USER MOD reduce.3.24.130724 H: found=0, std=0, add=1118, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1129 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 80 ASN : amide:sc= -0.0472 K(o=0.89,f=-1.6!) USER MOD Set 1.2: A 85 HIS : no HD1:sc= -0.176 K(o=0.89,f=-5.5!) USER MOD Set 1.3: A 138 CYS SG : rot 51:sc= 1.32 USER MOD Set 1.4: A 143 HIS : no HE2:sc= -0.201 K(o=0.89,f=-0.49) USER MOD Set 2.1: A 130 THR OG1 : rot 180:sc= 1.08 USER MOD Set 2.2: A 134 TYR OH : rot -7:sc= 1.21 USER MOD Set 3.1: A 71 THR OG1 : rot -64:sc= 1.28 USER MOD Set 3.2: A 128 HIS : no HE2:sc= 0.983 K(o=2.3,f=-5!) USER MOD Set 4.1: A 90 THR OG1 : rot 112:sc= 2.09 USER MOD Set 4.2: A 92 LYS NZ :NH3+ -157:sc= 1.67 (180deg=0.164) USER MOD Set 5.1: A 78 ASN : amide:sc= 1.23 K(o=3.1,f=-2.5!) USER MOD Set 5.2: A 112 SER OG : rot -137:sc= 1.83 USER MOD Set 6.1: A 39 HIS : no HE2:sc= 0.323 K(o=1.3,f=-0.81) USER MOD Set 6.2: A 75 THR OG1 : rot -163:sc= 1.02 USER MOD Set 7.1: A 63 THR OG1 : rot 91:sc= 1.94 USER MOD Set 7.2: A 151 LYS NZ :NH3+ -163:sc= 0.911 (180deg=-0.0375) USER MOD Set 8.1: A 33 TYR OH : rot -10:sc= 1.1 USER MOD Set 8.2: A 57 HIS : no HE2:sc= -0.482 K(o=0.62,f=-7.1) USER MOD Set 9.1: A 53 SER OG : rot 39:sc= 0.927 USER MOD Set 9.2: A 60 LYS NZ :NH3+ -168:sc= 0.637 (180deg=-0.0429) USER MOD Set10.1: A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set10.2: A 34 SER OG : rot 180:sc= -0.14 USER MOD Set11.1: A 27 SER OG : rot 139:sc= 0.496 USER MOD Set11.2: A 32 THR OG1 : rot -113:sc= 2.07 USER MOD Set12.1: A 11 THR OG1 : rot -44:sc= 1.18 USER MOD Set12.2: A 14 GLN : amide:sc= 1.58 K(o=2.8,f=-4.4!) USER MOD Single : A 5 THR OG1 : rot -34:sc= 0.0559 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0509) USER MOD Single : A 16 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0199) USER MOD Single : A 18 MET CE :methyl 169:sc=-0.00425 (180deg=-0.249) USER MOD Single : A 21 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0233) USER MOD Single : A 23 THR OG1 : rot 180:sc= -0.29 USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.017 USER MOD Single : A 36 LYS NZ :NH3+ 171:sc=-0.00196 (180deg=-0.089) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 157:sc= 0.0643 (180deg=-0.708!) USER MOD Single : A 61 ASN : amide:sc= 0.252 K(o=0.25,f=-5.1!) USER MOD Single : A 79 THR OG1 : rot 130:sc= -0.0158 USER MOD Single : A 81 LYS NZ :NH3+ -171:sc= 0.876 (180deg=0.757) USER MOD Single : A 86 SER OG : rot -39:sc= 1.13 USER MOD Single : A 91 LYS NZ :NH3+ -117:sc= 0.00622 (180deg=-0.06) USER MOD Single : A 96 TYR OH : rot 0:sc= 1.2 USER MOD Single : A 99 MET CE :methyl -169:sc= -0.0344 (180deg=-0.308) USER MOD Single : A 109 THR OG1 : rot 167:sc= 1.97 USER MOD Single : A 116 LYS NZ :NH3+ 140:sc=-0.00601 (180deg=-0.721) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot -165:sc= 0.134 USER MOD Single : A 126 THR OG1 : rot -68:sc= 1.23 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 TYR OH : rot 13:sc= 1.19 USER MOD Single : A 139 GLN : amide:sc= 0.211 K(o=0.21,f=-3) USER MOD Single : A 146 THR OG1 : rot -78:sc= 1.08 USER MOD Single : A 148 MET CE :methyl -143:sc= -2.2 (180deg=-2.55) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 54 N THR A 5 -3.800 -3.485 12.544 1.00 0.00 N ATOM 55 CA THR A 5 -5.246 -3.523 12.427 1.00 0.00 C ATOM 56 C THR A 5 -5.845 -2.146 12.730 1.00 0.00 C ATOM 57 O THR A 5 -6.892 -2.057 13.369 1.00 0.00 O ATOM 58 CB THR A 5 -5.812 -4.611 13.357 1.00 0.00 C ATOM 59 OG1 THR A 5 -5.514 -4.290 14.700 1.00 0.00 O ATOM 60 CG2 THR A 5 -5.240 -6.000 13.053 1.00 0.00 C ATOM 0 HA THR A 5 -5.522 -3.776 11.403 1.00 0.00 H new ATOM 0 HB THR A 5 -6.889 -4.642 13.189 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.645 -3.839 14.744 1.00 0.00 H new ATOM 0 HG21 THR A 5 -5.673 -6.729 13.738 1.00 0.00 H new ATOM 0 HG22 THR A 5 -5.483 -6.277 12.027 1.00 0.00 H new ATOM 0 HG23 THR A 5 -4.157 -5.983 13.178 1.00 0.00 H new ATOM 68 N THR A 6 -5.196 -1.062 12.288 1.00 0.00 N ATOM 69 CA THR A 6 -5.687 0.299 12.504 1.00 0.00 C ATOM 70 C THR A 6 -6.786 0.595 11.476 1.00 0.00 C ATOM 71 O THR A 6 -6.668 1.485 10.639 1.00 0.00 O ATOM 72 CB THR A 6 -4.519 1.305 12.483 1.00 0.00 C ATOM 73 OG1 THR A 6 -3.447 0.800 13.256 1.00 0.00 O ATOM 74 CG2 THR A 6 -4.970 2.643 13.073 