TYR A 12 -2.466 3.866 13.913 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.120 5.786 16.104 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.016 6.897 13.330 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -1.261 7.488 14.797 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -1.021 4.394 12.661 1.00 0.00 H new ATOM 0 HD2 TYR A 12 1.077 7.433 14.788 1.00 0.00 H new ATOM 0 HE1 TYR A 12 1.108 3.379 11.997 1.00 0.00 H new ATOM 0 HE2 TYR A 12 3.215 6.434 14.097 1.00 0.00 H new ATOM 0 HH TYR A 12 4.212 4.919 12.785 1.00 0.00 H new ATOM 214 N GLY A 13 -4.191 5.873 13.527 1.00 0.00 N ATOM 215 CA GLY A 13 -5.581 6.109 13.186 1.00 0.00 C ATOM 216 C GLY A 13 -5.765 6.535 11.743 1.00 0.00 C ATOM 217 O GLY A 13 -6.343 5.802 10.941 1.00 0.00 O ATOM 0 H GLY A 13 -3.576 5.705 12.731 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.155 5.200 13.368 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -5.986 6.879 13.842 1.00 0.00 H new ATOM 221 N ILE A 14 -5.275 7.726 11.410 1.00 0.00 N ATOM 222 CA ILE A 14 -5.395 8.248 10.055 1.00 0.00 C ATOM 223 C ILE A 14 -4.718 7.324 9.048 1.00 0.00 C ATOM 224 O ILE A 14 -5.288 7.006 8.005 1.00 0.00 O ATOM 225 CB ILE A 14 -4.795 9.668 9.943 1.00 0.00 C ATOM 226 CG1 ILE A 14 -5.159 10.302 8.594 1.00 0.00 C ATOM 227 CG2 ILE A 14 -3.285 9.636 10.142 1.00 0.00 C ATOM 228 CD1 ILE A 14 -4.378 9.751 7.416 1.00 0.00 C ATOM 0 H ILE A 14 -4.792 8.346 12.060 1.00 0.00 H new ATOM 0 HA ILE A 14 -6.459 8.301 9.825 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.223 10.284 10.734 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.223 10.154 8.411 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.993 11.378 8.654 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -2.886 10.647 10.059 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -3.057 9.236 11.130 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -2.831 9.002 9.380 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -4.696 10.252 6.502 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.313 9.923 7.573 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -4.563 8.681 7.326 1.00 0.00 H new ATOM 240 N GLU A 15 -3.505 6.888 9.367 1.00 0.00 N ATOM 241 CA GLU A 15 -2.766 5.995 8.485 1.00 0.00 C ATOM 242 C GLU A 15 -3.382 4.601 8.502 1.00 0.00 C ATOM 243 O GLU A 15 -3.314 3.869 7.516 1.00 0.00 O ATOM 244 CB GLU A 15 -1.295 5.930 8.900 1.00 0.00 C ATOM 245 CG GLU A 15 -0.382 6.777 8.029 1.00 0.00 C ATOM 246 CD GLU A 15 0.601 7.599 8.840 1.00 0.00 C ATOM 247 OE1 GLU A 15 1.560 7.012 9.384 1.00 0.00 O ATOM 248 OE2 GLU A 15 0.412 8.830 8.933 1.00 0.00 O ATOM 0 H GLU A 15 -3.015 7.137 10.226 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.823 6.388 7.470 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.203 6.258 9.935 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.961 4.893 8.863 1.00 0.00 H new ATOM 0 HG2 GLU A 15 0.168 6.128 7.348 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.988 7.444 7.415 1.00 0.00 H new ATOM 255 N GLY A 16 -3.993 4.247 9.628 1.00 0.00 N ATOM 256 CA GLY A 16 -4.622 2.948 9.749 1.00 0.00 C ATOM 257 C GLY A 16 -5.930 2.875 8.988 1.00 0.00 C ATOM 258 O GLY A 16 -6.289 1.823 8.460 1.00 0.00 O ATOM 0 H GLY A 16 -4.063 4.837 10.457 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -3.943 2.181 9.377 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -4.803 2.730 10.802 1.00 0.00 H new ATOM 262 N ARG A 17 -6.641 3.997 8.926 1.00 0.00 N ATOM 263 CA ARG A 17 -7.913 4.049 8.215 1.00 0.00 C ATOM 264 C ARG A 17 -7.692 3.943 6.711 1.00 0.00 C ATOM 265 O ARG A 17 -8.585 3.531 5.975 1.00 0.00 O ATOM 266 CB ARG A 17 -8.667 5.340 8.553 1.00 0.00 C ATOM 267 CG ARG A 17 -8.065 6.591 7.925 1.00 0.00 C ATOM 268 CD ARG A 17 -9.097 7.373 7.125 1.00 0.00 C ATOM 269 NE ARG A 17 -9.167 8.772 7.540 1.00 0.00 N ATOM 270 CZ ARG A 17 -8.314 9.710 7.134 1.00 0.00 C ATOM 271 NH1 ARG A 17 -7.322 9.402 6.306 1.00 0.00 N ATOM 272 NH2 ARG A 17 -8.451 10.958 7.558 1.00 0.00 N ATOM 0 H ARG A 17 -6.360 4.878 9.357 1.00 0.00 H new ATOM 0 HA ARG A 17 -8.518 3.201 8.536 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -9.701 5.242 8.223 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -8.688 5.464 9.636 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -7.652 7.228 8.707 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -7.238 6.309 7.274 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -8.849 7.321 6.065 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -10.076 6.910 7.246 1.00 0.00 H new ATOM 0 HE ARG A 17 -9.914 9.046 8.179 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -7.211 8.443 5.978 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -6.671 10.125 5.998 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -9.210 11.200 8.195 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -7.798 11.677 7.247 1.00 0.00 H new ATOM 286 N TYR A 18 -6.495 4.308 6.258 1.00 0.00 N ATOM 287 CA TYR A 18 -6.167 4.237 4.841 1.00 0.00 C ATOM 288 C TYR A 18 -6.383 2.824 4.323 1.00 0.00 C ATOM 289 O TYR A 18 -7.055 2.614 3.313 1.00 0.00 O ATOM 290 CB TYR A 18 -4.715 4.659 4.608 1.00 0.00 C ATOM 291 CG TYR A 18 -4.565 6.052 4.046 1.00 0.00 C ATOM 292 CD1 TYR A 18 -5.242 7.125 4.610 1.00 0.00 C ATOM 293 CD2 TYR A 18 -3.743 6.294 2.954 1.00 0.00 C ATOM 294 CE1 TYR A 18 -5.105 8.401 4.100 1.00 0.00 C ATOM 295 CE2 TYR A 18 -3.600 7.567 2.437 1.00 0.00 C ATOM 296 CZ TYR A 18 -4.283 8.617 3.014 1.00 0.00 C ATOM 297 OH TYR A 18 -4.143 9.888 2.502 1.00 0.00 O ATOM 0 H TYR A 18 -5.741 4.654 6.851 1.00 0.00 H new ATOM 0 HA TYR A 18 -6.823 4.919 4.300 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -4.174 4.599 5.552 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -4.246 3.950 3.926 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -5.886 6.959 5.461 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.206 5.473 2.501 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -5.639 9.225 4.549 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -2.957 7.739 1.586 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.528 9.868 1.739 1.00 0.00 H new ATOM 307 N ALA A 19 -5.816 1.858 5.031 1.00 0.00 N ATOM 308 CA ALA A 19 -5.953 0.463 4.656 1.00 0.00 C ATOM 309 C ALA A 19 -7.388 0.001 4.843 1.00 0.00 C ATOM 310 O ALA A 19 -7.947 -0.675 3.984 1.00 0.00 O ATOM 311 CB ALA A 19 -5.000 -0.401 5.471 1.00 0.00 C ATOM 0 H ALA A 19 -5.257 2.017 5.869 1.00 0.00 H new ATOM 0 HA ALA A 19 -5.695 0.360 3.602 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -5.115 -1.445 5.178 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.974 -0.083 5.288 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -5.229 -0.294 6.531 1.00 0.00 H new ATOM 317 N THR A 20 -7.985 0.373 5.969 1.00 0.00 N ATOM 318 CA THR A 20 -9.360 -0.011 6.252 1.00 0.00 C ATOM 319 C THR A 20 -10.335 0.710 5.331 1.00 0.00 C ATOM 320 O THR A 20 -11.468 0.267 5.154 1.00 0.00 O ATOM 321 CB THR A 20 -9.711 0.255 7.716 1.00 0.00 C ATOM 322 OG1 THR A 20 -8.683 0.988 8.358 1.00 0.00 O ATOM 323 CG2 THR A 20 -9.929 -1.019 8.501 1.00 0.00 C ATOM 0 H THR A 20 -7.542 0.936 6.695 1.00 0.00 H new ATOM 0 HA THR A 20 -9.448 -1.081 6.066 1.00 0.00 H new ATOM 0 HB THR A 20 -10.639 0.826 7.699 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.923 0.396 8.537 1.00 0.00 H new ATOM 0 HG21 THR A 20 -10.175 -0.772 9.534 1.00 0.00 H new ATOM 0 HG22 THR A 20 -10.749 -1.584 8.057 1.00 0.00 H new ATOM 0 HG23 THR A 20 -9.020 -1.620 8.478 1.00 0.00 H new ATOM 331 N ALA A 21 -9.895 1.813 4.732 1.00 0.00 N ATOM 332 CA ALA A 21 -10.751 2.559 3.823 1.00 0.00 C ATOM 333 C ALA A 21 -10.495 2.156 2.377 1.00 0.00 C ATOM 334 O ALA A 21 -11.133 2.668 1.457 1.00 0.00 O ATOM 335 CB ALA A 21 -10.562 4.056 4.010 1.00 0.00 C ATOM 0 H ALA A 21 -8.962 2.204 4.859 1.00 0.00 H new ATOM 0 HA ALA A 21 -11.787 2.316 4.060 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.212 4.594 3.320 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.815 4.329 5.034 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.523 4.319 3.810 1.00 0.00 H new ATOM 341 N LEU A 22 -9.585 1.210 2.187 1.00 0.00 N ATOM 342 CA LEU A 22 -9.273 0.705 0.857 1.00 0.00 C ATOM 343 C LEU A 22 -9.580 -0.769 0.831 1.00 0.00 C ATOM 344 O LEU A 22 -10.179 -1.283 -0.113 1.00 0.00 O ATOM 345 CB LEU A 22 -7.811 0.958 0.495 1.00 0.00 C ATOM 346 CG LEU A 22 -7.427 0.557 -0.931 1.00 0.00 C ATOM 347 CD1 LEU A 22 -6.674 1.681 -1.622 1.00 0.00 C ATOM 348 CD2 LEU A 22 -6.599 -0.720 -0.921 1.00 0.00 C ATOM 0 H LEU A 22 -9.049 0.776 2.939 1.00 0.00 H new ATOM 0 HA LEU A 22 -9.878 1.229 0.117 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -7.595 2.018 0.630 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -7.178 0.412 1.194 1.00 0.00 H new ATOM 0 HG LEU A 22 -8.342 0.368 -1.492 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.411 1.374 -2.634 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -7.304 2.569 -1.664 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.766 1.907 -1.064 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.335 -0.990 -1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.690 -0.560 -0.342 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -7.179 -1.526 -0.471 1.00 0.00 H new ATOM 360 N TYR A 23 -9.203 -1.436 1.907 1.00 0.00 N ATOM 361 CA TYR A 23 -9.476 -2.838 2.049 1.00 0.00 C ATOM 362 C TYR A 23 -10.951 -3.019 2.408 1.00 0.00 C ATOM 363 O TYR A 23 -11.512 -4.092 2.207 1.00 0.00 O ATOM 364 CB TYR A 23 -8.546 -3.455 3.105 1.00 0.00 C ATOM 365 CG TYR A 23 -9.257 -4.032 4.306 1.00 0.00 C ATOM 366 CD1 TYR A 23 -10.043 -5.161 4.175 1.00 0.00 C ATOM 367 CD2 TYR A 23 -9.144 -3.450 5.561 1.00 0.00 C ATOM 368 CE1 TYR A 23 -10.707 -5.699 5.252 1.00 0.00 C ATOM 369 CE2 TYR A 23 -9.802 -3.977 6.646 1.00 0.00 C ATOM 370 CZ TYR A 23 -10.587 -5.103 6.491 1.00 0.00 C ATOM 371 OH TYR A 23 -11.246 -5.633 7.576 1.00 0.00 O ATOM 0 H TYR A 23 -8.705 -1.019 2.694 1.00 0.00 H new ATOM 0 HA TYR A 23 -9.283 -3.359 1.111 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -7.956 -4.242 2.636 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -7.846 -2.692 3.445 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -10.138 -5.630 3.207 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -8.530 -2.570 5.686 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -11.318 -6.581 5.129 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -9.706 -3.513 7.616 1.00 0.00 H new ATOM 0 HH TYR A 23 -11.118 -6.604 7.594 1.00 0.00 H new ATOM 381 N SER A 24 -11.589 -1.951 2.921 1.00 0.00 N ATOM 382 CA SER A 24 -13.006 -2.017 3.271 1.00 0.00 C ATOM 383 C SER A 24 -13.786 -2.618 2.110 1.00 0.00 C ATOM 384 O SER A 24 -14.630 -3.495 2.297 1.00 0.00 O ATOM 385 CB SER A 24 -13.542 -0.623 3.613 1.00 0.00 C ATOM 386 OG SER A 24 -14.890 -0.470 3.201 1.00 0.00 O ATOM 0 H SER A 24 -11.148 -1.048 3.098 1.00 0.00 H new ATOM 0 HA SER A 24 -13.128 -2.649 4.150 1.00 0.00 H new ATOM 0 HB2 SER A 24 -13.468 -0.457 4.688 1.00 0.00 H new ATOM 0 HB3 SER A 24 -12.924 0.134 3.130 1.00 0.00 H new ATOM 0 HG SER A 24 -15.203 0.429 3.435 1.00 0.00 H new ATOM 392 N ALA A 25 -13.461 -2.164 0.903 1.00 0.00 N ATOM 393 CA ALA A 25 -14.092 -2.681 -0.297 1.00 0.00 C ATOM 394 C ALA A 25 -13.577 -4.086 -0.561 1.00 0.00 C ATOM 395 O ALA A 25 -14.316 -4.962 -1.011 1.00 0.00 O ATOM 396 CB ALA A 25 -13.814 -1.773 -1.486 1.00 0.00 C ATOM 0 H ALA A 25 -12.764 -1.439 0.735 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.172 -2.713 -0.152 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.296 -2.180 -2.375 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.208 -0.777 -1.283 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.739 -1.711 -1.653 1.00 0.00 H new ATOM 402 N ALA A 26 -12.301 -4.292 -0.251 1.00 0.00 N ATOM 403 CA ALA A 26 -11.672 -5.594 -0.426 1.00 0.00 C ATOM 404 C ALA A 26 -12.264 -6.616 0.539 1.00 0.00 C ATOM 405 O ALA A 26 -12.271 -7.814 0.260 1.00 0.00 O ATOM 406 CB ALA A 26 -10.171 -5.486 -0.219 1.00 0.00 C ATOM 0 H ALA A 26 -11.683 -3.572 0.123 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.865 -5.932 -1.444 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -9.714 -6.466 -0.353 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.753 -4.789 -0.945 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -9.968 -5.125 0.789 1.00 0.00 H new ATOM 412 N SER A 27 -12.758 -6.133 1.676 1.00 0.00 N ATOM 413 CA SER A 27 -13.355 -7.000 2.685 1.00 0.00 C ATOM 414 C SER A 27 -14.656 -7.601 2.167 1.00 0.00 C ATOM 415 O SER A 27 -14.878 -8.808 2.265 1.00 0.00 O ATOM 416 CB SER A 27 -13.616 -6.213 3.972 1.00 0.00 C ATOM 417 OG SER A 27 -14.896 -5.602 3.952 1.00 0.00 O ATOM 0 H SER A 27 -12.756 -5.143 1.921 1.00 0.00 H new ATOM 0 HA SER A 27 -12.658 -7.810 2.902 1.00 0.00 H new ATOM 0 HB2 SER A 27 -13.543 -6.881 4.830 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.848 -5.449 4.096 1.00 0.00 H new ATOM 0 HG SER A 27 -14.852 -4.766 3.442 1.00 0.00 H new ATOM 423 N LYS A 28 -15.511 -6.749 1.605 1.00 0.00 N ATOM 424 CA LYS A 28 -16.788 -7.196 1.061 1.00 0.00 C ATOM 425 C LYS A 28 -16.569 -8.321 0.056 1.00 0.00 C ATOM 426 O LYS A 28 -17.399 -9.219 -0.080 1.00 0.00 O ATOM 427 CB LYS A 28 -17.521 -6.031 0.392 1.00 0.00 C ATOM 428 CG LYS A 28 -19.035 -6.143 0.465 1.00 0.00 C ATOM 429 CD LYS A 28 -19.713 -5.108 -0.418 1.00 0.00 C ATOM 430 CE LYS A 28 -19.575 -3.708 0.158 1.00 0.00 C ATOM 431 NZ LYS A 28 -19.384 -2.685 -0.906 1.00 0.00 N ATOM 0 H LYS A 28 -15.342 -5.747 1.515 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.401 -7.570 1.881 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -17.211 -5.099 0.864 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -17.219 -5.975 -0.654 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -19.342 -7.143 0.158 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -19.361 -6.013 1.497 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -19.275 -5.137 -1.416 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -20.769 -5.356 -0.526 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -20.465 -3.465 0.739 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -18.729 -3.680 0.