1.00 0.00 C ATOM 0 H THR A 6 -4.317 -1.106 11.772 1.00 0.00 H new ATOM 0 HA THR A 6 -6.135 0.400 13.493 1.00 0.00 H new ATOM 0 HB THR A 6 -4.198 1.452 11.452 1.00 0.00 H new ATOM 0 HG1 THR A 6 -2.704 1.439 13.241 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.139 3.348 13.054 1.00 0.00 H new ATOM 0 HG22 THR A 6 -5.796 3.041 12.483 1.00 0.00 H new ATOM 0 HG23 THR A 6 -5.297 2.495 14.102 1.00 0.00 H new ATOM 82 N TRP A 7 -7.866 -0.175 11.562 1.00 0.00 N ATOM 83 CA TRP A 7 -8.962 -0.189 10.609 1.00 0.00 C ATOM 84 C TRP A 7 -9.886 1.007 10.842 1.00 0.00 C ATOM 85 O TRP A 7 -10.407 1.168 11.944 1.00 0.00 O ATOM 86 CB TRP A 7 -9.763 -1.481 10.841 1.00 0.00 C ATOM 87 CG TRP A 7 -9.079 -2.813 10.704 1.00 0.00 C ATOM 88 CD1 TRP A 7 -9.600 -3.975 11.161 1.00 0.00 C ATOM 89 CD2 TRP A 7 -7.860 -3.190 9.986 1.00 0.00 C ATOM 90 NE1 TRP A 7 -8.814 -5.034 10.762 1.00 0.00 N ATOM 91 CE2 TRP A 7 -7.745 -4.611 10.006 1.00 0.00 C ATOM 92 CE3 TRP A 7 -6.838 -2.491 9.313 1.00 0.00 C ATOM 93 CZ2 TRP A 7 -6.703 -5.285 9.358 1.00 0.00 C ATOM 94 CZ3 TRP A 7 -5.845 -3.163 8.580 1.00 0.00 C ATOM 95 CH2 TRP A 7 -5.780 -4.561 8.598 1.00 0.00 C ATOM 0 H TRP A 7 -8.004 -0.832 12.330 1.00 0.00 H new ATOM 0 HA TRP A 7 -8.570 -0.138 9.593 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -10.180 -1.430 11.847 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -10.603 -1.473 10.147 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -10.500 -4.060 11.752 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -9.001 -6.009 10.997 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -6.817 -1.412 9.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -6.613 -6.358 9.445 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -5.129 -2.599 8.001 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -5.021 -5.077 8.028 1.00 0.00 H new ATOM 106 N LYS A 8 -10.106 1.830 9.813 1.00 0.00 N ATOM 107 CA LYS A 8 -11.050 2.938 9.835 1.00 0.00 C ATOM 108 C LYS A 8 -11.706 3.015 8.456 1.00 0.00 C ATOM 109 O LYS A 8 -11.309 2.287 7.546 1.00 0.00 O ATOM 110 CB LYS A 8 -10.297 4.248 10.118 1.00 0.00 C ATOM 111 CG LYS A 8 -9.515 4.296 11.437 1.00 0.00 C ATOM 112 CD LYS A 8 -10.442 4.336 12.660 1.00 0.00 C ATOM 113 CE LYS A 8 -9.655 4.177 13.966 1.00 0.00 C ATOM 114 NZ LYS A 8 -8.668 5.254 14.156 1.00 0.00 N ATOM 0 H LYS A 8 -9.618 1.737 8.922 1.00 0.00 H new ATOM 0 HA LYS A 8 -11.801 2.788 10.611 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -9.602 4.430 9.298 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -11.016 5.067 10.114 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.865 3.423 11.504 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.870 5.175 11.443 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -10.986 5.280 12.675 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -11.184 3.541 12.582 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -10.348 4.169 14.807 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -9.144 3.214 13.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.208 5.144 15.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -7.951 5.204 13.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.148 6.176 14.116 1.00 0.00 H new ATOM 128 N GLU A 9 -12.710 3.881 8.280 1.00 0.00 N ATOM 129 CA GLU A 9 -13.277 4.147 6.967 1.00 0.00 C ATOM 130 C GLU A 9 -13.599 5.632 6.840 1.00 0.00 C ATOM 131 O GLU A 9 -13.919 6.286 7.831 1.00 0.00 O ATOM 132 CB GLU A 9 -14.528 3.321 6.625 1.00 0.00 C ATOM 133 CG GLU A 9 -14.522 1.856 7.104 1.00 0.00 C ATOM 134 CD GLU A 9 -14.723 1.712 8.606 1.00 0.00 C ATOM 135 OE1 GLU A 9 -15.604 2.354 9.169 1.00 0.00 O ATOM 136 OE2 GLU A 9 -13.886 0.852 9.242 1.00 0.00 O ATOM 0 H GLU A 9 -13.143 4.408 9.038 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.514 3.842 6.250 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -15.397 3.819 7.055 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -14.659 3.328 5.543 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -15.309 1.308 6.585 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -13.575 1.394 6.825 1.00 0.00 H new ATOM 144 N ALA A 10 -13.496 6.135 5.614 1.00 0.00 N ATOM 145 CA ALA A 10 -13.867 7.474 5.193 1.00 0.00 C ATOM 146 C ALA A 10 -14.926 7.301 4.104 1.00 0.00 C ATOM 147 O ALA A 10 -15.588 6.265 4.082 1.00 0.00 O ATOM 148 CB ALA A 10 -12.618 8.172 4.654 1.00 0.00 C ATOM 0 H ALA A 10 -13.127 5.580 4.842 1.00 0.00 H new ATOM 0 HA ALA A 10 -14.265 8.081 6.006 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -12.875 9.181 4.332 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -11.863 8.223 5.438 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -12.224 7.610 3.807 1.00 0.00 H new ATOM 154 N THR A 11 -15.073 8.258 3.183 1.00 0.00 N ATOM 155 CA THR A 11 -15.935 8.134 2.015 1.00 0.00 C ATOM 156 C THR A 11 -15.178 8.639 0.780 1.00 0.00 C ATOM 157 O THR A 11 -14.083 9.193 0.902 1.00 0.00 O ATOM 158 CB THR A 11 -17.287 8.847 2.224 1.00 0.00 C ATOM 159 OG1 THR A 11 -17.112 10.247 2.196 1.00 0.00 O ATOM 160 CG2 THR A 11 -17.962 8.479 3.548 1.00 0.00 C ATOM 0 H THR A 11 -14.586 9.153 3.233 1.00 0.00 H new ATOM 0 HA THR A 11 -16.185 7.085 1.857 1.00 0.00 H new ATOM 0 HB THR A 11 -17.930 8.514 1.409 1.00 0.00 H new ATOM 0 HG1 THR A 11 -16.326 10.489 2.729 1.00 0.00 H new ATOM 0 HG21 THR A 11 -18.908 9.013 3.635 1.00 0.00 H new ATOM 0 HG22 THR A 11 -18.148 7.405 3.576 1.00 0.00 H new ATOM 0 HG23 THR A 11 -17.311 8.756 4.377 1.00 0.00 H new ATOM 168 N LEU A 12 -15.763 8.449 -0.409 1.00 0.00 N ATOM 169 CA LEU A 12 -15.135 8.756 -1.695 1.00 0.00 C ATOM 170 C LEU A 12 -14.291 10.042 -1.709 1.00 0.00 C ATOM 171 O LEU A 12 -13.104 9.961 -2.027 1.00 0.00 O ATOM 172 CB LEU A 12 -16.187 8.726 -2.814 1.00 0.00 C ATOM 173 CG LEU A 12 -15.560 8.822 -4.217 1.00 0.00 C ATOM 174 CD1 LEU A 12 -16.321 7.912 -5.189 1.00 0.00 C ATOM 175 CD2 LEU A 12 -15.585 10.256 -4.763 1.00 0.00 C ATOM 0 H LEU A 12 -16.705 8.070 -0.503 1.00 0.00 H new ATOM 0 HA LEU A 12 -14.403 7.970 -1.878 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -16.765 7.805 -2.740 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -16.885 9.552 -2.674 1.00 0.00 H new ATOM 0 HG LEU A 12 -14.520 8.507 -4.128 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -15.874 7.983 -6.180 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -16.267 6.881 -4.840 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -17.364 8.224 -5.238 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -15.133 10.276 -5.754 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -16.616 10.603 -4.828 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -15.024 10.909 -4.095 1.00 0.00 H new ATOM 187 N PRO A 13 -14.828 11.229 -1.379 1.00 0.00 N ATOM 188 CA PRO A 13 -14.046 12.458 -1.428 1.00 0.00 C ATOM 189 C PRO A 13 -12.772 12.401 -0.577 1.00 0.00 C ATOM 190 O PRO A 13 -11.759 12.996 -0.948 1.00 0.00 O ATOM 191 CB PRO A 13 -14.991 13.583 -0.987 1.00 0.00 C ATOM 192 CG PRO A 13 -16.120 12.854 -0.258 1.00 0.00 C ATOM 193 CD PRO A 13 -16.201 11.527 -1.004 1.00 0.00 C ATOM 0 HA PRO A 13 -13.675 12.628 -2.439 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -14.487 14.294 -0.332 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -15.366 14.147 -1.841 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -15.893 12.711 0.799 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -17.058 13.406 -0.311 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -16.618 10.743 -0.372 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -16.843 11.605 -1.881 1.00 0.00 H new ATOM 201 N GLN A 14 -12.779 11.676 0.548 1.00 0.00 N ATOM 202 CA GLN A 14 -11.563 11.554 1.335 1.00 0.00 C ATOM 203 C GLN A 14 -10.489 10.789 0.564 1.00 0.00 C ATOM 204 O GLN A 14 -9.310 11.073 0.740 1.00 0.00 O ATOM 205 CB GLN A 14 -11.806 10.909 2.696 1.00 0.00 C ATOM 206 CG GLN A 14 -12.545 11.845 3.666 1.00 0.00 C ATOM 207 CD GLN A 14 -14.029 11.971 3.357 1.00 0.00 C ATOM 208 OE1 GLN A 14 -14.755 10.984 3.402 1.00 0.00 O ATOM 209 NE2 GLN A 14 -14.504 13.175 3.053 1.00 0.00 N ATOM 0 H GLN A 14 -13.590 11.182 0.919 1.00 0.00 H new ATOM 0 HA GLN A 14 -11.209 12.568 1.521 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -12.387 9.996 2.564 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -10.851 10.619 3.133 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -12.422 11.475 4.684 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -12.087 12.833 3.628 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -13.876 13.978 3.023 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -15.496 