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -19.294 -1.745 -0.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -18.521 -2.901 -1.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -20.203 -2.693 -1.547 1.00 0.00 H new ATOM 445 N GLN A 29 -15.436 -8.266 -0.636 1.00 0.00 N ATOM 446 CA GLN A 29 -15.090 -9.280 -1.620 1.00 0.00 C ATOM 447 C GLN A 29 -14.335 -10.425 -0.954 1.00 0.00 C ATOM 448 O GLN A 29 -14.587 -11.594 -1.246 1.00 0.00 O ATOM 449 CB GLN A 29 -14.242 -8.673 -2.738 1.00 0.00 C ATOM 450 CG GLN A 29 -15.023 -7.756 -3.665 1.00 0.00 C ATOM 451 CD GLN A 29 -14.783 -6.288 -3.370 1.00 0.00 C ATOM 452 OE1 GLN A 29 -13.655 -5.802 -3.458 1.00 0.00 O ATOM 453 NE2 GLN A 29 -15.846 -5.573 -3.017 1.00 0.00 N ATOM 0 H GLN A 29 -14.741 -7.527 -0.532 1.00 0.00 H new ATOM 0 HA GLN A 29 -16.011 -9.669 -2.053 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.419 -8.112 -2.295 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -13.800 -9.478 -3.325 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -14.744 -7.966 -4.698 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -16.087 -7.972 -3.572 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -16.762 -6.017 -2.957 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -15.746 -4.580 -2.806 1.00 0.00 H new ATOM 462 N ASN A 30 -13.401 -10.069 -0.064 1.00 0.00 N ATOM 463 CA ASN A 30 -12.579 -11.040 0.664 1.00 0.00 C ATOM 464 C ASN A 30 -11.204 -11.131 0.028 1.00 0.00 C ATOM 465 O ASN A 30 -10.575 -12.188 0.020 1.00 0.00 O ATOM 466 CB ASN A 30 -13.231 -12.428 0.706 1.00 0.00 C ATOM 467 CG ASN A 30 -12.666 -13.300 1.810 1.00 0.00 C ATOM 468 OD1 ASN A 30 -13.101 -13.227 2.959 1.00 0.00 O ATOM 469 ND2 ASN A 30 -11.689 -14.131 1.465 1.00 0.00 N ATOM 0 H ASN A 30 -13.195 -9.098 0.171 1.00 0.00 H new ATOM 0 HA ASN A 30 -12.487 -10.690 1.692 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -14.306 -12.317 0.849 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -13.086 -12.923 -0.254 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -11.268 -14.742 2.165 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -11.359 -14.158 0.500 1.00 0.00 H new ATOM 476 N LYS A 31 -10.747 -10.005 -0.507 1.00 0.00 N ATOM 477 CA LYS A 31 -9.448 -9.941 -1.151 1.00 0.00 C ATOM 478 C LYS A 31 -8.351 -9.594 -0.151 1.00 0.00 C ATOM 479 O LYS A 31 -7.218 -9.331 -0.545 1.00 0.00 O ATOM 480 CB LYS A 31 -9.469 -8.909 -2.281 1.00 0.00 C ATOM 481 CG LYS A 31 -9.905 -9.482 -3.619 1.00 0.00 C ATOM 482 CD LYS A 31 -11.385 -9.245 -3.872 1.00 0.00 C ATOM 483 CE LYS A 31 -11.667 -9.003 -5.347 1.00 0.00 C ATOM 484 NZ LYS A 31 -11.358 -10.201 -6.175 1.00 0.00 N ATOM 0 H LYS A 31 -11.261 -9.124 -0.506 1.00 0.00 H new ATOM 0 HA LYS A 31 -9.231 -10.925 -1.566 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -10.141 -8.096 -2.007 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.474 -8.478 -2.387 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -9.321 -9.026 -4.419 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -9.698 -10.552 -3.643 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.957 -10.107 -3.528 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -11.722 -8.387 -3.291 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.715 -8.733 -5.477 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.074 -8.158 -5.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.611 -10.013 -7.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -10.342 -10.414 -6.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -11.905 -11.014 -5.827 1.00 0.00 H new ATOM 498 N LEU A 32 -8.680 -9.599 1.145 1.00 0.00 N ATOM 499 CA LEU A 32 -7.702 -9.291 2.179 1.00 0.00 C ATOM 500 C LEU A 32 -6.387 -10.018 1.926 1.00 0.00 C ATOM 501 O LEU A 32 -5.319 -9.529 2.284 1.00 0.00 O ATOM 502 CB LEU A 32 -8.273 -9.670 3.540 1.00 0.00 C ATOM 503 CG LEU A 32 -9.251 -8.652 4.123 1.00 0.00 C ATOM 504 CD1 LEU A 32 -8.499 -7.643 4.977 1.00 0.00 C ATOM 505 CD2 LEU A 32 -10.034 -7.952 3.019 1.00 0.00 C ATOM 0 H LEU A 32 -9.613 -9.813 1.496 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.493 -8.221 2.160 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -8.779 -10.632 3.453 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.449 -9.806 4.241 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.968 -9.179 4.752 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.202 -6.920 5.390 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -7.992 -8.161 5.791 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.763 -7.124 4.363 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -10.723 -7.233 3.462 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.342 -7.432 2.356 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.597 -8.690 2.448 1.00 0.00 H new ATOM 517 N GLU A 33 -6.471 -11.176 1.285 1.00 0.00 N ATOM 518 CA GLU A 33 -5.279 -11.952 0.964 1.00 0.00 C ATOM 519 C GLU A 33 -4.549 -11.322 -0.218 1.00 0.00 C ATOM 520 O GLU A 33 -3.321 -11.357 -0.298 1.00 0.00 O ATOM 521 CB GLU A 33 -5.651 -13.401 0.643 1.00 0.00 C ATOM 522 CG GLU A 33 -4.500 -14.377 0.819 1.00 0.00 C ATOM 523 CD GLU A 33 -4.938 -15.689 1.441 1.00 0.00 C ATOM 524 OE1 GLU A 33 -6.046 -16.162 1.109 1.00 0.00 O ATOM 525 OE2 GLU A 33 -4.175 -16.243 2.260 1.00 0.00 O ATOM 0 H GLU A 33 -7.347 -11.598 0.978 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.619 -11.950 1.831 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.477 -13.706 1.285 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -6.009 -13.456 -0.385 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.044 -14.574 -0.151 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.734 -13.920 1.445 1.00 0.00 H new ATOM 532 N GLN A 34 -5.320 -10.733 -1.125 1.00 0.00 N ATOM 533 CA GLN A 34 -4.769 -10.073 -2.302 1.00 0.00 C ATOM 534 C GLN A 34 -4.429 -8.613 -2.003 1.00 0.00 C ATOM 535 O GLN A 34 -3.793 -7.940 -2.812 1.00 0.00 O ATOM 536 CB GLN A 34 -5.760 -10.152 -3.465 1.00 0.00 C ATOM 537 CG GLN A 34 -5.185 -9.680 -4.789 1.00 0.00 C ATOM 538 CD GLN A 34 -4.090 -10.590 -5.310 1.00 0.00 C ATOM 539 OE1 GLN A 34 -3.952 -11.731 -4.869 1.00 0.00 O ATOM 540 NE2 GLN A 34 -3.303 -10.087 -6.255 1.00 0.00 N ATOM 0 H GLN A 34 -6.338 -10.700 -1.066 1.00 0.00 H new ATOM 0 HA GLN A 34 -3.850 -10.589 -2.580 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -6.099 -11.182 -3.573 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -6.637 -9.551 -3.225 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -5.985 -9.621 -5.527 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -4.788 -8.672 -4.669 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -3.454 -9.136 -6.591 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -2.548 -10.652 -6.644 1.00 0.00 H new ATOM 549 N VAL A 35 -4.852 -8.130 -0.836 1.00 0.00 N ATOM 550 CA VAL A 35 -4.583 -6.752 -0.435 1.00 0.00 C ATOM 551 C VAL A 35 -3.582 -6.711 0.716 1.00 0.00 C ATOM 552 O VAL A 35 -2.785 -5.779 0.826 1.00 0.00 O ATOM 553 CB VAL A 35 -5.867 -6.007 0.005 1.00 0.00 C ATOM 554 CG1 VAL A 35 -5.777 -4.536 -0.368 1.00 0.00 C ATOM 555 CG2 VAL A 35 -7.125 -6.639 -0.593 1.00 0.00 C ATOM 0 H VAL A 35 -5.381 -8.672 -0.153 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.172 -6.252 -1.312 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.945 -6.093 1.089 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.686 -4.024 -0.053 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.917 -4.087 0.129 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.663 -4.441 -1.448 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.003 -6.086 -0.260 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.067 -6.606 -1.681 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.202 -7.676 -0.265 1.00 0.00 H new ATOM 565 N GLU A 36 -3.623 -7.733 1.567 1.00 0.00 N ATOM 566 CA GLU A 36 -2.714 -7.818 2.705 1.00 0.00 C ATOM 567 C GLU A 36 -1.330 -8.217 2.225 1.00 0.00 C ATOM 568 O GLU A 36 -0.328 -7.607 2.601 1.00 0.00 O ATOM 569 CB GLU A 36 -3.222 -8.827 3.736 1.00 0.00 C ATOM 570 CG GLU A 36 -2.377 -8.886 4.998 1.00 0.00 C ATOM 571 CD GLU A 36 -1.324 -9.975 4.944 1.00 0.00 C ATOM 572 OE1 GLU A 36 -0.987 -10.421 3.827 1.00 0.00 O ATOM 573 OE2 GLU A 36 -0.837 -10.384 6.019 1.00 0.00 O ATOM 0 H GLU A 36 -4.276 -8.513 1.490 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.665 -6.840 3.183 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -4.247 -8.572 4.007 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.249 -9.817 3.280 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -1.891 -7.923 5.150 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.026 -9.055 5.858 1.00 0.00 H new ATOM 580 N LYS A 37 -1.288 -9.223 1.361 1.00 0.00 N ATOM 581 CA LYS A 37 -0.031 -9.677 0.793 1.00 0.00 C ATOM 582 C LYS A 37 0.498 -8.601 -0.139 1.00 0.00 C ATOM 583 O LYS A 37 1.705 -8.471 -0.346 1.00 0.00 O ATOM 584 CB LYS A 37 -0.221 -10.993 0.036 1.00 0.00 C ATOM 585 CG LYS A 37 -0.365 -12.202 0.946 1.00 0.00 C ATOM 586 CD LYS A 37 0.950 -12.548 1.625 1.00 0.00 C ATOM 587 CE LYS A 37 1.918 -13.212 0.659 1.00 0.00 C ATOM 588 NZ LYS A 37 3.332 -12.851 0.954 1.00 0.00 N ATOM 0 H LYS A 37 -2.109 -9.737 1.041 1.00 0.00 H new ATOM 0 HA LYS A 37 0.686 -9.857 1.594 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -1.107 -10.915 -0.594 1.00 0.00 H new ATOM 0 HB3 LYS A 37 0.630 -11.147 -0.628 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -1.124 -12.001 1.702 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -0.712 -13.057 0.365 1.00 0.00 H new ATOM 0 HD2 LYS A 37 1.402 -11.642 2.029 1.00 0.00 H new ATOM 0 HD3 LYS A 37 0.762 -13.213 2.468 1.00 0.00 H new ATOM 0 HE2 LYS A 37 1.801 -14.294 0.714 1.00 0.00 H new ATOM 0 HE3 LYS A 37 1.673 -12.916 -0.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 3.960 -13.324 0.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 3.451 -11.821 0.