13.295 2.850 1.00 0.00 H new ATOM 218 N VAL A 15 -10.864 9.838 -0.296 1.00 0.00 N ATOM 219 CA VAL A 15 -9.873 9.143 -1.114 1.00 0.00 C ATOM 220 C VAL A 15 -9.064 10.173 -1.905 1.00 0.00 C ATOM 221 O VAL A 15 -7.832 10.164 -1.875 1.00 0.00 O ATOM 222 CB VAL A 15 -10.538 8.117 -2.045 1.00 0.00 C ATOM 223 CG1 VAL A 15 -9.475 7.307 -2.797 1.00 0.00 C ATOM 224 CG2 VAL A 15 -11.441 7.156 -1.266 1.00 0.00 C ATOM 0 H VAL A 15 -11.828 9.538 -0.441 1.00 0.00 H new ATOM 0 HA VAL A 15 -9.199 8.586 -0.463 1.00 0.00 H new ATOM 0 HB VAL A 15 -11.149 8.673 -2.756 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -9.963 6.585 -3.452 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.860 7.980 -3.394 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -8.846 6.779 -2.081 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -11.895 6.444 -1.955 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -10.848 6.618 -0.527 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -12.224 7.721 -0.761 1.00 0.00 H new ATOM 234 N LYS A 16 -9.771 11.089 -2.576 1.00 0.00 N ATOM 235 CA LYS A 16 -9.136 12.192 -3.278 1.00 0.00 C ATOM 236 C LYS A 16 -8.279 12.998 -2.301 1.00 0.00 C ATOM 237 O LYS A 16 -7.099 13.218 -2.562 1.00 0.00 O ATOM 238 CB LYS A 16 -10.177 13.076 -3.976 1.00 0.00 C ATOM 239 CG LYS A 16 -10.983 12.302 -5.029 1.00 0.00 C ATOM 240 CD LYS A 16 -12.052 13.181 -5.698 1.00 0.00 C ATOM 241 CE LYS A 16 -11.495 14.441 -6.378 1.00 0.00 C ATOM 242 NZ LYS A 16 -10.439 14.125 -7.356 1.00 0.00 N ATOM 0 H LYS A 16 -10.789 11.081 -2.643 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.488 11.790 -4.056 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.858 13.490 -3.232 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -9.675 13.918 -4.452 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -10.306 11.913 -5.789 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -11.462 11.443 -4.559 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -12.583 12.586 -6.440 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -12.783 13.480 -4.947 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.306 14.970 -6.879 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -11.096 15.115 -5.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -10.164 14.991 -7.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -9.612 13.736 -6.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -10.795 13.424 -8.037 1.00 0.00 H new ATOM 256 N ALA A 17 -8.854 13.408 -1.166 1.00 0.00 N ATOM 257 CA ALA A 17 -8.136 14.186 -0.163 1.00 0.00 C ATOM 258 C ALA A 17 -6.787 13.553 0.203 1.00 0.00 C ATOM 259 O ALA A 17 -5.763 14.230 0.157 1.00 0.00 O ATOM 260 CB ALA A 17 -9.001 14.400 1.080 1.00 0.00 C ATOM 0 H ALA A 17 -9.824 13.209 -0.922 1.00 0.00 H new ATOM 0 HA ALA A 17 -7.920 15.160 -0.602 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -8.445 14.983 1.814 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -9.909 14.936 0.804 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -9.267 13.434 1.509 1.00 0.00 H new ATOM 266 N MET A 18 -6.768 12.262 0.551 1.00 0.00 N ATOM 267 CA MET A 18 -5.519 11.571 0.830 1.00 0.00 C ATOM 268 C MET A 18 -4.613 11.570 -0.405 1.00 0.00 C ATOM 269 O MET A 18 -3.457 11.978 -0.302 1.00 0.00 O ATOM 270 CB MET A 18 -5.744 10.149 1.365 1.00 0.00 C ATOM 271 CG MET A 18 -6.047 10.113 2.873 1.00 0.00 C ATOM 272 SD MET A 18 -7.749 10.384 3.413 1.00 0.00 S ATOM 273 CE MET A 18 -8.484 8.837 2.833 1.00 0.00 C ATOM 0 H MET A 18 -7.602 11.683 0.644 1.00 0.00 H new ATOM 0 HA MET A 18 -5.014 12.122 1.623 1.00 0.00 H new ATOM 0 HB2 MET A 18 -6.571 9.690 0.823 1.00 0.00 H new ATOM 0 HB3 MET A 18 -4.858 9.547 1.164 1.00 0.00 H new ATOM 0 HG2 MET A 18 -5.729 9.142 3.253 1.00 0.00 H new ATOM 0 HG3 MET A 18 -5.422 10.864 3.355 1.00 0.00 H new ATOM 0 HE1 MET A 18 -9.487 8.734 3.246 1.00 0.00 H new ATOM 0 HE2 MET A 18 -8.539 8.846 1.744 1.00 0.00 H new ATOM 0 HE3 MET A 18 -7.869 7.998 3.159 1.00 0.00 H new ATOM 283 N LEU A 19 -5.108 11.118 -1.565 1.00 0.00 N ATOM 284 CA LEU A 19 -4.302 11.038 -2.788 1.00 0.00 C ATOM 285 C LEU A 19 -3.605 12.366 -3.097 1.00 0.00 C ATOM 286 O LEU A 19 -2.439 12.377 -3.489 1.00 0.00 O ATOM 287 CB LEU A 19 -5.162 10.598 -3.982 1.00 0.00 C ATOM 288 CG LEU A 19 -5.549 9.110 -3.955 1.00 0.00 C ATOM 289 CD1 LEU A 19 -6.678 8.870 -4.963 1.00 0.00 C ATOM 290 CD2 LEU A 19 -4.368 8.202 -4.328 1.00 0.00 C ATOM 0 H LEU A 19 -6.070 10.800 -1.681 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.530 10.288 -2.616 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.071 11.200 -4.004 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.620 10.806 -4.904 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.863 8.867 -2.940 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.959 7.817 -4.951 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.541 9.479 -4.694 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -6.338 9.143 -5.962 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.686 7.160 -4.296 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.025 8.446 -5.333 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.554 8.355 -3.620 1.00 0.00 H new ATOM 302 N GLU A 20 -4.312 13.480 -2.901 1.00 0.00 N ATOM 303 CA GLU A 20 -3.790 14.821 -3.122 1.00 0.00 C ATOM 304 C GLU A 20 -2.559 15.128 -2.258 1.00 0.00 C ATOM 305 O GLU A 20 -1.788 16.012 -2.622 1.00 0.00 O ATOM 306 CB GLU A 20 -4.898 15.852 -2.874 1.00 0.00 C ATOM 307 CG GLU A 20 -5.972 15.807 -3.972 1.00 0.00 C ATOM 308 CD GLU A 20 -7.229 16.557 -3.560 1.00 0.00 C ATOM 309 OE1 GLU A 20 -8.330 16.040 -3.718 1.00 0.00 O ATOM 310 OE2 GLU A 20 -7.038 17.791 -3.026 1.00 0.00 O ATOM 0 H GLU A 20 -5.280 13.471 -2.579 1.00 0.00 H new ATOM 0 HA GLU A 20 -3.460 14.879 -4.159 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -5.360 15.664 -1.905 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -4.463 16.851 -2.831 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -5.573 16.241 -4.889 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -6.223 14.770 -4.193 1.00 0.00 H new ATOM 318 N LYS A 21 -2.367 14.443 -1.123 1.00 0.00 N ATOM 319 CA LYS A 21 -1.210 14.698 -0.276 1.00 0.00 C ATOM 320 C LYS A 21 0.053 14.181 -0.967 1.00 0.00 C ATOM 321 O LYS A 21 0.902 14.981 -1.352 1.00 0.00 O ATOM 322 CB LYS A 21 -1.406 14.092 1.121 1.00 0.00 C ATOM 323 CG LYS A 21 -2.564 14.779 1.858 1.00 0.00 C ATOM 324 CD LYS A 21 -2.884 14.124 3.211 1.00 0.00 C ATOM 325 CE LYS A 21 -1.712 14.120 4.202 1.00 0.00 C ATOM 326 NZ LYS A 21 -1.213 15.479 4.474 1.00 0.00 N ATOM 0 H LYS A 21 -2.995 13.717 -0.778 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.096 15.772 -0.130 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.608 13.024 1.034 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.488 14.197 1.699 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -2.315 15.828 2.018 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -3.454 14.755 1.229 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -3.726 14.646 3.664 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -3.202 13.096 3.038 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -2.029 13.657 5.136 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -0.902 13.510 3.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -0.468 15.437 5.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.824 15.887 3.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -1.995 16.074 4.816 1.00 0.00 H new ATOM 340 N ASP A 22 0.162 12.856 -1.139 1.00 0.00 N ATOM 341 CA ASP A 22 1.242 12.146 -1.843 1.00 0.00 C ATOM 342 C ASP A 22 2.662 12.375 -1.289 1.00 0.00 C ATOM 343 O ASP A 22 3.315 11.419 -0.874 1.00 0.00 O ATOM 344 CB ASP A 22 1.142 12.395 -3.354 1.00 0.00 C ATOM 345 CG ASP A 22 2.418 12.040 -4.107 1.00 0.00 C ATOM 346 OD1 ASP A 22 2.647 10.876 -4.413 1.00 0.00 O ATOM 347 OD2 ASP A 22 3.239 13.082 -4.405 1.00 0.00 O ATOM 0 H ASP A 22 -0.540 12.214 -0.770 1.00 0.00 H new ATOM 0 HA ASP A 22 1.079 11.086 -1.647 1.00 0.00 H new ATOM 0 HB2 ASP A 22 0.315 11.811 -3.758 1.00 0.00 H new ATOM 0 HB3 ASP A 22 0.905 13.445 -3.528 1.00 0.00 H new ATOM 353 N THR A 23 3.167 13.611 -1.311 1.00 0.00 N ATOM 354 CA THR A 23 4.485 14.014 -0.821 1.00 0.00 C ATOM 355 C THR A 23 5.618 13.181 -1.442 1.00 0.00 C ATOM 356 O THR A 23 6.611 12.881 -0.786 1.00 0.00 O ATOM 357 CB THR A 23 4.508 14.055 0.724 1.00 0.00 C ATOM 358 OG1 THR A 23 3.957 12.894 1.313 1.00 0.00 O ATOM 359 CG2 THR A 23 3.693 15.242 1.243 1.00 0.00 C ATOM 0 H THR A 23 2.640 14.397 -1.691 1.00 0.00 H new