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 3.574 -13.156 1.918 1.00 0.00 H new ATOM 602 N GLU A 38 -0.429 -7.814 -0.682 1.00 0.00 N ATOM 603 CA GLU A 38 -0.087 -6.726 -1.573 1.00 0.00 C ATOM 604 C GLU A 38 0.157 -5.440 -0.781 1.00 0.00 C ATOM 605 O GLU A 38 0.212 -4.350 -1.346 1.00 0.00 O ATOM 606 CB GLU A 38 -1.211 -6.521 -2.582 1.00 0.00 C ATOM 607 CG GLU A 38 -1.117 -7.436 -3.793 1.00 0.00 C ATOM 608 CD GLU A 38 -1.105 -8.904 -3.413 1.00 0.00 C ATOM 609 OE1 GLU A 38 -0.101 -9.356 -2.823 1.00 0.00 O ATOM 610 OE2 GLU A 38 -2.099 -9.602 -3.704 1.00 0.00 O ATOM 0 H GLU A 38 -1.430 -7.918 -0.513 1.00 0.00 H new ATOM 0 HA GLU A 38 0.831 -6.978 -2.104 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.168 -6.686 -2.086 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.201 -5.484 -2.919 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.960 -7.243 -4.456 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.211 -7.201 -4.352 1.00 0.00 H new ATOM 617 N LEU A 39 0.314 -5.576 0.531 1.00 0.00 N ATOM 618 CA LEU A 39 0.574 -4.433 1.394 1.00 0.00 C ATOM 619 C LEU A 39 1.988 -4.529 1.948 1.00 0.00 C ATOM 620 O LEU A 39 2.658 -3.517 2.155 1.00 0.00 O ATOM 621 CB LEU A 39 -0.449 -4.370 2.531 1.00 0.00 C ATOM 622 CG LEU A 39 -1.420 -3.187 2.457 1.00 0.00 C ATOM 623 CD1 LEU A 39 -2.847 -3.646 2.716 1.00 0.00 C ATOM 624 CD2 LEU A 39 -1.019 -2.105 3.449 1.00 0.00 C ATOM 0 H LEU A 39 0.265 -6.470 1.020 1.00 0.00 H new ATOM 0 HA LEU A 39 0.481 -3.517 0.811 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.025 -5.295 2.534 1.00 0.00 H new ATOM 0 HB3 LEU A 39 0.086 -4.324 3.480 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.373 -2.768 1.452 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -3.520 -2.791 2.659 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -3.133 -4.384 1.967 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -2.911 -4.093 3.708 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -1.720 -1.273 3.383 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -1.036 -2.514 4.459 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -0.014 -1.753 3.217 1.00 0.00 H new ATOM 636 N LEU A 40 2.444 -5.761 2.164 1.00 0.00 N ATOM 637 CA LEU A 40 3.786 -6.000 2.665 1.00 0.00 C ATOM 638 C LEU A 40 4.807 -5.737 1.563 1.00 0.00 C ATOM 639 O LEU A 40 5.955 -5.387 1.836 1.00 0.00 O ATOM 640 CB LEU A 40 3.920 -7.436 3.175 1.00 0.00 C ATOM 641 CG LEU A 40 4.945 -7.634 4.292 1.00 0.00 C ATOM 642 CD1 LEU A 40 4.363 -7.210 5.632 1.00 0.00 C ATOM 643 CD2 LEU A 40 5.404 -9.083 4.342 1.00 0.00 C ATOM 0 H LEU A 40 1.899 -6.607 1.998 1.00 0.00 H new ATOM 0 HA LEU A 40 3.975 -5.320 3.495 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.946 -7.770 3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.190 -8.079 2.337 1.00 0.00 H new ATOM 0 HG LEU A 40 5.811 -7.006 4.081 1.00 0.00 H new ATOM 0 HD11 LEU A 40 5.107 -7.358 6.415 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.084 -6.157 5.591 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.480 -7.811 5.852 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.133 -9.206 5.143 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.547 -9.730 4.529 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.861 -9.353 3.390 1.00 0.00 H new ATOM 655 N ARG A 41 4.375 -5.901 0.312 1.00 0.00 N ATOM 656 CA ARG A 41 5.248 -5.672 -0.830 1.00 0.00 C ATOM 657 C ARG A 41 5.637 -4.200 -0.915 1.00 0.00 C ATOM 658 O ARG A 41 6.795 -3.868 -1.165 1.00 0.00 O ATOM 659 CB ARG A 41 4.557 -6.110 -2.124 1.00 0.00 C ATOM 660 CG ARG A 41 5.067 -7.435 -2.668 1.00 0.00 C ATOM 661 CD ARG A 41 4.936 -8.546 -1.638 1.00 0.00 C ATOM 662 NE ARG A 41 5.756 -9.707 -1.977 1.00 0.00 N ATOM 663 CZ ARG A 41 7.087 -9.707 -1.953 1.00 0.00 C ATOM 664 NH1 ARG A 41 7.752 -8.611 -1.608 1.00 0.00 N ATOM 665 NH2 ARG A 41 7.755 -10.806 -2.276 1.00 0.00 N ATOM 0 H ARG A 41 3.428 -6.191 0.069 1.00 0.00 H new ATOM 0 HA ARG A 41 6.153 -6.265 -0.698 1.00 0.00 H new ATOM 0 HB2 ARG A 41 3.485 -6.189 -1.945 1.00 0.00 H new ATOM 0 HB3 ARG A 41 4.698 -5.338 -2.880 1.00 0.00 H new ATOM 0 HG2 ARG A 41 4.508 -7.701 -3.565 1.00 0.00 H new ATOM 0 HG3 ARG A 41 6.111 -7.331 -2.962 1.00 0.00 H new ATOM 0 HD2 ARG A 41 5.230 -8.169 -0.658 1.00 0.00 H new ATOM 0 HD3 ARG A 41 3.892 -8.849 -1.563 1.00 0.00 H new ATOM 0 HE ARG A 41 5.281 -10.568 -2.248 1.00 0.00 H new ATOM 0 HH11 ARG A 41 7.243 -7.763 -1.359 1.00 0.00 H new ATOM 0 HH12 ARG A 41 8.772 -8.617 -1.591 1.00 0.00 H new ATOM 0 HH21 ARG A 41 7.249 -11.651 -2.543 1.00 0.00 H new ATOM 0 HH22 ARG A 41 8.775 -10.807 -2.258 1.00 0.00 H new ATOM 679 N VAL A 42 4.661 -3.323 -0.698 1.00 0.00 N ATOM 680 CA VAL A 42 4.904 -1.887 -0.743 1.00 0.00 C ATOM 681 C VAL A 42 5.935 -1.479 0.303 1.00 0.00 C ATOM 682 O VAL A 42 6.653 -0.494 0.130 1.00 0.00 O ATOM 683 CB VAL A 42 3.602 -1.091 -0.519 1.00 0.00 C ATOM 684 CG1 VAL A 42 3.868 0.407 -0.574 1.00 0.00 C ATOM 685 CG2 VAL A 42 2.550 -1.490 -1.544 1.00 0.00 C ATOM 0 H VAL A 42 3.697 -3.582 -0.490 1.00 0.00 H new ATOM 0 HA VAL A 42 5.289 -1.655 -1.736 1.00 0.00 H new ATOM 0 HB VAL A 42 3.221 -1.330 0.474 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.936 0.948 -0.413 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.583 0.678 0.202 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.276 0.669 -1.550 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.638 -0.918 -1.371 1.00 0.00 H new ATOM 0 HG22 VAL A 42 2.923 -1.283 -2.547 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.335 -2.554 -1.449 1.00 0.00 H new ATOM 695 N GLY A 43 6.010 -2.247 1.384 1.00 0.00 N ATOM 696 CA GLY A 43 6.963 -1.953 2.437 1.00 0.00 C ATOM 697 C GLY A 43 8.381 -2.297 2.033 1.00 0.00 C ATOM 698 O GLY A 43 9.310 -1.530 2.283 1.00 0.00 O ATOM 0 H GLY A 43 5.428 -3.068 1.550 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.906 -0.895 2.692 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.696 -2.512 3.334 1.00 0.00 H new ATOM 702 N GLN A 44 8.545 -3.453 1.396 1.00 0.00 N ATOM 703 CA GLN A 44 9.858 -3.895 0.947 1.00 0.00 C ATOM 704 C GLN A 44 10.408 -2.944 -0.110 1.00 0.00 C ATOM 705 O GLN A 44 11.619 -2.742 -0.212 1.00 0.00 O ATOM 706 CB GLN A 44 9.778 -5.314 0.381 1.00 0.00 C ATOM 707 CG GLN A 44 11.019 -6.149 0.654 1.00 0.00 C ATOM 708 CD GLN A 44 10.830 -7.114 1.808 1.00 0.00 C ATOM 709 OE1 GLN A 44 10.002 -8.023 1.745 1.00 0.00 O ATOM 710 NE2 GLN A 44 11.600 -6.919 2.873 1.00 0.00 N ATOM 0 H GLN A 44 7.785 -4.098 1.180 1.00 0.00 H new ATOM 0 HA GLN A 44 10.531 -3.895 1.804 1.00 0.00 H new ATOM 0 HB2 GLN A 44 8.910 -5.818 0.807 1.00 0.00 H new ATOM 0 HB3 GLN A 44 9.617 -5.258 -0.696 1.00 0.00 H new ATOM 0 HG2 GLN A 44 11.280 -6.709 -0.244 1.00 0.00 H new ATOM 0 HG3 GLN A 44 11.857 -5.487 0.872 1.00 0.00 H new ATOM 0 HE21 GLN A 44 12.273 -6.153 2.882 1.00 0.00 H new ATOM 0 HE22 GLN A 44 11.518 -7.536 3.681 1.00 0.00 H new ATOM 719 N ILE A 45 9.507 -2.356 -0.892 1.00 0.00 N ATOM 720 CA ILE A 45 9.897 -1.418 -1.936 1.00 0.00 C ATOM 721 C ILE A 45 10.606 -0.207 -1.338 1.00 0.00 C ATOM 722 O ILE A 45 11.679 0.183 -1.795 1.00 0.00 O ATOM 723 CB ILE A 45 8.670 -0.955 -2.751 1.00 0.00 C ATOM 724 CG1 ILE A 45 8.017 -2.152 -3.444 1.00 0.00 C ATOM 725 CG2 ILE A 45 9.061 0.105 -3.775 1.00 0.00 C ATOM 726 CD1 ILE A 45 6.571 -1.918 -3.825 1.00 0.00 C ATOM 0 H ILE A 45 8.502 -2.514 -0.821 1.00 0.00 H new ATOM 0 HA ILE A 45 10.585 -1.936 -2.605 1.00 0.00 H new ATOM 0 HB ILE A 45 7.951 -0.509 -2.064 1.00 0.00 H new ATOM 0 HG12 ILE A 45 8.585 -2.396 -4.342 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.075 -3.018 -2.785 1.00 0.00 H new ATOM 0 HG21 ILE A 45 8.178 0.413 -4.335 1.00 0.00 H new ATOM 0 HG22 ILE A 45 9.485 0.968 -3.262 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.800 -0.308 -4.462 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.174 -2.809 -4.312 1.00 0.00 H new ATOM 0 HD12 ILE A 45 5.989 -1.704 -2.929 1.00 0.00 H new ATOM 0 HD13 ILE A 45 6.507 -1.072 -4.509 1.00 0.00 H new ATOM 738 N LEU A 46 10.001 0.384 -0.313 1.00 0.00 N ATOM 739 CA LEU A 46 10.581 1.549 0.343 1.00 0.00 C ATOM 740 C LEU A 46 11.838 1.167 1.118 1.00 0.00 C ATOM 741 O LEU A 46 12.767 1.963 1.245 1.00 0.00 O ATOM 742 CB LEU A 46 9.561 2.193 1.283 1.00 0.00 C ATOM 743 CG LEU A 46 8.159 2.362 0.696 1.00 0.00 C ATOM 744 CD1 LEU A 46 7.277 3.157 1.645 1.00 0.00 C ATOM 745 CD2 LEU A 46 8.230 3.038 -0.665 1.00 0.00 C ATOM 0 H LEU A 46 9.112 0.076 0.080 1.00 0.00 H new ATOM 0 HA LEU A 46 10.857 2.269 -0.427 1.00 0.00 H new ATOM 0 HB2 LEU A 46 9.490 1.588 2.187 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.934 3.172 1.583 1.00 0.00 H new ATOM 0 HG LEU A 46 7.717 1.374 0.565 1.00 0.00 H new ATOM 0 HD11 LEU A 46 6.283 3.268 1.211 1.00 0.00 H new ATOM 0 HD12 LEU A 46 7.201 2.632 2.597 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.714 4.142 1.808 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.224 3.150 -1.068 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.691 4.020 -0.560 1.00 0.00 H new ATOM 0 HD23 LEU A 46 8.827 2.428 -1.343 1.00 0.00 H new ATOM 757 N LYS A 47 11.863 -0.061 1.625 1.00 0.00 N ATOM 758 CA LYS A 47 13.010 -0.552 2.376 1.00 0.00 C ATOM 759 C LYS A 47 14.159 -0.885 1.431 1.00 0.00 C ATOM 760 O LYS A 47 15.327 -0.833 1.813 1.00 0.00 O ATOM 761 CB LYS A 47 12.626 -1.790 3.189 1.00 0.00 C ATOM 762 CG LYS A 47 13.655 -2.170 4.242 1.00 0.00 C ATOM 763 CD LYS A 47 13.725 -3.676 4.433 1.00 0.00 C ATOM 764 CE LYS A 47 12.873 -4.128 5.608 1.00 0.00 C ATOM 765 NZ LYS A 47 13.330 -5.436 6.155 1.00 0.00 N ATOM 0 H LYS A 47 11.102 -0.733 1.529 1.00 0.00 H new ATOM 0 HA LYS A 47 13.333 0.231 3.062 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.668 -1.611 3.677 1.00 0.00 H new ATOM 0 HB3 LYS A 47 12.486 -2.631 2.510 1.00 0.00 H new ATOM 0 HG2 LYS A 47 14.635 -1.793 3.948 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.402 -1.693 5.189 1.00 0.00 H new ATOM 0 HD2 LYS A 47 13.388 -4.175 3.524 1.00 0.00 H new ATOM 0 HD3 LYS A 47 14.760 -3.976 4.596 1.00 0.00 H new ATOM 0 HE2 LYS A 47 12.909 -3.373 6.394 1.00 0.00 H new ATOM 0 HE3 LYS A 47 11.833 -4.210 5.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 12.723 -5.709 6.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 13.272 -6.162 5.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 14.314 -5.351 6.480 1.00 0.00 H new ATOM 779 N GLU A 48 13.813 -1.224 0.193 1.00 0.00 N ATOM 780 CA GLU A 48 14.808 -1.561 -0.814 1.00 0.00 C ATOM 781 C GLU A 48 15.705 -0.359 -1.113 1.00 0.00 C ATOM 782 O GLU A 48 15.246 0.638 -1.668 1.00 0.00 O ATOM 783 CB GLU A 48 14.118 -2.027 -2.098 1.00 0.00 C ATOM 784 CG GLU A 48 13.980 -3.537 -2.199 1.00 0.00 C ATOM 785 CD GLU A 48 15.056 -4.166 -3.062 1.00 0.00 C ATOM 786 OE1 GLU A 48 15.202 -3.745 -4.229 1.00 0.00 O ATOM 787 OE2 GLU A 48 15.754 -5.078 -2.571 1.00 0.00 O ATOM 0 H GLU A 48 12.849 -1.272 -0.135 1.00 0.00 H new ATOM 0 HA GLU A 48 15.429 -2.369 -0.426 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.128 -1.575 -2.153 1.00 0.00 H new ATOM 0 HB3 GLU A 48 14.682 -1.664 -2.957 1.00 0.00 H new ATOM 0 HG2 GLU A 48 14.023 -3.969 -1.199 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.001 -3.782 -2.610 1.00 0.00 H new ATOM 794 N PRO A 49 16.998 -0.433 -0.746 1.00 0.00 N ATOM 795 CA PRO A 49 17.945 0.663 -0.980 1.00 0.00 C ATOM 796 C PRO A 49 17.899 1.182 -2.415 1.00 0.00 C ATOM 797 O PRO A 49 18.244 2.333 -2.680 1.00 0.00 O ATOM 798 CB PRO A 49 19.302 0.022 -0.687 1.00 0.00 C ATOM 799 CG PRO A 49 19.002 -1.063 0.286 1.00 0.00 C ATOM 800 CD PRO A 49 17.637 -1.581 -0.075 1.00 0.00 C ATOM 0 HA PRO A 49 17.722 1.532 -0.361 1.00 0.00 H new ATOM 0 HB2 PRO A 49 19.758 -0.374 -1.595 1.00 0.00 H new ATOM 0 HB3 PRO A 49 20.001 0.747 -0.270 1.00 0.00 H new ATOM 0 HG2 PRO A 49 19.748 -1.856 0.228 1.00 0.00 H new ATOM 0 HG3 PRO A 49 19.018 -0.685 1.308 1.00 0.00 H new ATOM 0 HD2 PRO A 49 17.698 -2.447 -0.734 1.00 0.00 H new ATOM 0 HD3 PRO A 49 17.079 -1.891 0.809 1.00 0.00 H new ATOM 808 N LYS A 50 17.472 0.326 -3.339 1.00 0.00 N ATOM 809 CA LYS A 50 17.384 0.700 -4.745 1.00 0.00 C ATOM 810 C LYS A 50 16.111 1.495 -5.026 1.00 0.00 C ATOM 811 O LYS A 50 16.072 2.319 -5.939 1.00 0.00 O ATOM 812 CB LYS A 50 17.423 -0.548 -5.629 1.00 0.00 C ATOM 813 CG LYS A 50 18.031 -0.302 -7.000 1.00 0.00 C ATOM 814 CD LYS A 50 17.382 -1.175 -8.062 1.00 0.00 C ATOM 815 CE LYS A 50 17.851 -2.619 -7.960 1.00 0.00 C ATOM 816 NZ LYS A 50 17.086 -3.516 -8.869 1.00 0.00 N ATOM 0 H LYS A 50 17.182 -0.631 -3.138 1.00 0.00 H new ATOM 0 HA LYS A 50 18.241 1.332 -4.977 1.00 0.00 H new ATOM 0 HB2 LYS A 50 17.994 -1.325 -5.121 1.00 0.00 H new ATOM 0 HB3 LYS A 50 16.409 -0.927 -5.753 1.00 0.00 H new ATOM 0 HG2 LYS A 50 17.913 0.748 -7.268 1.00 0.00 H new ATOM 0 HG3 LYS A 50 19.102 -0.504 -6.966 1.00 0.00 H new ATOM 0 HD2 LYS A 50 16.298 -1.135 -7.955 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.619 -0.783 -9.051 1.00 0.00 H new ATOM 0 HE2 LYS A 50 18.912 -2.674 -8.204 1.00 0.00 H new ATOM 0 HE3 LYS A 50 17.742 -2.965 -6.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 17.435 -4.491 -8.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 16.077 -3.483 -8.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 17.211 -3.202 -9.853 1.00 0.00 H new ATOM 830 N MET A 51 15.069 1.240 -4.239 1.00 0.00 N ATOM 831 CA MET A 51 13.796 1.932 -4.411 1.00 0.00 C ATOM 832 C MET A 51 13.655 3.085 -3.419 1.00 0.00 C ATOM 833 O MET A 51 12.956 4.062 -3.686 1.00 0.00 O ATOM 834 CB MET A 51 12.633 0.952 -4.243 1.00 0.00 C ATOM 835 CG MET A 51 11.995 0.538 -5.560 1.00 0.00 C ATOM 836 SD MET A 51 12.494 -1.113 -6.087 1.00 0.00 S ATOM 837 CE MET A 51 11.746 -2.116 -4.805 1.00 0.00 C ATOM 0 H MET A 51 15.081 0.561 -3.478 1.00 0.00 H new ATOM 0 HA MET A 51 13.773 2.346 -5.419 1.00 0.00 H new ATOM 0 HB2 MET A 51 12.990 0.062 -3.725 1.00 0.00 H new ATOM 0 HB3 MET A 51 11.873 1.407 -3.607 1.00 0.00 H new ATOM 0 HG2 MET A 51 10.910 0.570 -5.459 1.00 0.00 H new ATOM 0 HG3 MET A 51 12.265 1.258 -6.332 1.00 0.00 H new ATOM 0 HE1 MET A 51 12.363 -2.996 -4.625 1.00 0.00 H new ATOM 0 HE2 MET A 51 11.668 -1.534 -3.887 1.00 0.00 H new ATOM 0 HE3 MET A 51 10.751 -2.429 -5.122 1.00 0.00 H new ATOM 847 N ALA A 52 14.321 2.965 -2.275 1.00 0.00 N ATOM 848 CA ALA A 52 14.266 3.997 -1.246 1.00 0.00 C ATOM 849 C ALA A 52 14.726 5.345 -1.791 1.00 0.00 C ATOM 850 O ALA A 52 14.075 6.368 -1.576 1.00 0.00 O ATOM 851 CB ALA A 52 15.115 3.593 -0.050 1.00 0.00 C ATOM 0 H ALA A 52 14.905 2.163 -2.037 1.00 0.00 H new ATOM 0 HA ALA A 52 13.229 4.100 -0.926 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.066 4.372 0.711 1.00 0.00 H new ATOM 0 HB2 ALA A 52 14.739 2.657 0.364 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.150 3.460 -0.366 1.00 0.00 H new ATOM 857 N ALA A 53 15.852 5.340 -2.497 1.00 0.00 N ATOM 858 CA ALA A 53 16.400 6.563 -3.071 1.00 0.00 C ATOM 859 C ALA A 53 15.489 7.114 -4.165 1.00 0.00 C ATOM 860 O ALA A 53 15.461 8.320 -4.411 1.00 0.00 O ATOM 861 CB ALA A 53 17.794 6.307 -3.623 1.00 0.00 C ATOM 0 H ALA A 53 16.403 4.502 -2.685 1.00 0.00 H new ATOM 0 HA ALA A 53 16.465 7.309 -2.279 1.00 0.00 H new ATOM 0 HB1 ALA A 53 18.192 7.228 -4.049 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.447 5.967 -2.819 1.00 0.00 H new ATOM 0 HB3 ALA A 53 17.744 5.542 -4.397 1.00 0.00 H new ATOM 867 N SER A 54 14.749 6.224 -4.820 1.00 0.00 N ATOM 868 CA SER A 54 13.841 6.625 -5.889 1.00 0.00 C ATOM 869 C SER A 54 12.509 7.109 -5.324 1.00 0.00 C ATOM 870 O SER A 54 11.834 7.942 -5.930 1.00 0.00 O ATOM 871 CB SER A 54 13.606 5.457 -6.848 1.00 0.00 C ATOM 872 OG SER A 54 14.827 4.992 -7.395 1.00 0.00 O ATOM 0 H SER A 54 14.760 5.222 -4.629 1.00 0.00 H new ATOM 0 HA SER A 54 14.303 7.449 -6.433 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.107 4.644 -6.320 1.00 0.00 H new ATOM 0 HB3 SER A 54 12.940 5.771 -7.652 1.00 0.00 H new ATOM 0 HG SER A 54 15.133 4.208 -6.893 1.00 0.00 H new ATOM 878 N LEU A 55 12.133 6.584 -4.164 1.00 0.00 N ATOM 879 CA LEU A 55 10.878 6.964 -3.524 1.00 0.00 C ATOM 880 C LEU A 55 11.059 8.184 -2.620 1.00 0.00 C ATOM 881 O LEU A 55 10.081 8.754 -2.135 1.00 0.00 O ATOM 882 CB LEU A 55 10.323 5.792 -2.712 1.00 0.00 C ATOM 883 CG LEU A 55 9.655 4.690 -3.542 1.00 0.00 C ATOM 884 CD1 LEU A 55 10.332 3.350 -3.301 1.00 0.00 C ATOM 885 CD2 LEU A 55 8.169 4.606 -3.221 1.00 0.00 C ATOM 0 H LEU A 55 12.678 5.894 -3.647 1.00 0.00 H new ATOM 0 HA LEU A 55 10.170 7.227 -4.310 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.136 5.350 -2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.598 6.177 -1.995 1.00 0.00 H new ATOM 0 HG LEU A 55 9.765 4.942 -4.597 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.842 2.582 -3.900 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.382 3.417 -3.585 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.257 3.089 -2.245 1.00 0.00 H new ATOM 0 HD21 LEU A 55 7.711 3.818 -3.820 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.038 4.380 -2.163 1.00 0.00 H new ATOM 0 HD23 LEU A 55 7.693 5.559 -3.451 1.00 0.00 H new ATOM 897 N LEU A 56 12.309 8.578 -2.391 1.00 0.00 N ATOM 898 CA LEU A 56 12.602 9.728 -1.540 1.00 0.00 C ATOM 899 C LEU A 56 13.155 10.894 -2.357 1.00 0.00 C ATOM 900 O LEU A 56 13.087 12.047 -1.930 1.00 0.00 O ATOM 901 CB LEU A 56 13.601 9.337 -0.450 1.00 0.00 C ATOM 902 CG LEU A 56 13.460 10.108 0.863 1.00 0.00 C ATOM 903 CD1 LEU A 56 13.841 11.568 0.668 1.00 0.00 C ATOM 904 CD2 LEU A 56 12.041 9.994 1.399 1.00 0.00 C ATOM 0 H LEU A 56 13.133 8.120 -2.781 1.00 0.00 H new ATOM 0 HA LEU A 56 11.669 10.048 -1.076 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.491 8.273 -0.242 1.00 0.00 H new ATOM 0 HB3 LEU A 56 14.611 9.484 -0.834 1.00 0.00 H new ATOM 0 HG LEU A 56 14.140 9.670 1.594 1.00 0.00 H new ATOM 0 HD11 LEU A 56 13.735 12.101 1.613 1.00 0.00 H new ATOM 0 HD12 LEU A 56 14.875 11.632 0.330 1.00 0.00 H new ATOM 0 HD13 LEU A 56 13.187 12.018 -0.078 1.00 0.00 H new ATOM 0 HD21 LEU A 56 11.959 10.549 2.334 1.00 0.00 H new ATOM 0 HD22 LEU A 56 11.343 10.406 0.670 1.00 0.00 H new ATOM 0 HD23 LEU A 56 11.803 8.945 1.577 1.00 0.00 H new ATOM 916 N ASN A 57 13.707 10.591 -3.529 1.00 0.00 N ATOM 917 CA ASN A 57 14.273 11.619 -4.393 1.00 0.00 C ATOM 918 C ASN A 57 13.173 12.459 -5.044 1.00 0.00 C ATOM 919 O ASN A 57 12.300 11.923 -5.727 1.00 0.00 O ATOM 920 CB ASN A 57 15.141 10.978 -5.477 1.00 0.00 C ATOM 921 CG ASN A 57 16.590 10.835 -5.050 1.00 0.00 C ATOM 922 OD1 ASN A 57 16.802 10.450 -3.796 1.00 0.00 O flip ATOM 923 ND2 ASN A 57 17.507 11.068 -5.837 1.00 0.00 N flip ATOM 0 H ASN A 57 13.774 9.643 -3.900 1.00 0.00 H new ATOM 0 HA ASN A 57 14.888 12.274 -3.776 1.00 0.00 H new ATOM 0 HB2 ASN A 57 14.740 9.995 -5.726 1.00 0.00 H new ATOM 0 HB3 ASN A 57 15.090 11.582 -6.383 1.00 0.00 H new ATOM 0 HD21 ASN A 57 17.298 11.361 -6.791 1.00 0.00 H new ATOM 0 HD22 ASN A 57 18.476 10.968 -5.535 1.00 0.00 H new ATOM 930 N PRO A 58 13.198 13.792 -4.847 1.00 0.00 N ATOM 931 CA PRO A 58 12.196 14.695 -5.428 1.00 0.00 C ATOM 932 C PRO A 58 12.278 14.760 -6.954 1.00 0.00 C ATOM 933 O PRO A 58 11.437 15.379 -7.603 1.00 0.00 O ATOM 934 CB PRO A 58 12.535 16.066 -4.822 1.00 0.00 C ATOM 935 CG PRO A 58 13.463 15.785 -3.689 1.00 0.00 C ATOM 936 CD PRO A 58 14.194 14.527 -4.054 1.00 0.00 C ATOM 0 HA PRO A 58 11.183 14.357 -5.208 1.00 0.00 H new ATOM 0 HB2 PRO A 58 13.004 16.716 -5.561 1.00 0.00 H new ATOM 0 HB3 PRO A 58 11.635 16.575 -4.475 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.158 16.611 -3.541 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.913 15.660 -2.756 1.00 0.00 H new ATOM 0 HD2 PRO A 58 15.096 14.735 -4.630 1.00 0.00 H new ATOM 0 HD3 PRO A 58 14.502 13.967 -3.171 1.00 0.00 H new ATOM 944 N TYR A 59 13.302 14.124 -7.516 1.00 0.00 N ATOM 945 CA TYR A 59 13.503 14.113 -8.960 1.00 0.00 C ATOM 946 C TYR A 59 12.595 13.093 -9.643 1.00 0.00 C ATOM 947 O TYR A 59 12.356 13.172 -10.849 1.00 0.00 O ATOM 948 CB TYR A 59 14.968 13.807 -9.275 1.00 0.00 C ATOM 949 CG TYR A 59 15.937 14.675 -8.504 1.00 0.00 C ATOM 950 CD1 TYR A 59 16.267 14.379 -7.188 1.00 0.00 C ATOM 951 CD2 TYR A 59 16.516 15.794 -9.089 1.00 0.00 C ATOM 952 CE1 TYR A 59 17.145 15.172 -6.476 1.00 0.00 C ATOM 953 CE2 TYR A 59 17.395 16.593 -8.384 1.00 0.00 C ATOM 954 CZ TYR A 59 17.706 16.278 -7.078 1.00 0.00 C ATOM 955 OH TYR A 59 18.581 17.071 -6.371 1.00 0.00 O ATOM 0 H TYR A 59 14.007 13.608 -6.990 1.00 0.00 H new ATOM 0 HA TYR A 59 13.245 15.099 -9.346 1.00 0.00 H new ATOM 0 HB2 TYR A 59 15.170 12.760 -9.050 1.00 0.00 H new ATOM 0 HB3 TYR A 59 15.139 13.943 -10.343 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.829 13.513 -6.713 1.00 0.00 H new ATOM 0 HD2 TYR A 59 16.275 16.043 -10.112 1.00 0.00 H new ATOM 0 HE1 TYR A 59 17.391 14.927 -5.453 1.00 0.00 H new ATOM 0 HE2 TYR A 59 17.836 17.460 -8.853 1.00 0.00 H new ATOM 0 HH TYR A 59 18.887 17.808 -6.940 1.00 0.00 H new ATOM 965 N VAL A 60 12.092 12.134 -8.871 1.00 0.00 N ATOM 966 CA VAL A 60 11.213 11.103 -9.410 1.00 0.00 C ATOM 967 C VAL A 60 9.818 11.653 -9.712 1.00 0.00 C ATOM 968 O VAL A 60 8.984 10.957 -10.290 1.00 0.00 O ATOM 969 CB VAL A 60 11.086 9.914 -8.440 1.00 0.00 C ATOM 970 CG1 VAL A 60 12.433 9.233 -8.253 1.00 0.00 C ATOM 971 CG2 VAL A 60 10.515 10.369 -7.103 1.00 0.00 C ATOM 0 H VAL A 60 12.278 12.050 -7.872 1.00 0.00 H new ATOM 0 HA VAL A 60 11.667 10.762 -10.340 1.00 0.00 H new ATOM 0 HB VAL A 60 10.396 9.189 -8.871 1.00 0.00 H new ATOM 0 HG11 VAL A 60 12.325 8.395 -7.564 1.00 0.00 H new ATOM 0 HG12 VAL A 60 12.793 8.868 -9.215 1.00 0.00 H new ATOM 0 HG13 VAL A 60 13.148 9.947 -7.845 1.00 0.00 H new ATOM 0 HG21 VAL A 60 10.433 9.514 -6.432 1.00 0.00 H new ATOM 0 HG22 VAL A 60 11.175 11.115 -6.661 1.00 0.00 H new ATOM 0 HG23 VAL A 60 9.528 10.804 -7.258 1.00 0.00 H new ATOM 981 N LYS A 61 9.571 12.901 -9.319 1.00 0.00 N ATOM 982 CA LYS A 61 8.277 13.532 -9.555 1.00 0.00 C ATOM 983 C LYS A 61 7.167 12.797 -8.810 1.00 0.00 C ATOM 984 O LYS A 61 7.426 11.857 -8.060 1.00 0.00 O ATOM 985 CB LYS A 61 7.966 13.568 -11.054 1.00 0.00 C ATOM 986 CG LYS A 61 8.393 14.860 -11.732 1.00 0.00 C ATOM 987 CD LYS A 61 7.268 15.881 -11.744 1.00 0.00 C ATOM 988 CE LYS A 61 7.795 17.293 -11.550 1.00 0.00 C ATOM 989 NZ LYS A 61 7.683 17.738 -10.134 1.00 0.00 N ATOM 0 H LYS A 61 10.248 13.492 -8.837 1.00 0.00 H new ATOM 0 HA LYS A 61 8.327 14.553 -9.178 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.465 12.730 -11.541 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.895 13.428 -11.198 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.257 15.276 -11.214 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.705 14.649 -12.755 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.729 15.819 -12.690 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.554 15.646 -10.955 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.838 17.337 -11.863 1.00 0.00 H new ATOM 0 HE3 LYS A 61 7.241 17.979 -12.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.053 18.706 -10.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 6.685 17.720 -9.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.233 17.099 -9.525 1.00 0.00 H new ATOM 1003 N ARG A 62 5.930 13.235 -9.021 1.00 0.00 N ATOM 1004 CA ARG A 62 4.780 12.622 -8.369 1.00 0.00 C ATOM 1005 C ARG A 62 3.982 11.772 -9.354 1.00 0.00 C ATOM 1006 O ARG A 62 3.366 10.777 -8.974 1.00 0.00 O ATOM 1007 CB ARG A 62 3.879 13.699 -7.762 1.00 0.00 C ATOM 1008 CG ARG A 62 3.276 13.304 -6.423 1.00 0.00 C ATOM 1009 CD ARG A 62 2.172 14.263 -6.004 1.00 0.00 C ATOM 1010 NE ARG A 62 2.329 14.708 -4.622 1.00 0.00 N ATOM 1011 CZ ARG A 62 1.580 15.653 -4.057 1.00 0.00 C ATOM 1012 NH1 ARG A 62 0.623 16.255 -4.753 1.00 0.00 N ATOM 1013 NH2 ARG A 62 1.789 15.997 -2.794 1.00 0.00 N ATOM 0 H ARG A 62 5.699 14.013 -9.639 1.00 0.00 H new ATOM 0 HA ARG A 62 5.148 11.974 -7.574 1.00 0.00 H new ATOM 0 HB2 ARG A 62 4.456 14.615 -7.635 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.074 13.924 -8.461 1.00 0.00 H new ATOM 0 HG2 ARG A 62 2.875 12.292 -6.487 1.00 0.00 H new ATOM 0 HG3 ARG A 62 4.056 13.290 -5.662 1.00 0.00 H new ATOM 0 HD2 ARG A 62 2.173 15.129 -6.666 1.00 0.00 H new ATOM 0 HD3 ARG A 62 1.204 13.775 -6.120 1.00 0.00 H new ATOM 0 HE ARG A 62 3.055 14.269 -4.056 1.00 0.00 H new ATOM 0 HH11 ARG A 62 0.459 15.994 -5.725 1.00 0.00 H new ATOM 0 HH12 ARG A 62 0.052 16.978 -4.315 1.00 0.00 H new ATOM 0 HH21 ARG A 62 2.523 15.538 -2.255 1.00 0.00 H new ATOM 0 HH22 ARG A 62 1.215 16.721 -2.361 1.00 0.00 H new ATOM 1027 N SER A 63 3.996 12.173 -10.622 1.00 0.00 N ATOM 1028 CA SER A 63 3.271 11.447 -11.660 1.00 0.00 C ATOM 1029 C SER A 63 4.194 10.498 -12.420 1.00 0.00 C ATOM 1030 O SER A 63 3.730 9.580 -13.096 1.00 0.00 O ATOM 1031 CB SER A 63 2.615 12.428 -12.633 1.00 0.00 C ATOM 1032 OG SER A 63 2.364 13.676 -12.010 1.00 0.00 O ATOM 0 H SER A 63 4.500 12.995 -10.955 1.00 0.00 H new ATOM 0 HA SER A 63 2.498 10.852 -11.174 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.262 12.574 -13.498 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.679 12.008 -13.002 1.00 0.00 H new ATOM 0 HG SER A 63 1.946 14.285 -12.654 1.00 0.00 H new ATOM 1038 N VAL A 64 5.501 10.716 -12.304 1.00 0.00 N ATOM 1039 CA VAL A 64 6.473 9.868 -12.979 1.00 0.00 C ATOM 1040 C VAL A 64 6.833 8.669 -12.111 1.00 0.00 C ATOM 1041 O VAL A 64 7.029 7.561 -12.612 1.00 0.00 O ATOM 1042 CB VAL A 64 7.757 10.643 -13.329 1.00 0.00 C ATOM 1043 CG1 VAL A 64 8.677 9.794 -14.192 1.00 0.00 C ATOM 1044 CG2 VAL A 64 7.416 11.952 -14.025 1.00 0.00 C ATOM 0 H VAL A 64 5.908 11.470 -11.751 1.00 0.00 H new ATOM 0 HA VAL A 64 6.011 9.525 -13.905 1.00 0.00 H new ATOM 0 HB VAL A 64 8.283 10.876 -12.403 1.00 0.00 H new ATOM 0 HG11 VAL A 64 9.578 10.359 -14.428 1.00 0.00 H new ATOM 0 HG12 VAL A 64 8.949 8.887 -13.651 1.00 0.00 H new ATOM 0 HG13 VAL A 64 8.164 9.526 -15.116 1.00 0.00 H new ATOM 0 HG21 VAL A 64 8.335 12.487 -14.265 1.00 0.00 H new ATOM 0 HG22 VAL A 64 6.867 11.744 -14.943 1.00 0.00 H new ATOM 0 HG23 VAL A 64 6.801 12.565 -13.366 1.00 0.00 H new ATOM 1054 N LYS A 65 6.909 8.897 -10.805 1.00 0.00 N ATOM 1055 CA LYS A 65 7.234 7.836 -9.862 1.00 0.00 C ATOM 1056 C LYS A 65 6.030 6.926 -9.642 1.00 0.00 C ATOM 1057 O LYS A 65 6.182 5.747 -9.320 1.00 0.00 O ATOM 1058 CB LYS A 65 7.691 8.430 -8.528 1.00 0.00 C ATOM 1059 CG LYS A 65 8.323 7.411 -7.593 1.00 0.00 C ATOM 1060 CD LYS A 65 9.665 6.929 -8.120 1.00 0.00 C ATOM 1061 CE LYS A 65 9.876 5.450 -7.836 1.00 0.00 C ATOM 1062 NZ LYS A 65 9.628 4.611 -9.042 1.00 0.00 N ATOM 0 H LYS A 65 6.750 9.808 -10.376 1.00 0.00 H new ATOM 0 HA LYS A 65 8.047 7.244 -10.282 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.409 9.227 -8.722 1.00 0.00 H new ATOM 0 HB3 LYS A 65 6.835 8.886 -8.030 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.456 7.855 -6.606 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.652 6.561 -7.472 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.720 7.106 -9.194 1.00 0.00 H new ATOM 0 HD3 LYS A 65 10.467 7.507 -7.660 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.896 5.290 -7.486 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.210 5.136 -7.