ATOM 0 HA THR A 23 4.677 15.033 -1.157 1.00 0.00 H new ATOM 0 HB THR A 23 5.560 14.136 0.998 1.00 0.00 H new ATOM 0 HG1 THR A 23 3.998 12.971 2.289 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.721 15.254 2.333 1.00 0.00 H new ATOM 0 HG22 THR A 23 4.117 16.170 0.859 1.00 0.00 H new ATOM 0 HG23 THR A 23 2.660 15.149 0.908 1.00 0.00 H new ATOM 367 N GLY A 24 5.478 12.848 -2.727 1.00 0.00 N ATOM 368 CA GLY A 24 6.373 11.967 -3.460 1.00 0.00 C ATOM 369 C GLY A 24 6.574 12.474 -4.887 1.00 0.00 C ATOM 370 O GLY A 24 5.606 12.622 -5.634 1.00 0.00 O ATOM 0 H GLY A 24 4.711 13.199 -3.300 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.334 11.909 -2.950 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.962 10.958 -3.481 1.00 0.00 H new ATOM 374 N LYS A 25 7.827 12.741 -5.256 1.00 0.00 N ATOM 375 CA LYS A 25 8.245 13.238 -6.557 1.00 0.00 C ATOM 376 C LYS A 25 8.293 12.069 -7.544 1.00 0.00 C ATOM 377 O LYS A 25 9.057 11.123 -7.340 1.00 0.00 O ATOM 378 CB LYS A 25 9.636 13.870 -6.402 1.00 0.00 C ATOM 379 CG LYS A 25 9.608 15.114 -5.498 1.00 0.00 C ATOM 380 CD LYS A 25 10.910 15.266 -4.700 1.00 0.00 C ATOM 381 CE LYS A 25 12.146 15.386 -5.597 1.00 0.00 C ATOM 382 NZ LYS A 25 13.358 15.607 -4.788 1.00 0.00 N ATOM 0 H LYS A 25 8.613 12.608 -4.620 1.00 0.00 H new ATOM 0 HA LYS A 25 7.546 13.984 -6.934 1.00 0.00 H new ATOM 0 HB2 LYS A 25 10.324 13.134 -5.985 1.00 0.00 H new ATOM 0 HB3 LYS A 25 10.021 14.145 -7.384 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.449 16.003 -6.108 1.00 0.00 H new ATOM 0 HG3 LYS A 25 8.766 15.045 -4.810 1.00 0.00 H new ATOM 0 HD2 LYS A 25 10.840 16.149 -4.065 1.00 0.00 H new ATOM 0 HD3 LYS A 25 11.028 14.407 -4.039 1.00 0.00 H new ATOM 0 HE2 LYS A 25 12.260 14.479 -6.191 1.00 0.00 H new ATOM 0 HE3 LYS A 25 12.015 16.211 -6.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 14.184 15.686 -5.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 13.254 16.485 -4.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 13.492 14.807 -4.137 1.00 0.00 H new ATOM 396 N VAL A 26 7.474 12.127 -8.600 1.00 0.00 N ATOM 397 CA VAL A 26 7.300 11.062 -9.582 1.00 0.00 C ATOM 398 C VAL A 26 8.575 10.902 -10.425 1.00 0.00 C ATOM 399 O VAL A 26 8.654 11.337 -11.573 1.00 0.00 O ATOM 400 CB VAL A 26 6.050 11.344 -10.441 1.00 0.00 C ATOM 401 CG1 VAL A 26 5.724 10.144 -11.346 1.00 0.00 C ATOM 402 CG2 VAL A 26 4.814 11.634 -9.575 1.00 0.00 C ATOM 0 H VAL A 26 6.897 12.945 -8.797 1.00 0.00 H new ATOM 0 HA VAL A 26 7.137 10.112 -9.074 1.00 0.00 H new ATOM 0 HB VAL A 26 6.283 12.222 -11.044 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.839 10.367 -11.942 1.00 0.00 H new ATOM 0 HG12 VAL A 26 6.567 9.948 -12.008 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.535 9.265 -10.730 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.956 11.827 -10.219 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.605 10.773 -8.940 1.00 0.00 H new ATOM 0 HG23 VAL A 26 5.004 12.508 -8.951 1.00 0.00 H new ATOM 412 N SER A 27 9.587 10.258 -9.850 1.00 0.00 N ATOM 413 CA SER A 27 10.877 10.024 -10.472 1.00 0.00 C ATOM 414 C SER A 27 10.737 8.811 -11.398 1.00 0.00 C ATOM 415 O SER A 27 11.232 7.718 -11.115 1.00 0.00 O ATOM 416 CB SER A 27 11.953 9.852 -9.384 1.00 0.00 C ATOM 417 OG SER A 27 11.746 10.745 -8.296 1.00 0.00 O ATOM 0 H SER A 27 9.525 9.874 -8.907 1.00 0.00 H new ATOM 0 HA SER A 27 11.198 10.871 -11.078 1.00 0.00 H new ATOM 0 HB2 SER A 27 11.941 8.825 -9.019 1.00 0.00 H new ATOM 0 HB3 SER A 27 12.939 10.026 -9.816 1.00 0.00 H new ATOM 0 HG SER A 27 11.917 10.277 -7.452 1.00 0.00 H new ATOM 423 N GLY A 28 10.003 8.999 -12.497 1.00 0.00 N ATOM 424 CA GLY A 28 9.675 7.929 -13.425 1.00 0.00 C ATOM 425 C GLY A 28 8.829 6.878 -12.711 1.00 0.00 C ATOM 426 O GLY A 28 7.716 7.176 -12.285 1.00 0.00 O ATOM 0 H GLY A 28 9.620 9.906 -12.764 1.00 0.00 H new ATOM 0 HA2 GLY A 28 9.131 8.329 -14.281 1.00 0.00 H new ATOM 0 HA3 GLY A 28 10.588 7.476 -13.811 1.00 0.00 H new ATOM 430 N ASP A 29 9.364 5.664 -12.526 1.00 0.00 N ATOM 431 CA ASP A 29 8.656 4.617 -11.792 1.00 0.00 C ATOM 432 C ASP A 29 8.753 4.837 -10.281 1.00 0.00 C ATOM 433 O ASP A 29 7.977 4.258 -9.522 1.00 0.00 O ATOM 434 CB ASP A 29 9.191 3.221 -12.137 1.00 0.00 C ATOM 435 CG ASP A 29 8.462 2.152 -11.325 1.00 0.00 