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 10.174 3.729 -8.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.615 4.386 -9.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.922 5.131 -9.893 1.00 0.00 H new ATOM 1076 N VAL A 66 4.833 7.479 -9.820 1.00 0.00 N ATOM 1077 CA VAL A 66 3.606 6.714 -9.644 1.00 0.00 C ATOM 1078 C VAL A 66 3.368 5.780 -10.827 1.00 0.00 C ATOM 1079 O VAL A 66 2.792 4.704 -10.676 1.00 0.00 O ATOM 1080 CB VAL A 66 2.382 7.639 -9.469 1.00 0.00 C ATOM 1081 CG1 VAL A 66 2.082 8.390 -10.756 1.00 0.00 C ATOM 1082 CG2 VAL A 66 1.171 6.840 -9.013 1.00 0.00 C ATOM 0 H VAL A 66 4.689 8.453 -10.086 1.00 0.00 H new ATOM 0 HA VAL A 66 3.729 6.121 -8.738 1.00 0.00 H new ATOM 0 HB VAL A 66 2.616 8.374 -8.699 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.216 9.035 -10.608 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.944 8.998 -11.032 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.871 7.677 -11.553 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.318 7.508 -8.895 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.936 6.079 -9.757 1.00 0.00 H new ATOM 0 HG23 VAL A 66 1.390 6.359 -8.060 1.00 0.00 H new ATOM 1092 N LYS A 67 3.816 6.203 -12.007 1.00 0.00 N ATOM 1093 CA LYS A 67 3.653 5.403 -13.215 1.00 0.00 C ATOM 1094 C LYS A 67 4.541 4.164 -13.171 1.00 0.00 C ATOM 1095 O LYS A 67 4.194 3.118 -13.719 1.00 0.00 O ATOM 1096 CB LYS A 67 3.983 6.238 -14.454 1.00 0.00 C ATOM 1097 CG LYS A 67 3.165 5.860 -15.678 1.00 0.00 C ATOM 1098 CD LYS A 67 3.534 6.714 -16.879 1.00 0.00 C ATOM 1099 CE LYS A 67 2.335 6.953 -17.783 1.00 0.00 C ATOM 1100 NZ LYS A 67 1.311 7.818 -17.132 1.00 0.00 N ATOM 0 H LYS A 67 4.293 7.093 -12.151 1.00 0.00 H new ATOM 0 HA LYS A 67 2.613 5.081 -13.269 1.00 0.00 H new ATOM 0 HB2 LYS A 67 3.816 7.291 -14.227 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.042 6.126 -14.686 1.00 0.00 H new ATOM 0 HG2 LYS A 67 3.327 4.808 -15.914 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.104 5.978 -15.458 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.930 7.671 -16.538 1.00 0.00 H new ATOM 0 HD3 LYS A 67 4.326 6.224 -17.445 1.00 0.00 H new ATOM 0 HE2 LYS A 67 2.667 7.419 -18.711 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.885 5.997 -18.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 0.726 8.273 -17.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 0.707 7.237 -16.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 1.785 8.549 -16.563 1.00 0.00 H new ATOM 1114 N SER A 68 5.689 4.291 -12.513 1.00 0.00 N ATOM 1115 CA SER A 68 6.629 3.181 -12.395 1.00 0.00 C ATOM 1116 C SER A 68 6.082 2.103 -11.463 1.00 0.00 C ATOM 1117 O SER A 68 6.380 0.920 -11.626 1.00 0.00 O ATOM 1118 CB SER A 68 7.978 3.685 -11.878 1.00 0.00 C ATOM 1119 OG SER A 68 8.754 2.623 -11.352 1.00 0.00 O ATOM 0 H SER A 68 5.991 5.150 -12.054 1.00 0.00 H new ATOM 0 HA SER A 68 6.767 2.744 -13.384 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.523 4.170 -12.688 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.817 4.438 -11.106 1.00 0.00 H new ATOM 0 HG SER A 68 9.611 2.972 -11.030 1.00 0.00 H new ATOM 1125 N LEU A 69 5.282 2.520 -10.487 1.00 0.00 N ATOM 1126 CA LEU A 69 4.695 1.590 -9.530 1.00 0.00 C ATOM 1127 C LEU A 69 3.682 0.674 -10.211 1.00 0.00 C ATOM 1128 O LEU A 69 3.551 -0.495 -9.854 1.00 0.00 O ATOM 1129 CB LEU A 69 4.020 2.356 -8.391 1.00 0.00 C ATOM 1130 CG LEU A 69 4.958 2.807 -7.270 1.00 0.00 C ATOM 1131 CD1 LEU A 69 4.388 4.020 -6.553 1.00 0.00 C ATOM 1132 CD2 LEU A 69 5.200 1.670 -6.289 1.00 0.00 C ATOM 0 H LEU A 69 5.026 3.496 -10.338 1.00 0.00 H new ATOM 0 HA LEU A 69 5.497 0.975 -9.121 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.526 3.234 -8.807 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.241 1.726 -7.961 1.00 0.00 H new ATOM 0 HG LEU A 69 5.914 3.089 -7.712 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.069 4.326 -5.759 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.266 4.838 -7.263 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.419 3.766 -6.122 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.869 2.008 -5.498 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.251 1.358 -5.853 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.653 0.828 -6.812 1.00 0.00 H new ATOM 1144 N SER A 70 2.967 1.214 -11.193 1.00 0.00 N ATOM 1145 CA SER A 70 1.966 0.446 -11.922 1.00 0.00 C ATOM 1146 C SER A 70 2.620 -0.652 -12.750 1.00 0.00 C ATOM 1147 O SER A 70 2.106 -1.765 -12.837 1.00 0.00 O ATOM 1148 CB SER A 70 1.140 1.365 -12.825 1.00 0.00 C ATOM 1149 OG SER A 70 -0.180 0.874 -12.980 1.00 0.00 O ATOM 0 H SER A 70 3.063 2.181 -11.502 1.00 0.00 H new ATOM 0 HA SER A 70 1.303 -0.021 -11.194 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.111 2.368 -12.399 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.618 1.447 -13.801 1.00 0.00 H new ATOM 0 HG SER A 70 -0.688 1.479 -13.560 1.00 0.00 H new ATOM 1155 N ASP A 71 3.763 -0.340 -13.346 1.00 0.00 N ATOM 1156 CA ASP A 71 4.487 -1.315 -14.147 1.00 0.00 C ATOM 1157 C ASP A 71 5.376 -2.161 -13.250 1.00 0.00 C ATOM 1158 O ASP A 71 5.628 -3.334 -13.531 1.00 0.00 O ATOM 1159 CB ASP A 71 5.325 -0.619 -15.221 1.00 0.00 C ATOM 1160 CG ASP A 71 4.496 -0.194 -16.417 1.00 0.00 C ATOM 1161 OD1 ASP A 71 3.871 0.885 -16.353 1.00 0.00 O ATOM 1162 OD2 ASP A 71 4.470 -0.942 -17.417 1.00 0.00 O ATOM 0 H ASP A 71 4.207 0.577 -13.290 1.00 0.00 H new ATOM 0 HA ASP A 71 3.765 -1.962 -14.646 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.810 0.257 -14.789 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.117 -1.291 -15.552 1.00 0.00 H new ATOM 1167 N MET A 72 5.831 -1.562 -12.156 1.00 0.00 N ATOM 1168 CA MET A 72 6.670 -2.262 -11.201 1.00 0.00 C ATOM 1169 C MET A 72 5.823 -3.180 -10.338 1.00 0.00 C ATOM 1170 O MET A 72 6.310 -4.196 -9.840 1.00 0.00 O ATOM 1171 CB MET A 72 7.436 -1.266 -10.325 1.00 0.00 C ATOM 1172 CG MET A 72 8.293 -1.926 -9.258 1.00 0.00 C ATOM 1173 SD MET A 72 8.974 -0.739 -8.083 1.00 0.00 S ATOM 1174 CE MET A 72 7.490 -0.231 -7.218 1.00 0.00 C ATOM 0 H MET A 72 5.631 -0.592 -11.911 1.00 0.00 H new ATOM 0 HA MET A 72 7.394 -2.863 -11.750 1.00 0.00 H new ATOM 0 HB2 MET A 72 8.073 -0.651 -10.961 1.00 0.00 H new ATOM 0 HB3 MET A 72 6.724 -0.596 -9.844 1.00 0.00 H new ATOM 0 HG2 MET A 72 7.695 -2.661 -8.720 1.00 0.00 H new ATOM 0 HG3 MET A 72 9.109 -2.467 -9.736 1.00 0.00 H new ATOM 0 HE1 MET A 72 7.467 0.856 -7.142 1.00 0.00 H new ATOM 0 HE2 MET A 72 6.613 -0.574 -7.767 1.00 0.00 H new ATOM 0 HE3 MET A 72 7.485 -0.665 -6.218 1.00 0.00 H new ATOM 1184 N THR A 73 4.545 -2.839 -10.172 1.00 0.00 N ATOM 1185 CA THR A 73 3.662 -3.673 -9.380 1.00 0.00 C ATOM 1186 C THR A 73 3.506 -5.030 -10.041 1.00 0.00 C ATOM 1187 O THR A 73 3.332 -6.044 -9.365 1.00 0.00 O ATOM 1188 CB THR A 73 2.294 -3.032 -9.186 1.00 0.00 C ATOM 1189 OG1 THR A 73 1.519 -3.833 -8.325 1.00 0.00 O ATOM 1190 CG2 THR A 73 1.502 -2.871 -10.457 1.00 0.00 C ATOM 0 H THR A 73 4.111 -2.006 -10.570 1.00 0.00 H new ATOM 0 HA THR A 73 4.114 -3.790 -8.395 1.00 0.00 H new ATOM 0 HB THR A 73 2.494 -2.040 -8.781 1.00 0.00 H new ATOM 0 HG1 THR A 73 2.002 -3.970 -7.483 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.542 -2.407 -10.231 1.00 0.00 H new ATOM 0 HG22 THR A 73 2.055 -2.240 -11.153 1.00 0.00 H new ATOM 0 HG23 THR A 73 1.335 -3.849 -10.908 1.00 0.00 H new ATOM 1198 N ALA A 74 3.589 -5.049 -11.370 1.00 0.00 N ATOM 1199 CA ALA A 74 3.478 -6.296 -12.107 1.00 0.00 C ATOM 1200 C ALA A 74 4.427 -7.335 -11.522 1.00 0.00 C ATOM 1201 O ALA A 74 4.180 -8.538 -11.609 1.00 0.00 O ATOM 1202 CB ALA A 74 3.776 -6.071 -13.583 1.00 0.00 C ATOM 0 H ALA A 74 3.731 -4.222 -11.949 1.00 0.00 H new ATOM 0 HA ALA A 74 2.457 -6.666 -12.018 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.688 -7.015 -14.120 1.00 0.00 H new ATOM 0 HB2 ALA A 74 3.065 -5.353 -13.992 1.00 0.00 H new ATOM 0 HB3 ALA A 74 4.788 -5.683 -13.695 1.00 0.00 H new ATOM 1208 N LYS A 75 5.514 -6.857 -10.916 1.00 0.00 N ATOM 1209 CA LYS A 75 6.497 -7.743 -10.309 1.00 0.00 C ATOM 1210 C LYS A 75 6.333 -7.806 -8.790 1.00 0.00 C ATOM 1211 O LYS A 75 6.834 -8.730 -8.149 1.00 0.00 O ATOM 1212 CB LYS A 75 7.914 -7.289 -10.664 1.00 0.00 C ATOM 1213 CG LYS A 75 8.399 -7.805 -12.007 1.00 0.00 C ATOM 1214 CD LYS A 75 8.601 -9.312 -11.985 1.00 0.00 C ATOM 1215 CE LYS A 75 7.412 -10.043 -12.587 1.00 0.00 C ATOM 1216 NZ LYS A 75 7.832 -11.237 -13.369 1.00 0.00 N ATOM 0 H LYS A 75 5.732 -5.864 -10.834 1.00 0.00 H new ATOM 0 HA LYS A 75 6.330 -8.744 -10.708 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.947 -6.200 -10.669 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.600 -7.625 -9.886 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.676 -7.545 -12.780 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.337 -7.315 -12.269 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.504 -9.567 -12.539 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.752 -9.645 -10.958 1.00 0.00 H new ATOM 0 HE2 LYS A 75 6.734 -10.351 -11.791 1.00 0.00 H new ATOM 0 HE3 LYS A 75 6.857 -9.363 -13.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.992 -11.707 -13.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 8.459 -10.941 -14.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 8.339 -11.898 -12.747 1.00 0.00 H new ATOM 1230 N GLU A 76 5.632 -6.831 -8.213 1.00 0.00 N ATOM 1231 CA GLU A 76 5.422 -6.807 -6.772 1.00 0.00 C ATOM 1232 C GLU A 76 4.329 -7.793 -6.368 1.00 0.00 C ATOM 1233 O GLU A 76 4.585 -8.740 -5.626 1.00 0.00 O ATOM 1234 CB GLU A 76 5.057 -5.396 -6.309 1.00 0.00 C ATOM 1235 CG GLU A 76 5.823 -4.945 -5.076 1.00 0.00 C ATOM 1236 CD GLU A 76 7.208 -4.425 -5.407 1.00 0.00 C ATOM 1237 OE1 GLU A 76 7.322 -3.573 -6.314 1.00 0.00 O ATOM 1238 OE2 GLU A 76 8.180 -4.870 -4.761 1.00 0.00 O ATOM 0 H GLU A 76 5.204 -6.055 -8.719 1.00 0.00 H new ATOM 0 HA GLU A 76 6.352 -7.106 -6.288 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.247 -4.695 -7.122 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.988 -5.357 -6.098 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.258 -4.164 -4.567 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.909 -5.780 -4.381 1.00 0.00 H new ATOM 1245 N LYS A 77 3.114 -7.562 -6.871 1.00 0.00 N ATOM 1246 CA LYS A 77 1.963 -8.424 -6.576 1.00 0.00 C ATOM 1247 C LYS A 77 0.650 -7.672 -6.787 1.00 0.00 C ATOM 1248 O LYS A 77 -0.348 -8.256 -7.211 1.00 0.00 O ATOM 1249 CB LYS A 77 2.019 -8.951 -5.136 1.00 0.00 C ATOM 1250 CG LYS A 77 2.500 -10.390 -5.035 1.00 0.00 C ATOM 1251 CD LYS A 77 3.326 -10.614 -3.778 1.00 0.00 C ATOM 1252 CE LYS A 77 3.184 -12.038 -3.266 1.00 0.00 C ATOM 1253 NZ LYS A 77 4.135 -12.968 -3.939 1.00 0.00 N ATOM 0 H LYS A 77 2.899 -6.780 -7.489 1.00 0.00 H new ATOM 0 HA LYS A 77 2.008 -9.268 -7.264 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.680 -8.313 -4.550 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.027 -8.876 -4.691 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.642 -11.062 -5.033 1.00 0.00 H new ATOM 0 HG3 LYS A 77 3.097 -10.638 -5.913 1.00 0.00 H new ATOM 0 HD2 LYS A 77 4.375 -10.404 -3.988 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.010 -9.915 -3.004 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.359 -12.056 -2.190 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.163 -12.382 -3.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 4.006 -13.929 -3.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.952 -12.970 -4.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 5.111 -12.654 -3.762 1.00 0.00 H new ATOM 1267 N PHE A 78 0.654 -6.380 -6.469 1.00 0.00 N ATOM 1268 CA PHE A 78 -0.535 -5.541 -6.604 1.00 0.00 C ATOM 1269 C PHE A 78 -1.174 -5.670 -7.964 1.00 0.00 C ATOM 1270 O PHE A 78 -0.745 -6.459 -8.805 1.00 0.00 O ATOM 1271 CB PHE A 78 -0.199 -4.068 -6.385 1.00 0.00 C ATOM 1272 CG PHE A 78 0.925 -3.848 -5.437 1.00 0.00 C ATOM 1273 CD1 PHE A 78 0.922 -4.459 -4.201 1.00 0.00 C ATOM 1274 CD2 PHE A 78 1.995 -3.053 -5.796 1.00 0.00 C ATOM 1275 CE1 PHE A 78 1.979 -4.279 -3.332 1.00 0.00 C ATOM 1276 CE2 PHE A 78 3.051 -2.863 -4.934 1.00 0.00 C ATOM 1277 CZ PHE A 78 3.046 -3.479 -3.697 1.00 0.00 C ATOM 0 H PHE A 78 1.474 -5.888 -6.113 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.232 -5.890 -5.843 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.052 -3.615 -7.344 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -1.084 -3.554 -6.011 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.088 -5.082 -3.911 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.004 -2.575 -6.764 1.00 0.00 H new ATOM 0 HE1 PHE A 78 1.973 -4.763 -2.367 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.880 -2.235 -5.223 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.873 -3.336 -3.017 1.00 0.00 H new ATOM 1287 N SER A 79 -2.194 -4.843 -8.161 1.00 0.00 N ATOM 1288 CA SER A 79 -2.936 -4.775 -9.411 1.00 0.00 C ATOM 1289 C SER A 79 -4.435 -4.637 -9.168 1.00 0.00 C ATOM 1290 O SER A 79 -5.111 -3.890 -9.873 1.00 0.00 O ATOM 1291 CB SER A 79 -2.677 -5.995 -10.305 1.00 0.00 C ATOM 1292 OG SER A 79 -3.633 -6.075 -11.348 1.00 0.00 O ATOM 0 H SER A 79 -2.531 -4.195 -7.449 1.00 0.00 H new ATOM 0 HA SER A 79 -2.575 -3.885 -9.927 1.00 0.00 H new ATOM 0 HB2 SER A 79 -1.675 -5.932 -10.730 1.00 0.00 H new ATOM 0 HB3 SER A 79 -2.712 -6.904 -9.704 1.00 0.00 H new ATOM 0 HG SER A 79 -3.445 -6.860 -11.904 1.00 0.00 H new ATOM 1298 N PRO A 80 -4.997 -5.399 -8.213 1.00 0.00 N ATOM 1299 CA PRO A 80 -6.418 -5.385 -7.944 1.00 0.00 C ATOM 1300 C PRO A 80 -6.844 -4.583 -6.718 1.00 0.00 C ATOM 1301 O PRO A 80 -7.515 -3.560 -6.854 1.00 0.00 O ATOM 1302 CB PRO A 80 -6.699 -6.872 -7.739 1.00 0.00 C ATOM 1303 CG PRO A 80 -5.415 -7.444 -7.193 1.00 0.00 C ATOM 1304 CD PRO A 80 -4.334 -6.395 -7.375 1.00 0.00 C ATOM 0 HA PRO A 80 -6.972 -4.897 -8.746 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.525 -7.025 -7.045 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -6.978 -7.353 -8.676 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -5.527 -7.700 -6.139 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -5.151 -8.362 -7.718 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -4.012 -5.974 -6.422 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -3.447 -6.806 -7.858 1.00 0.00 H new ATOM 1312 N LEU A 81 -6.479 -5.038 -5.524 1.00 0.00 N ATOM 1313 CA LEU A 81 -6.868 -4.324 -4.318 1.00 0.00 C ATOM 1314 C LEU A 81 -5.747 -3.420 -3.860 1.00 0.00 C ATOM 1315 O LEU A 81 -5.820 -2.791 -2.805 1.00 0.00 O ATOM 1316 CB LEU A 81 -7.241 -5.300 -3.209 1.00 0.00 C ATOM 1317 CG LEU A 81 -8.681 -5.819 -3.265 1.00 0.00 C ATOM 1318 CD1 LEU A 81 -9.671 -4.675 -3.093 1.00 0.00 C ATOM 1319 CD2 LEU A 81 -8.931 -6.550 -4.575 1.00 0.00 C ATOM 0 H LEU A 81 -5.926 -5.881 -5.368 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.742 -3.715 -4.549 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.561 -6.151 -3.250 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.083 -4.812 -2.247 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.826 -6.522 -2.444 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -10.688 -5.065 -3.136 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -9.507 -4.194 -2.129 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -9.528 -3.947 -3.891 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.959 -6.913 -4.599 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.767 -5.868 -5.409 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.246 -7.394 -4.657 1.00 0.00 H new ATOM 1331 N THR A 82 -4.707 -3.367 -4.670 1.00 0.00 N ATOM 1332 CA THR A 82 -3.557 -2.554 -4.378 1.00 0.00 C ATOM 1333 C THR A 82 -3.266 -1.601 -5.531 1.00 0.00 C ATOM 1334 O THR A 82 -2.344 -0.793 -5.452 1.00 0.00 O ATOM 1335 CB THR A 82 -2.360 -3.445 -4.105 1.00 0.00 C ATOM 1336 OG1 THR A 82 -2.745 -4.809 -4.085 1.00 0.00 O ATOM 1337 CG2 THR A 82 -1.680 -3.134 -2.789 1.00 0.00 C ATOM 0 H THR A 82 -4.642 -3.887 -5.545 1.00 0.00 H new ATOM 0 HA THR A 82 -3.762 -1.954 -3.491 1.00 0.00 H new ATOM 0 HB THR A 82 -1.657 -3.250 -4.914 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.284 -4.985 -3.286 1.00 0.00 H new ATOM 0 HG21 THR A 82 -0.832 -3.804 -2.650 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.330 -2.102 -2.795 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.388 -3.272 -1.972 1.00 0.00 H new ATOM 1345 N SER A 83 -4.068 -1.675 -6.597 1.00 0.00 N ATOM 1346 CA SER A 83 -3.876 -0.786 -7.734 1.00 0.00 C ATOM 1347 C SER A 83 -4.594 0.537 -7.494 1.00 0.00 C ATOM 1348 O SER A 83 -5.009 1.224 -8.427 1.00 0.00 O ATOM 1349 CB SER A 83 -4.387 -1.426 -9.020 1.00 0.00 C ATOM 1350 OG SER A 83 -3.316 -1.908 -9.811 1.00 0.00 O ATOM 0 H SER A 83 -4.843 -2.332 -6.692 1.00 0.00 H new ATOM 0 HA SER A 83 -2.807 -0.601 -7.842 1.00 0.00 H new ATOM 0 HB2 SER A 83 -5.062 -2.247 -8.778 1.00 0.00 H new ATOM 0 HB3 SER A 83 -4.963 -0.696 -9.589 1.00 0.00 H new ATOM 0 HG SER A 83 -3.670 -2.301 -10.636 1.00 0.00 H new ATOM 1356 N ASN A 84 -4.711 0.877 -6.225 1.00 0.00 N ATOM 1357 CA ASN A 84 -5.346 2.103 -5.782 1.00 0.00 C ATOM 1358 C ASN A 84 -4.571 2.578 -4.577 1.00 0.00 C ATOM 1359 O ASN A 84 -4.174 3.739 -4.480 1.00 0.00 O ATOM 1360 CB ASN A 84 -6.814 1.866 -5.423 1.00 0.00 C ATOM 1361 CG ASN A 84 -7.521 3.140 -5.004 1.00 0.00 C ATOM 1362 OD1 ASN A 84 -7.897 3.302 -3.843 1.00 0.00 O ATOM 1363 ND2 ASN A 84 -7.704 4.054 -5.950 1.00 0.00 N ATOM 0 H ASN A 84 -4.362 0.299 -5.460 1.00 0.00 H new ATOM 0 HA ASN A 84 -5.337 2.851 -6.575 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -7.329 1.433 -6.280 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -6.874 1.138 -4.614 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -8.172 4.932 -5.727 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -7.376 3.878 -6.900 1.00 0.00 H new ATOM 1370 N LEU A 85 -4.302 1.628 -3.688 1.00 0.00 N ATOM 1371 CA LEU A 85 -3.507 1.890 -2.514 1.00 0.00 C ATOM 1372 C LEU A 85 -2.086 2.216 -2.961 1.00 0.00 C ATOM 1373 O LEU A 85 -1.317 2.827 -2.220 1.00 0.00 O ATOM 1374 CB LEU A 85 -3.510 0.671 -1.583 1.00 0.00 C ATOM 1375 CG LEU A 85 -2.548 0.759 -0.395 1.00 0.00 C ATOM 1376 CD1 LEU A 85 -2.995 1.843 0.574 1.00 0.00 C ATOM 1377 CD2 LEU A 85 -2.456 -0.585 0.315 1.00 0.00 C ATOM 0 H LEU A 85 -4.630 0.665 -3.768 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.925 2.732 -1.962 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.521 0.527 -1.202 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.260 -0.214 -2.168 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.559 1.020 -0.771 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.300 1.891 1.412 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.013 2.805 0.061 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.994 1.611 0.944 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.768 -0.505 1.157 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.443 -0.873 0.678 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.091 -1.340 -0.381 1.00 0.00 H new ATOM 1389 N ILE A 86 -1.746 1.809 -4.195 1.00 0.00 N ATOM 1390 CA ILE A 86 -0.424 2.073 -4.735 1.00 0.00 C ATOM 1391 C ILE A 86 -0.285 3.545 -5.114 1.00 0.00 C ATOM 1392 O ILE A 86 0.633 4.231 -4.662 1.00 0.00 O ATOM 1393 CB ILE A 86 -0.113 1.169 -5.961 1.00 0.00 C ATOM 1394 CG1 ILE A 86 0.830 0.035 -5.553 1.00 0.00 C ATOM 1395 CG2 ILE A 86 0.494 1.967 -7.111 1.00 0.00 C ATOM 1396 CD1 ILE A 86 0.195 -0.974 -4.622 1.00 0.00 C ATOM 0 H ILE A 86 -2.369 1.302 -4.824 1.00 0.00 H new ATOM 0 HA ILE A 86 0.301 1.837 -3.956 1.00 0.00 H new ATOM 0 HB ILE A 86 -1.056 0.748 -6.310 1.00 0.00 H new ATOM 0 HG12 ILE A 86 1.177 -0.478 -6.450 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.709 0.461 -5.069 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.697 1.300 -7.949 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -0.205 2.742 -7.425 1.00 0.00 H new ATOM 0 HG23 ILE A 86 1.424 2.430 -6.782 1.00 0.00 H new ATOM 0 HD11 ILE A 86 0.921 -1.749 -4.375 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.127 -0.474 -3.709 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.667 -1.428 -5.111 1.00 0.00 H new ATOM 1408 N ASN A 87 -1.205 4.025 -5.944 1.00 0.00 N ATOM 1409 CA ASN A 87 -1.190 5.415 -6.382 1.00 0.00 C ATOM 1410 C ASN A 87 -1.496 6.350 -5.218 1.00 0.00 C ATOM 1411 O ASN A 87 -1.004 7.478 -5.169 1.00 0.00 O ATOM 1412 CB ASN A 87 -2.206 5.629 -7.505 1.00 0.00 C ATOM 1413 CG ASN A 87 -2.093 7.005 -8.133 1.00 0.00 C ATOM 1414 OD1 ASN A 87 -1.457 7.902 -7.580 1.00 0.00 O ATOM 1415 ND2 ASN A 87 -2.712 7.177 -9.296 1.00 0.00 N ATOM 0 H ASN A 87 -1.971 3.471 -6.327 1.00 0.00 H new ATOM 0 HA ASN A 87 -0.193 5.643 -6.758 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -2.060 4.869 -8.273 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -3.213 5.494 -7.111 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -2.671 8.081 -9.767 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -3.228 6.405 -9.718 1.00 0.00 H new ATOM 1422 N LEU A 88 -2.309 5.872 -4.281 1.00 0.00 N ATOM 1423 CA LEU A 88 -2.678 6.665 -3.115 1.00 0.00 C ATOM 1424 C LEU A 88 -1.519 6.750 -2.129 1.00 0.00 C ATOM 1425 O LEU A 88 -1.356 7.755 -1.435 1.00 0.00 O ATOM 1426 CB LEU A 88 -3.907 6.064 -2.427 1.00 0.00 C ATOM 1427 CG LEU A 88 -4.870 7.083 -1.819 1.00 0.00 C ATOM 1428 CD1 LEU A 88 -6.268 6.493 -1.708 1.00 0.00 C ATOM 1429 CD2 LEU A 88 -4.372 7.539 -0.456 1.00 0.00 C ATOM 0 H LEU A 88 -2.724 4.941 -4.307 1.00 0.00 H new ATOM 0 HA LEU A 88 -2.919 7.672 -3.454 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -4.452 5.460 -3.153 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.570 5.390 -1.639 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.915 7.951 -2.476 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -6.941 7.232 -1.273 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.626 6.215 -2.700 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.240 5.608 -1.072 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.070 8.264 -0.038 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -4.299 6.680 0.211 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.390 8.000 -0.563 1.00 0.00 H new ATOM 1441 N LEU A 89 -0.711 5.695 -2.072 1.00 0.00 N ATOM 1442 CA LEU A 89 0.432 5.667 -1.170 1.00 0.00 C ATOM 1443 C LEU A 89 1.543 6.575 -1.686 1.00 0.00 C ATOM 1444 O LEU A 89 2.307 7.143 -0.906 1.00 0.00 O ATOM 1445 CB LEU A 89 0.949 4.238 -1.008 1.00 0.00 C ATOM 1446 CG LEU A 89 0.365 3.478 0.183 1.00 0.00 C ATOM 1447 CD1 LEU A 89 0.857 2.039 0.194 1.00 0.00 C ATOM 1448 CD2 LEU A 89 0.726 4.179 1.484 1.00 0.00 C ATOM 0 H LEU A 89 -0.827 4.854 -2.637 1.00 0.00 H new ATOM 0 HA LEU A 89 0.109 6.033 -0.195 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.730 3.682 -1.919 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.034 4.268 -0.906 1.00 0.00 H new ATOM 0 HG LEU A 89 -0.721 3.464 0.087 1.00 0.00 H new ATOM 0 HD11 LEU A 89 0.430 1.515 1.049 1.00 0.00 H new ATOM 0 HD12 LEU A 89 0.550 1.542 -0.726 1.00 0.00 H new ATOM 0 HD13 LEU A 89 1.944 2.027 0.267 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.304 3.627 2.324 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.810 4.221 1.586 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.323 5.192 1.476 1.00 0.00 H new ATOM 1460 N ALA A 90 1.616 6.715 -3.004 1.00 0.00 N ATOM 1461 CA ALA A 90 2.624 7.564 -3.627 1.00 0.00 C ATOM 1462 C ALA A 90 1.979 8.788 -4.269 1.00 0.00 C ATOM 1463 O ALA A 90 2.528 9.374 -5.203 1.00 0.00 O ATOM 1464 CB ALA A 90 3.413 6.774 -4.662 1.00 0.00 C ATOM 0 H ALA A 90 0.989 6.252 -3.662 1.00 0.00 H new ATOM 0 HA ALA A 90 3.310 7.908 -2.852 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.162 7.420 -5.119 1.00 0.00 H new ATOM 0 HB2 ALA A 90 3.907 5.932 -4.178 1.00 0.00 H new ATOM 0 HB3 ALA A 90 2.735 6.404 -5.431 1.00 0.00 H new ATOM 1470 N GLU A 91 0.809 9.169 -3.764 1.00 0.00 N ATOM 1471 CA GLU A 91 0.089 10.323 -4.289 1.00 0.00 C ATOM 1472 C GLU A 91 0.527 11.603 -3.584 1.00 0.00 C ATOM 1473 O GLU A 91 0.899 12.583 -4.230 1.00 0.00 O ATOM 1474 CB GLU A 91 -1.420 10.126 -4.129 1.00 0.00 C ATOM 1475 CG GLU A 91 -2.201 10.335 -5.416 1.00 0.00 C ATOM 1476 CD GLU A 91 -3.572 9.690 -5.378 1.00 0.00 C ATOM 1477 OE1 GLU A 91 -4.478 10.260 -4.735 1.00 0.00 O ATOM 1478 OE2 GLU A 91 -3.739 8.614 -5.991 1.00 0.00 O ATOM 0 H GLU A 91 0.340 8.695 -2.992 1.00 0.00 H new ATOM 0 HA GLU A 91 0.324 10.416 -5.349 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.609 9.118 -3.759 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.790 10.818 -3.373 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.311 11.404 -5.600 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.634 9.925 -6.251 1.00 0.00 H new ATOM 1485 N ASN A 92 0.477 11.588 -2.256 1.00 0.00 N ATOM 1486 CA ASN A 92 0.869 12.750 -1.466 1.00 0.00 C ATOM 1487 C ASN A 92 2.103 12.451 -0.619 1.00 0.00 C ATOM 1488 O ASN A 92 