C ATOM 436 OD1 ASP A 29 9.062 1.543 -10.442 1.00 0.00 O ATOM 437 OD2 ASP A 29 7.148 1.966 -11.622 1.00 0.00 O ATOM 0 H ASP A 29 10.282 5.387 -12.875 1.00 0.00 H new ATOM 0 HA ASP A 29 7.611 4.675 -12.096 1.00 0.00 H new ATOM 0 HB2 ASP A 29 9.061 3.028 -13.202 1.00 0.00 H new ATOM 0 HB3 ASP A 29 10.261 3.174 -11.933 1.00 0.00 H new ATOM 443 N THR A 30 9.726 5.636 -9.841 1.00 0.00 N ATOM 444 CA THR A 30 10.012 5.797 -8.432 1.00 0.00 C ATOM 445 C THR A 30 9.374 7.066 -7.866 1.00 0.00 C ATOM 446 O THR A 30 9.805 8.169 -8.180 1.00 0.00 O ATOM 447 CB THR A 30 11.528 5.746 -8.236 1.00 0.00 C ATOM 448 OG1 THR A 30 12.029 4.539 -8.774 1.00 0.00 O ATOM 449 CG2 THR A 30 11.919 5.814 -6.766 1.00 0.00 C ATOM 0 H THR A 30 10.330 6.183 -10.455 1.00 0.00 H new ATOM 0 HA THR A 30 9.564 4.981 -7.866 1.00 0.00 H new ATOM 0 HB THR A 30 11.952 6.612 -8.745 1.00 0.00 H new ATOM 0 HG1 THR A 30 13.001 4.505 -8.651 1.00 0.00 H new ATOM 0 HG21 THR A 30 13.005 5.775 -6.676 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.553 6.746 -6.335 1.00 0.00 H new ATOM 0 HG23 THR A 30 11.480 4.970 -6.233 1.00 0.00 H new ATOM 457 N VAL A 31 8.354 6.931 -7.021 1.00 0.00 N ATOM 458 CA VAL A 31 7.795 8.065 -6.301 1.00 0.00 C ATOM 459 C VAL A 31 8.779 8.298 -5.133 1.00 0.00 C ATOM 460 O VAL A 31 8.958 7.431 -4.278 1.00 0.00 O ATOM 461 CB VAL A 31 6.325 7.777 -5.929 1.00 0.00 C ATOM 462 CG1 VAL A 31 5.816 8.838 -4.957 1.00 0.00 C ATOM 463 CG2 VAL A 31 5.409 7.808 -7.169 1.00 0.00 C ATOM 0 H VAL A 31 7.898 6.041 -6.820 1.00 0.00 H new ATOM 0 HA VAL A 31 7.717 8.991 -6.871 1.00 0.00 H new ATOM 0 HB VAL A 31 6.298 6.784 -5.480 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.778 8.628 -4.700 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.424 8.825 -4.053 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.882 9.821 -5.424 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.382 7.601 -6.868 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.459 8.793 -7.634 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.737 7.052 -7.883 1.00 0.00 H new ATOM 473 N THR A 32 9.475 9.440 -5.132 1.00 0.00 N ATOM 474 CA THR A 32 10.580 9.736 -4.225 1.00 0.00 C ATOM 475 C THR A 32 10.178 10.746 -3.160 1.00 0.00 C ATOM 476 O THR A 32 9.796 11.868 -3.486 1.00 0.00 O ATOM 477 CB THR A 32 11.770 10.256 -5.050 1.00 0.00 C ATOM 478 OG1 THR A 32 12.181 9.259 -5.966 1.00 0.00 O ATOM 479 CG2 THR A 32 12.973 10.657 -4.191 1.00 0.00 C ATOM 0 H THR A 32 9.277 10.202 -5.781 1.00 0.00 H new ATOM 0 HA THR A 32 10.863 8.823 -3.702 1.00 0.00 H new ATOM 0 HB THR A 32 11.423 11.151 -5.566 1.00 0.00 H new ATOM 0 HG1 THR A 32 13.073 8.935 -5.719 1.00 0.00 H new ATOM 0 HG21 THR A 32 13.777 11.015 -4.835 1.00 0.00 H new ATOM 0 HG22 THR A 32 12.680 11.449 -3.502 1.00 0.00 H new ATOM 0 HG23 THR A 32 13.319 9.793 -3.624 1.00 0.00 H new ATOM 487 N TYR A 33 10.295 10.360 -1.892 1.00 0.00 N ATOM 488 CA TYR A 33 10.038 11.243 -0.768 1.00 0.00 C ATOM 489 C TYR A 33 11.248 12.129 -0.489 1.00 0.00 C ATOM 490 O TYR A 33 12.339 11.912 -1.015 1.00 0.00 O ATOM 491 CB TYR A 33 9.662 10.406 0.453 1.00 0.00 C ATOM 492 CG TYR A 33 8.273 9.826 0.330 1.00 0.00 C ATOM 493 CD1 TYR A 33 8.043 8.694 -0.474 1.00 0.00 C ATOM 494 CD2 TYR A 33 7.187 10.527 0.883 1.00 0.00 C ATOM 495 CE1 TYR A 33 6.727 8.294 -0.756 1.00 0.00 C ATOM 496 CE2 TYR A 33 5.878 10.079 0.660 1.00 0.00 C ATOM 497 CZ TYR A 33 5.649 9.001 -0.202 1.00 0.00 C ATOM 498 OH TYR A 33 4.379 8.619 -0.486 1.00 0.00 O ATOM 0 H TYR A 33 10.573 9.418 -1.618 1.00 0.00 H new ATOM 0 HA TYR A 33 9.205 11.904 -1.008 1.00 0.00 H new ATOM 0 HB2 TYR A 33 10.383 9.598 0.576 1.00 0.00 H new ATOM 0 HB3 TYR A 33 9.720 11.024 1.349 1.00 0.00 H new ATOM 0 HD1 TYR A 33 8.876 8.135 -0.873 1.00 0.00 H new ATOM 0 HD2 TYR A 33 7.361 11.410 1.479 1.00 0.00 H new ATOM 0 HE1 TYR A 33 6.545 7.444 -1.398 1.00 0.00 H new ATOM 0 HE2 TYR A 33 5.048 10.565 1.152 1.00 0.00 H new ATOM 0 HH TYR A 33 4.391 7.951 -1.203 1.00 0.00 H new ATOM 508 N SER A 34 11.043 13.148 0.346 1.00 0.00 N ATOM 509 CA SER A 34 12.059 14.136 0.692 1.00 0.00 C ATOM 510 C SER A 34 11.672 14.820 2.005 1.00 0.00 C ATOM 511 O SER A 34 11.700 16.044 2.107 1.00 0.00 O ATOM 512 CB SER A 34 12.221 15.164 -0.442 1.00 0.00 C ATOM 513 OG SER A 34 12.559 14.555 -1.676 