2.365 13.132 0.372 1.00 0.00 O ATOM 1489 CB ASN A 92 -0.286 13.191 -0.565 1.00 0.00 C ATOM 1490 CG ASN A 92 -1.570 13.419 -1.340 1.00 0.00 C ATOM 1491 OD1 ASN A 92 -1.552 13.569 -2.561 1.00 0.00 O ATOM 1492 ND2 ASN A 92 -2.691 13.446 -0.631 1.00 0.00 N ATOM 0 H ASN A 92 0.170 10.786 -1.705 1.00 0.00 H new ATOM 0 HA ASN A 92 1.116 13.557 -2.156 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -0.456 12.433 0.200 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -0.009 14.110 -0.048 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -3.586 13.596 -1.097 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -2.658 13.317 0.380 1.00 0.00 H new ATOM 1499 N GLY A 93 2.860 11.430 -1.014 1.00 0.00 N ATOM 1500 CA GLY A 93 4.053 11.066 -0.275 1.00 0.00 C ATOM 1501 C GLY A 93 3.742 10.214 0.937 1.00 0.00 C ATOM 1502 O GLY A 93 4.219 10.491 2.038 1.00 0.00 O ATOM 0 H GLY A 93 2.667 10.851 -1.831 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.733 10.524 -0.932 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.571 11.971 0.043 1.00 0.00 H new ATOM 1506 N ARG A 94 2.937 9.177 0.736 1.00 0.00 N ATOM 1507 CA ARG A 94 2.561 8.283 1.824 1.00 0.00 C ATOM 1508 C ARG A 94 3.455 7.046 1.855 1.00 0.00 C ATOM 1509 O ARG A 94 3.060 5.997 2.366 1.00 0.00 O ATOM 1510 CB ARG A 94 1.095 7.865 1.686 1.00 0.00 C ATOM 1511 CG ARG A 94 0.126 8.807 2.381 1.00 0.00 C ATOM 1512 CD ARG A 94 -0.344 8.245 3.715 1.00 0.00 C ATOM 1513 NE ARG A 94 0.285 8.920 4.847 1.00 0.00 N ATOM 1514 CZ ARG A 94 1.498 8.625 5.308 1.00 0.00 C ATOM 1515 NH1 ARG A 94 2.219 7.667 4.737 1.00 0.00 N ATOM 1516 NH2 ARG A 94 1.993 9.288 6.343 1.00 0.00 N ATOM 0 H ARG A 94 2.533 8.935 -0.169 1.00 0.00 H new ATOM 0 HA ARG A 94 2.692 8.823 2.762 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.840 7.810 0.628 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.971 6.863 2.096 1.00 0.00 H new ATOM 0 HG2 ARG A 94 0.608 9.772 2.542 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -0.735 8.984 1.737 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -1.427 8.346 3.789 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.119 7.179 3.758 1.00 0.00 H new ATOM 0 HE ARG A 94 -0.237 9.662 5.312 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.844 7.152 3.940 1.00 0.00 H new ATOM 0 HH12 ARG A 94 3.148 7.446 5.095 1.00 0.00 H new ATOM 0 HH21 ARG A 94 1.444 10.025 6.787 1.00 0.00 H new ATOM 0 HH22 ARG A 94 2.923 9.062 6.696 1.00 0.00 H new ATOM 1530 N LEU A 95 4.661 7.174 1.310 1.00 0.00 N ATOM 1531 CA LEU A 95 5.607 6.064 1.282 1.00 0.00 C ATOM 1532 C LEU A 95 6.694 6.257 2.333 1.00 0.00 C ATOM 1533 O LEU A 95 7.887 6.181 2.038 1.00 0.00 O ATOM 1534 CB LEU A 95 6.233 5.931 -0.108 1.00 0.00 C ATOM 1535 CG LEU A 95 5.240 5.664 -1.241 1.00 0.00 C ATOM 1536 CD1 LEU A 95 5.713 6.319 -2.532 1.00 0.00 C ATOM 1537 CD2 LEU A 95 5.047 4.167 -1.438 1.00 0.00 C ATOM 0 H LEU A 95 5.006 8.034 0.883 1.00 0.00 H new ATOM 0 HA LEU A 95 5.064 5.147 1.511 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.780 6.847 -0.333 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.962 5.121 -0.086 1.00 0.00 H new ATOM 0 HG LEU A 95 4.279 6.101 -0.968 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.994 6.118 -3.326 1.00 0.00 H new ATOM 0 HD12 LEU A 95 5.799 7.395 -2.384 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.685 5.913 -2.811 1.00 0.00 H new ATOM 0 HD21 LEU A 95 4.338 3.995 -2.248 1.00 0.00 H new ATOM 0 HD22 LEU A 95 6.003 3.707 -1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.662 3.726 -0.519 1.00 0.00 H new ATOM 1549 N THR A 96 6.265 6.503 3.565 1.00 0.00 N ATOM 1550 CA THR A 96 7.185 6.704 4.678 1.00 0.00 C ATOM 1551 C THR A 96 6.708 5.928 5.900 1.00 0.00 C ATOM 1552 O THR A 96 7.496 5.272 6.583 1.00 0.00 O ATOM 1553 CB THR A 96 7.304 8.191 5.011 1.00 0.00 C ATOM 1554 OG1 THR A 96 6.039 8.730 5.356 1.00 0.00 O ATOM 1555 CG2 THR A 96 7.860 9.017 3.870 1.00 0.00 C ATOM 0 H THR A 96 5.279 6.568 3.819 1.00 0.00 H new ATOM 0 HA THR A 96 8.168 6.334 4.387 1.00 0.00 H new ATOM 0 HB THR A 96 7.998 8.245 5.849 1.00 0.00 H new ATOM 0 HG1 THR A 96 6.136 9.682 5.567 1.00 0.00 H new ATOM 0 HG21 THR A 96 7.918 10.063 4.172 1.00 0.00 H new ATOM 0 HG22 THR A 96 8.856 8.658 3.612 1.00 0.00 H new ATOM 0 HG23 THR A 96 7.206 8.926 3.003 1.00 0.00 H new ATOM 1563 N ASN A 97 5.406 5.995 6.156 1.00 0.00 N ATOM 1564 CA ASN A 97 4.806 5.288 7.280 1.00 0.00 C ATOM 1565 C ASN A 97 3.963 4.116 6.784 1.00 0.00 C ATOM 1566 O ASN A 97 3.226 3.497 7.552 1.00 0.00 O ATOM 1567 CB ASN A 97 3.942 6.241 8.108 1.00 0.00 C ATOM 1568 CG ASN A 97 4.771 7.205 8.932 1.00 0.00 C ATOM 1569 OD1 ASN A 97 5.092 6.934 10.089 1.00 0.00 O ATOM 1570 ND2 ASN A 97 5.125 8.340 8.339 1.00 0.00 N ATOM 0 H ASN A 97 4.744 6.534 5.598 1.00 0.00 H new ATOM 0 HA ASN A 97 5.607 4.901 7.910 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.288 6.805 7.443 1.00 0.00 H new ATOM 0 HB3 ASN A 97 3.299 5.661 8.770 1.00 0.00 H new ATOM 0 HD21 ASN A 97 5.684 9.027 8.845 1.00 0.00 H new ATOM 0 HD22 ASN A 97 4.837 8.525 7.378 1.00 0.00 H new ATOM 1577 N THR A 98 4.075 3.817 5.488 1.00 0.00 N ATOM 1578 CA THR A 98 3.329 2.724 4.874 1.00 0.00 C ATOM 1579 C THR A 98 3.375 1.456 5.728 1.00 0.00 C ATOM 1580 O THR A 98 2.332 0.927 6.114 1.00 0.00 O ATOM 1581 CB THR A 98 3.884 2.433 3.478 1.00 0.00 C ATOM 1582 OG1 THR A 98 4.610 3.544 2.984 1.00 0.00 O ATOM 1583 CG2 THR A 98 2.810 2.104 2.466 1.00 0.00 C ATOM 0 H THR A 98 4.681 4.323 4.842 1.00 0.00 H new ATOM 0 HA THR A 98 2.287 3.035 4.797 1.00 0.00 H new ATOM 0 HB THR A 98 4.528 1.562 3.600 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.029 4.333 2.967 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.270 1.908 1.498 1.00 0.00 H new ATOM 0 HG22 THR A 98 2.261 1.221 2.792 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.123 2.946 2.378 1.00 0.00 H new ATOM 1591 N PRO A 99 4.581 0.945 6.039 1.00 0.00 N ATOM 1592 CA PRO A 99 4.740 -0.265 6.849 1.00 0.00 C ATOM 1593 C PRO A 99 3.891 -0.229 8.115 1.00 0.00 C ATOM 1594 O PRO A 99 3.492 -1.270 8.636 1.00 0.00 O ATOM 1595 CB PRO A 99 6.237 -0.289 7.201 1.00 0.00 C ATOM 1596 CG PRO A 99 6.788 1.020 6.732 1.00 0.00 C ATOM 1597 CD PRO A 99 5.882 1.490 5.633 1.00 0.00 C ATOM 0 HA PRO A 99 4.412 -1.154 6.310 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.384 -0.413 8.274 1.00 0.00 H new ATOM 0 HB3 PRO A 99 6.740 -1.123 6.712 1.00 0.00 H new ATOM 0 HG2 PRO A 99 6.818 1.743 7.547 1.00 0.00 H new ATOM 0 HG3 PRO A 99 7.810 0.904 6.371 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.862 2.577 5.561 1.00 0.00 H new ATOM 0 HD3 PRO A 99 6.195 1.112 4.660 1.00 0.00 H new ATOM 1605 N ALA A 100 3.611 0.975 8.601 1.00 0.00 N ATOM 1606 CA ALA A 100 2.800 1.142 9.800 1.00 0.00 C ATOM 1607 C ALA A 100 1.324 0.927 9.487 1.00 0.00 C ATOM 1608 O ALA A 100 0.559 0.467 10.334 1.00 0.00 O ATOM 1609 CB ALA A 100 3.022 2.521 10.402 1.00 0.00 C ATOM 0 H ALA A 100 3.933 1.848 8.184 1.00 0.00 H new ATOM 0 HA ALA A 100 3.106 0.392 10.529 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.409 2.630 11.297 1.00 0.00 H new ATOM 0 HB2 ALA A 100 4.073 2.638 10.665 1.00 0.00 H new ATOM 0 HB3 ALA A 100 2.743 3.284 9.676 1.00 0.00 H new ATOM 1615 N VAL A 101 0.934 1.259 8.260 1.00 0.00 N ATOM 1616 CA VAL A 101 -0.447 1.097 7.828 1.00 0.00 C ATOM 1617 C VAL A 101 -0.791 -0.378 7.650 1.00 0.00 C ATOM 1618 O VAL A 101 -1.943 -0.782 7.814 1.00 0.00 O ATOM 1619 CB VAL A 101 -0.713 1.840 6.504 1.00 0.00 C ATOM 1620 CG1 VAL A 101 -2.190 1.780 6.143 1.00 0.00 C ATOM 1621 CG2 VAL A 101 -0.238 3.281 6.595 1.00 0.00 C ATOM 0 H VAL A 101 1.556 1.642 7.548 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.078 1.526 8.607 1.00 0.00 H new ATOM 0 HB VAL A 101 -0.150 1.345 5.713 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.357 2.310 5.205 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -2.495 0.740 6.031 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -2.777 2.247 6.934 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.434 3.789 5.651 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.771 3.790 7.398 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.832 3.299 6.801 1.00 0.00 H new ATOM 1631 N ILE A 102 0.216 -1.180 7.315 1.00 0.00 N ATOM 1632 CA ILE A 102 0.017 -2.611 7.119 1.00 0.00 C ATOM 1633 C ILE A 102 -0.351 -3.295 8.431 1.00 0.00 C ATOM 1634 O ILE A 102 -1.150 -4.231 8.451 1.00 0.00 O ATOM 1635 CB ILE A 102 1.278 -3.281 6.535 1.00 0.00 C ATOM 1636 CG1 ILE A 102 1.738 -2.546 5.276 1.00 0.00 C ATOM 1637 CG2 ILE A 102 1.008 -4.747 6.229 1.00 0.00 C ATOM 1638 CD1 ILE A 102 3.191 -2.786 4.934 1.00 0.00 C ATOM 0 H ILE A 102 1.175 -0.863 7.174 1.00 0.00 H new ATOM 0 HA ILE A 102 -0.803 -2.724 6.410 1.00 0.00 H new ATOM 0 HB ILE A 102 2.075 -3.226 7.277 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.119 -2.859 4.435 1.00 0.00 H new ATOM 0 HG13 ILE A 102 1.576 -1.476 5.410 1.00 0.00 H new ATOM 0 HG21 ILE A 102 1.908 -5.205 5.818 1.00 0.00 H new ATOM 0 HG22 ILE A 102 0.725 -5.264 7.146 1.00 0.00 H new ATOM 0 HG23 ILE A 102 0.198 -4.824 5.504 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.448 -2.234 4.030 1.00 0.00 H new ATOM 0 HD12 ILE A 102 3.819 -2.447 5.757 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.355 -3.851 4.768 1.00 0.00 H new ATOM 1650 N SER A 103 0.234 -2.819 9.528 1.00 0.00 N ATOM 1651 CA SER A 103 -0.041 -3.385 10.843 1.00 0.00 C ATOM 1652 C SER A 103 -1.527 -3.303 11.164 1.00 0.00 C ATOM 1653 O SER A 103 -2.132 -4.278 11.611 1.00 0.00 O ATOM 1654 CB SER A 103 0.770 -2.657 11.917 1.00 0.00 C ATOM 1655 OG SER A 103 2.157 -2.904 11.766 1.00 0.00 O ATOM 0 H SER A 103 0.899 -2.045 9.531 1.00 0.00 H new ATOM 0 HA SER A 103 0.253 -4.434 10.831 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.580 -1.585 11.856 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.445 -2.983 12.905 1.00 0.00 H new ATOM 0 HG SER A 103 2.652 -2.426 12.464 1.00 0.00 H new ATOM 1661 N ALA A 104 -2.114 -2.135 10.925 1.00 0.00 N ATOM 1662 CA ALA A 104 -3.533 -1.929 11.179 1.00 0.00 C ATOM 1663 C ALA A 104 -4.373 -2.893 10.348 1.00 0.00 C ATOM 1664 O ALA A 104 -5.472 -3.279 10.746 1.00 0.00 O ATOM 1665 CB ALA A 104 -3.920 -0.489 10.880 1.00 0.00 C ATOM 0 H ALA A 104 -1.628 -1.318 10.556 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.728 -2.128 12.233 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -4.983 -0.350 11.074 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -3.344 0.182 11.517 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.710 -0.266 9.834 1.00 0.00 H new ATOM 1671 N PHE A 105 -3.841 -3.282 9.193 1.00 0.00 N ATOM 1672 CA PHE A 105 -4.531 -4.208 8.303 1.00 0.00 C ATOM 1673 C PHE A 105 -4.725 -5.560 8.976 1.00 0.00 C ATOM 1674 O PHE A 105 -5.674 -6.283 8.673 1.00 0.00 O ATOM 1675 CB PHE A 105 -3.736 -4.389 7.008 1.00 0.00 C ATOM 1676 CG PHE A 105 -4.578 -4.772 5.824 1.00 0.00 C ATOM 1677 CD1 PHE A 105 -4.953 -6.091 5.611 1.00 0.00 C ATOM 1678 CD2 PHE A 105 -4.990 -3.811 4.916 1.00 0.00 C ATOM 1679 CE1 PHE A 105 -5.722 -6.440 4.518 1.00 0.00 C ATOM 1680 CE2 PHE A 105 -5.756 -4.155 3.821 1.00 0.00 C ATOM 1681 CZ PHE A 105 -6.123 -5.470 3.623 1.00 0.00 C ATOM 0 H PHE A 105 -2.932 -2.969 8.852 1.00 0.00 H new ATOM 0 HA PHE A 105 -5.510 -3.788 8.070 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -3.211 -3.461 6.783 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -2.976 -5.155 7.164 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -4.640 -6.854 6.308 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.708 -2.779 5.067 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -6.009 -7.470 4.364 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -6.068 -3.395 3.120 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.724 -5.740 2.767 1.00 0.00 H new ATOM 1691 N SER A 106 -3.815 -5.900 9.886 1.00 0.00 N ATOM 1692 CA SER A 106 -3.887 -7.175 10.591 1.00 0.00 C ATOM 1693 C SER A 106 -4.836 -7.105 11.784 1.00 0.00 C ATOM 1694 O SER A 106 -5.331 -8.132 12.249 1.00 0.00 O ATOM 1695 CB SER A 106 -2.494 -7.611 11.048 1.00 0.00 C ATOM 1696 OG SER A 106 -2.040 -8.730 10.305 1.00 0.00 O ATOM 0 H SER A 106 -3.024 -5.313 10.151 1.00 0.00 H new ATOM 0 HA SER A 106 -4.281 -7.915 9.895 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.794 -6.784 10.930 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.517 -7.860 12.109 1.00 0.00 H new ATOM 0 HG SER A 106 -1.147 -8.988 10.615 1.00 0.00 H new ATOM 1702 N THR A 107 -5.105 -5.900 12.267 1.00 0.00 N ATOM 1703 CA THR A 107 -6.013 -5.727 13.391 1.00 0.00 C ATOM 1704 C THR A 107 -7.405 -5.372 12.895 1.00 0.00 C ATOM 1705 O THR A 107 -8.402 -5.676 13.549 1.00 0.00 O ATOM 1706 CB THR A 107 -5.497 -4.649 14.344 1.00 0.00 C ATOM 1707 OG1 THR A 107 -4.163 -4.923 14.736 1.00 0.00 O ATOM 1708 CG2 THR A 107 -6.326 -4.515 15.603 1.00 0.00 C ATOM 0 H THR A 107 -4.710 -5.034 11.901 1.00 0.00 H new ATOM 0 HA THR A 107 -6.065 -6.669 13.937 1.00 0.00 H new ATOM 0 HB THR A 107 -5.562 -3.715 13.785 1.00 0.00 H new ATOM 0 HG1 THR A 107 -3.850 -4.221 15.344 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.905 -3.733 16.235 1.00 0.00 H new ATOM 0 HG22 THR A 107 -7.351 -4.255 15.338 1.00 0.00 H new ATOM 0 HG23 THR A 107 -6.321 -5.461 16.145 1.00 0.00 H new ATOM 1716 N MET A 108 -7.471 -4.751 11.724 1.00 0.00 N ATOM 1717 CA MET A 108 -8.745 -4.388 11.138 1.00 0.00 C ATOM 1718 C MET A 108 -9.346 -5.587 10.423 1.00 0.00 C ATOM 1719 O MET A 108 -10.558 -5.652 10.217 1.00 0.00 O ATOM 1720 CB MET A 108 -8.572 -3.219 10.174 1.00 0.00 C ATOM 1721 CG MET A 108 -8.100 -1.944 10.855 1.00 0.00 C ATOM 1722 SD MET A 108 -7.037 -0.942 9.799 1.00 0.00 S ATOM 1723 CE MET A 108 -6.854 0.526 10.809 1.00 0.00 C ATOM 0 H MET A 108 -6.657 -4.491 11.167 1.00 0.00 H new ATOM 0 HA MET A 108 -9.424 -4.078 11.932 1.00 0.00 H new ATOM 0 HB2 MET A 108 -7.855 -3.497 9.401 1.00 0.00 H new ATOM 0 HB3 MET A 108 -9.521 -3.026 9.674 1.00 0.00 H new ATOM 0 HG2 MET A 108 -8.967 -1.355 11.154 1.00 0.00 H new ATOM 0 HG3 MET A 108 -7.560 -2.202 11.766 1.00 0.00 H new ATOM 0 HE1 MET A 108 -5.858 0.945 10.665 1.00 0.00 H new ATOM 0 HE2 MET A 108 -7.603 1.263 10.519 1.00 0.00 H new ATOM 0 HE3 MET A 108 -6.989 0.265 11.859 1.00 0.00 H new ATOM 1733 N MET A 109 -8.498 -6.549 10.057 1.00 0.00 N ATOM 1734 CA MET A 109 -8.976 -7.744 9.387 1.00 0.00 C ATOM 1735 C MET A 109 -9.875 -8.534 10.324 1.00 0.00 C ATOM 1736 O MET A 109 -10.867 -9.126 9.899 1.00 0.00 O ATOM 1737 CB MET A 109 -7.808 -8.618 8.933 1.00 0.00 C ATOM 1738 CG MET A 109 -6.748 -8.813 9.998 1.00 0.00 C ATOM 1739 SD MET A 109 -5.634 -10.182 9.630 1.00 0.00 S ATOM 1740 CE MET A 109 -6.584 -11.568 10.253 1.00 0.00 C ATOM 0 H MET A 109 -7.491 -6.520 10.214 1.00 0.00 H new ATOM 0 HA MET A 109 -9.543 -7.442 8.506 1.00 0.00 H new ATOM 0 HB2 MET A 109 -8.190 -9.593 8.630 1.00 0.00 H new ATOM 0 HB3 MET A 109 -7.349 -8.168 8.053 1.00 0.00 H new ATOM 0 HG2 MET A 109 -6.168 -7.896 10.100 1.00 0.00 H new ATOM 0 HG3 MET A 109 -7.232 -8.992 10.958 1.00 0.00 H new ATOM 0 HE1 MET A 109 -6.026 -12.491 10.097 1.00 0.00 H new ATOM 0 HE2 MET A 109 -6.770 -11.432 11.318 1.00 0.00 H new ATOM 0 HE3 MET A 109 -7.535 -11.625 9.723 1.00 0.00 H new ATOM 1750 N SER A 110 -9.527 -8.532 11.612 1.00 0.00 N ATOM 1751 CA SER A 110 -10.316 -9.243 12.611 1.00 0.00 C ATOM 1752 C SER A 110 -11.771 -8.779 12.574 1.00 0.00 C ATOM 1753 O SER A 110 -12.674 -9.497 13.002 1.00 0.00 O ATOM 1754 CB SER A 110 -9.732 -9.022 14.007 1.00 0.00 C ATOM 1755 OG SER A 110 -8.742 -9.991 14.305 1.00 0.00 O ATOM 0 H SER A 110 -8.709 -8.048 11.983 1.00 0.00 H new ATOM 0 HA SER A 110 -10.282 -10.308 12.380 1.00 0.00 H new ATOM 0 HB2 SER A 110 -9.299 -8.024 14.069 1.00 0.00 H new ATOM 0 HB3 SER A 110 -10.528 -9.071 14.750 1.00 0.00 H new ATOM 0 HG SER A 110 -8.383 -9.827 15.202 1.00 0.00 H new ATOM 1761 N VAL A 111 -11.986 -7.571 12.058 1.00 0.00 N ATOM 1762 CA VAL A 111 -13.324 -7.004 11.960 1.00 0.00 C ATOM 1763 C VAL A 111 -14.095 -7.609 10.786 1.00 0.00 C ATOM 1764 O VAL A 111 -15.277 -7.931 10.912 1.00 0.00 O ATOM 1765 CB VAL A 111 -13.263 -5.468 11.809 1.00 0.00 C ATOM 1766 CG1 VAL A 111 -14.643 -4.890 11.521 1.00 0.00 C ATOM 1767 CG2 VAL A 111 -12.670 -4.838 13.060 1.00 0.00 C ATOM 0 H VAL A 111 -11.246 -6.966 11.701 1.00 0.00 H new ATOM 0 HA VAL A 111 -13.849 -7.246 12.884 1.00 0.00 H new ATOM 0 HB VAL A 111 -12.619 -5.235 10.961 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -14.570 -3.807 11.420 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -15.030 -5.316 10.595 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -15.318 -5.133 12.342 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -12.633 -3.755 12.940 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -13.290 -5.086 13.921 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -11.661 -5.220 13.217 1.00 0.00 H new ATOM 1777 N HIS A 112 -13.425 -7.765 9.646 1.00 0.00 N ATOM 1778 CA HIS A 112 -14.061 -8.336 8.462 1.00 0.00 C ATOM 1779 C HIS A 112 -14.224 -9.847 8.611 1.00 0.00 C ATOM 1780 O HIS A 112 -15.148 -10.440 8.054 1.00 0.00 O ATOM 1781 CB HIS A 112 -13.254 -8.008 7.199 1.00 0.00 C ATOM 1782 CG HIS A 112 -12.045 -8.871 6.999 1.00 0.00 C ATOM 1783 ND1 HIS A 112 -10.762 -8.396 7.108 1.00 0.00 N ATOM 1784 CD2 HIS A 112 -11.930 -10.188 6.714 1.00 0.00 C ATOM 1785 CE1 HIS A 112 -9.908 -9.383 6.905 1.00 0.00 C ATOM 1786 NE2 HIS A 112 -10.593 -10.481 6.665 1.00 0.00 N ATOM 0 H HIS A 112 -12.447 -7.505 9.518 1.00 0.00 H new ATOM 0 HA HIS A 112 -15.051 -7.891 8.363 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -13.905 -8.107 6.330 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -12.939 -6.966 7.244 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -12.743 -10.881 6.554 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -8.831 -9.303 6.931 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -10.193 -11.400 6.474 1.00 0.00 H new ATOM 1795 N ARG A 113 -13.322 -10.463 9.369 1.00 0.00 N ATOM 1796 CA ARG A 113 -13.365 -11.902 9.594 1.00 0.00 C ATOM 1797 C ARG A 113 -14.367 -12.251 10.689 1.00 0.00 C ATOM 1798 O ARG A 113 -14.961 -13.329 10.680 1.00 0.00 O ATOM 1799 CB ARG A 113 -11.977 -12.422 9.971 1.00 0.00 C ATOM 1800 CG ARG A 113 -11.144 -12.859 8.777 1.00 0.00 C ATOM 1801 CD ARG A 113 -11.072 -14.373 8.669 1.00 0.00 C ATOM 1802 NE ARG A 113 -10.166 -14.805 7.608 1.00 0.00 N ATOM 1803 CZ ARG A 113 -9.655 -16.031 7.521 1.00 0.00 C ATOM 1804 NH1 ARG A 113 -9.958 -16.949 8.431 1.00 0.00 N ATOM 1805 NH2 ARG A 113 -8.839 -16.340 6.523 1.00 0.00 N ATOM 0 H ARG A 113 -12.552 -9.986 9.838 1.00 0.00 H new ATOM 0 HA ARG A 113 -13.685 -12.380 8.668 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -11.441 -11.642 10.511 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -12.087 -13.264 10.654 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -11.574 -12.449 7.863 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -10.137 -12.452 8.867 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -10.740 -14.789 9.620 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -12.069 -14.770 8.478 1.00 0.00 H new ATOM 0 HE ARG A 113 -9.910 -14.127 6.891 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -10.585 -16.716 9.201 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -9.564 -17.887 8.360 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -8.603 -15.638 5.822 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -8.448 -17.280 6.457 1.00 0.00 H new ATOM 1819 N GLY A 114 -14.549 -11.332 11.633 1.00 0.00 N ATOM 1820 CA GLY A 114 -15.481 -11.563 12.721 1.00 0.00 C ATOM 1821 C GLY A 114 -16.859 -10.997 12.438 1.00 0.00 C ATOM 1822 O GLY A 114 -17.860 -11.501 12.946 1.00 0.00 O ATOM 0 H GLY A 114 -14.068 -10.433 11.663 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -15.563 -12.635 12.903 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -15.088 -11.114 13.633 1.00 0.00 H new ATOM 1826 N GLU A 115 -16.909 -9.949 11.622 1.00 0.00 N ATOM 1827 CA GLU A 115 -18.174 -9.315 11.271 1.00 0.00 C ATOM 1828 C GLU A 115 -18.682 -9.822 9.925 1.00 0.00 C ATOM 1829 O GLU A 115 -19.232 -9.059 9.130 1.00 0.00 O ATOM 1830 CB GLU A 115 -18.011 -7.794 11.229 1.00 0.00 C ATOM 1831 CG GLU A 115 -19.331 -7.041 11.230 1.00 0.00 C ATOM 1832 CD GLU A 115 -19.207 -5.646 10.649 1.00 0.00 C ATOM 1833 OE1 GLU A 115 -18.637 -5.510 9.547 1.00 0.00 O ATOM 1834 OE2 GLU A 115 -19.680 -4.689 11.297 1.00 0.00 O ATOM 0 H GLU A 115 -16.089 -9.521 11.192 1.00 0.00 H new ATOM 0 HA GLU A 115 -18.907 -9.574 12.035 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -17.420 -7.476 12.088 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -17.448 -7.522 10.337 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -20.067 -7.605 10.657 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -19.706 -6.973 12.251 1.00 0.00 H new ATOM 1841 N VAL A 116 -18.495 -11.113 9.675 1.00 0.00 N ATOM 1842 CA VAL A 116 -18.934 -11.722 8.426 1.00 0.00 C ATOM 1843 C VAL A 116 -19.840 -12.925 8.689 1.00 0.00 C ATOM 1844 O VAL A 116 -19.503 -14.057 8.342 1.00 0.00 O ATOM 1845 CB VAL A 116 -17.733 -12.166 7.566 1.00 0.00 C ATOM 1846 CG1 VAL A 116 -16.900 -13.205 8.302 1.00 0.00 C ATOM 1847 CG2 VAL A 116 -18.204 -12.702 6.222 1.00 0.00 C ATOM 0 H VAL A 116 -18.042 -11.758 10.322 1.00 0.00 H new ATOM 0 HA VAL A 116 -19.497 -10.964 7.882 1.00 0.00 H new ATOM 0 HB VAL A 116 -17.103 -11.296 7.382 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -16.058 -13.505 7.678 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -16.528 -12.779 9.234 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -17.517 -14.076 8.522 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -17.342 -13.010 5.631 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.859 -13.558 6.381 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -18.749 -11.922 5.690 1.00 0.00 H new ATOM 1857 N PRO A 117 -21.009 -12.692 9.312 1.00 0.00 N ATOM 1858 CA PRO A 117 -21.964 -13.760 9.621 1.00 0.00 C ATOM 1859 C PRO A 117 -22.634 -14.319 8.370 1.00 0.00 C ATOM 1860 O PRO A 117 -23.467 -13.655 7.752 1.00 0.00 O ATOM 1861 CB PRO A 117 -22.995 -13.068 10.516 1.00 0.00 C ATOM 1862 CG PRO A 117 -22.923 -11.630 10.132 1.00 0.00 C ATOM 1863 CD PRO A 117 -21.489 -11.372 9.760 1.00 0.00 C ATOM 0 HA PRO A 117 -21.479 -14.616 10.090 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -23.994 -13.472 10.354 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -22.761 -13.208 11.571 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -23.588 -11.416 9.295 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -23.233 -10.990 10.958 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -21.407 -10.625 8.970 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -20.914 -11.002 10.609 1.00 0.00 H new ATOM 1871 N CYS A 118 -22.265 -15.540 8.003 1.00 0.00 N ATOM 1872 CA CYS A 118 -22.830 -16.189 6.825 1.00 0.00 C ATOM 1873 C CYS A 118 -24.336 -16.379 6.978 1.00 0.00 C ATOM 1874 O CYS A 118 -24.833 -16.612 8.080 1.00 0.00 O ATOM 1875 CB CYS A 118 -22.155 -17.540 6.586 1.00 0.00 C ATOM 1876 SG CYS A 118 -22.056 -18.019 4.846 1.00 0.00 S ATOM 0 H CYS A 118 -21.577 -16.102 8.504 1.00 0.00 H new ATOM 0 HA CYS A 118 -22.649 -15.544 5.965 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -21.148 -17.509 7.001 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -22.701 -18.309 7.133 1.00 0.00 H new ATOM 0 HG CYS A 118 -21.467 -19.174 4.747 1.00 0.00 H new ATOM 1882 N THR A 119 -25.056 -16.278 5.866 1.00 0.00 N ATOM 1883 CA THR A 119 -26.505 -16.440 5.878 1.00 0.00 C ATOM 1884 C THR A 119 -27.163 -15.395 6.773 1.00 0.00 C ATOM 1885 O THR A 119 -27.167 -15.526 7.997 1.00 0.00 O ATOM 1886 CB THR A 119 -26.879 -17.844 6.353 1.00 0.00 C ATOM 1887 OG1 THR A 119 -25.946 -18.799 5.882 1.00 0.00 O ATOM 1888 CG2 THR A 119 -28.255 -18.283 5.899 1.00 0.00 C ATOM 0 H THR A 119 -24.660 -16.085 4.946 1.00 0.00 H new ATOM 0 HA THR A 119 -26.869 -16.300 4.860 1.00 0.00 H new ATOM 0 HB THR A 119 -26.873 -17.791 7.442 1.00 0.00 H new ATOM 0 HG1 THR A 119 -26.202 -19.690 6.198 1.00 0.00 H new ATOM 0 HG21 THR A 119 -28.457 -19.288 6.270 1.00 0.00 H new ATOM 0 HG22 THR A 119 -29.004 -17.594 6.290 1.00 0.00 H new ATOM 0 HG23 THR A 119 -28.296 -18.284 4.810 1.00 0.00 H new ATOM 1896 N VAL A 120 -27.717 -14.357 6.155 1.00 0.00 N ATOM 1897 CA VAL A 120 -28.377 -13.289 6.896 1.00 0.00 C ATOM 1898 C VAL A 120 -29.795 -13.689 7.290 1.00 0.00 C ATOM 1899 O VAL A 120 -30.453 -12.905 8.006 1.00 0.00 O ATOM 1900 CB VAL A 120 -28.433 -11.987 6.077 1.00 0.00 C ATOM 1901 CG1 VAL A 120 -27.050 -11.365 5.965 1.00 0.00 C ATOM 1902 CG2 VAL A 120 -29.021 -12.249 4.698 1.00 0.00 C ATOM 1903 OXT VAL A 120 -30.236 -14.784 6.879 1.00 0.00 O ATOM 0 H VAL A 120 -27.722 -14.233 5.143 1.00 0.00 H new ATOM 0 HA VAL A 120 -27.786 -13.118 7.796 1.00 0.00 H new ATOM 0 HB VAL A 120 -29.082 -11.281 6.596 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -27.111 -10.446 5.383 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -26.671 -11.139 6.962 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -26.376 -12.064 5.470 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -29.053 -11.317 4.133 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -28.401 -12.973 4.169 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -30.031 -12.645 4.802 1.00 0.00 H new TER 1913 VAL A 120