1.00 0.00 O ATOM 0 H SER A 34 10.148 13.311 0.808 1.00 0.00 H new ATOM 0 HA SER A 34 13.020 13.638 0.824 1.00 0.00 H new ATOM 0 HB2 SER A 34 11.293 15.723 -0.558 1.00 0.00 H new ATOM 0 HB3 SER A 34 12.994 15.883 -0.170 1.00 0.00 H new ATOM 0 HG SER A 34 12.650 15.244 -2.367 1.00 0.00 H new ATOM 519 N GLY A 35 11.287 14.027 3.005 1.00 0.00 N ATOM 520 CA GLY A 35 10.873 14.511 4.310 1.00 0.00 C ATOM 521 C GLY A 35 10.572 13.302 5.186 1.00 0.00 C ATOM 522 O GLY A 35 10.546 12.181 4.683 1.00 0.00 O ATOM 0 H GLY A 35 11.256 13.011 2.923 1.00 0.00 H new ATOM 0 HA2 GLY A 35 11.659 15.120 4.758 1.00 0.00 H new ATOM 0 HA3 GLY A 35 9.991 15.145 4.219 1.00 0.00 H new ATOM 526 N LYS A 36 10.364 13.521 6.488 1.00 0.00 N ATOM 527 CA LYS A 36 10.110 12.441 7.433 1.00 0.00 C ATOM 528 C LYS A 36 8.662 11.950 7.352 1.00 0.00 C ATOM 529 O LYS A 36 8.405 10.770 7.584 1.00 0.00 O ATOM 530 CB LYS A 36 10.469 12.887 8.857 1.00 0.00 C ATOM 531 CG LYS A 36 11.968 13.177 9.055 1.00 0.00 C ATOM 532 CD LYS A 36 12.822 11.897 9.018 1.00 0.00 C ATOM 533 CE LYS A 36 14.306 12.175 9.289 1.00 0.00 C ATOM 534 NZ LYS A 36 14.541 12.661 10.660 1.00 0.00 N ATOM 0 H LYS A 36 10.368 14.449 6.910 1.00 0.00 H new ATOM 0 HA LYS A 36 10.747 11.598 7.165 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.899 13.783 9.102 1.00 0.00 H new ATOM 0 HB3 LYS A 36 10.162 12.112 9.559 1.00 0.00 H new ATOM 0 HG2 LYS A 36 12.309 13.861 8.278 1.00 0.00 H new ATOM 0 HG3 LYS A 36 12.115 13.681 10.010 1.00 0.00 H new ATOM 0 HD2 LYS A 36 12.446 11.191 9.759 1.00 0.00 H new ATOM 0 HD3 LYS A 36 12.717 11.421 8.043 1.00 0.00 H new ATOM 0 HE2 LYS A 36 14.880 11.263 9.125 1.00 0.00 H new ATOM 0 HE3 LYS A 36 14.671 12.914 8.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 15.564 12.690 10.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 14.143 13.616 10.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 14.083 12.020 11.339 1.00 0.00 H new ATOM 548 N THR A 37 7.710 12.829 7.038 1.00 0.00 N ATOM 549 CA THR A 37 6.295 12.484 6.991 1.00 0.00 C ATOM 550 C THR A 37 5.987 11.753 5.680 1.00 0.00 C ATOM 551 O THR A 37 5.375 12.304 4.765 1.00 0.00 O ATOM 552 CB THR A 37 5.473 13.770 7.155 1.00 0.00 C ATOM 553 OG1 THR A 37 6.055 14.563 8.171 1.00 0.00 O ATOM 554 CG2 THR A 37 4.022 13.453 7.526 1.00 0.00 C ATOM 0 H THR A 37 7.903 13.804 6.809 1.00 0.00 H new ATOM 0 HA THR A 37 6.029 11.807 7.803 1.00 0.00 H new ATOM 0 HB THR A 37 5.474 14.308 6.207 1.00 0.00 H new ATOM 0 HG1 THR A 37 5.536 15.387 8.280 1.00 0.00 H new ATOM 0 HG21 THR A 37 3.463 14.382 7.636 1.00 0.00 H new ATOM 0 HG22 THR A 37 3.569 12.848 6.740 1.00 0.00 H new ATOM 0 HG23 THR A 37 3.999 12.902 8.466 1.00 0.00 H new ATOM 562 N VAL A 38 6.430 10.502 5.582 1.00 0.00 N ATOM 563 CA VAL A 38 6.316 9.718 4.366 1.00 0.00 C ATOM 564 C VAL A 38 4.897 9.151 4.266 1.00 0.00 C ATOM 565 O VAL A 38 4.609 8.043 4.715 1.00 0.00 O ATOM 566 CB VAL A 38 7.473 8.708 4.300 1.00 0.00 C ATOM 567 CG1 VAL A 38 7.301 7.667 3.194 1.00 0.00 C ATOM 568 CG2 VAL A 38 8.774 9.486 4.047 1.00 0.00 C ATOM 0 H VAL A 38 6.880 10.006 6.351 1.00 0.00 H new ATOM 0 HA VAL A 38 6.434 10.320 3.465 1.00 0.00 H new ATOM 0 HB VAL A 38 7.494 8.168 5.247 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.151 6.985 3.201 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.383 7.105 3.363 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.247 8.168 2.228 1.00 0.00 H new ATOM 0 HG21 VAL A 38 9.611 8.789 3.996 1.00 0.00 H new ATOM 0 HG22 VAL A 38 8.696 10.029 3.105 1.00 0.00 H new ATOM 0 HG23 VAL A 38 8.939 10.193 4.860 1.00 0.00 H new ATOM 578 N HIS A 39 4.001 9.961 3.699 1.00 0.00 N ATOM 579 CA HIS A 39 2.594 9.644 3.509 1.00 0.00 C ATOM 580 C HIS A 39 2.393 8.866 2.203 1.00 0.00 C ATOM 581 O HIS A 39 2.407 9.462 1.125 1.00 0.00 O ATOM 582 CB HIS A 39 1.806 10.958 3.509 1.00 0.00 C ATOM 583 CG HIS A 39 0.321 10.744 3.542 1.00 0.00 C ATOM 584 ND1 HIS A 39 -0.571 11.031 2.529 1.00 0.00 N ATOM 585 CD2 HIS A 39 -0.366 10.151 4.561 1.00 0.00 C ATOM 586 CE1 HIS A 39 -1.790 10.633 2.937 1.00 0.00 C ATOM 587 NE2 HIS A 39 -1.684 10.090 4.165 1.00 0.00 N ATOM 0 H HIS A 39 4.249 10.887 3.349 1.00 0.00 H new ATOM 0 HA HIS A 39 2.233 9.007 4.317 1.00 0.00 H new ATOM 0 HB2 HIS A 39 2.102 11.554 4.372 1.00 0.00 H new ATOM 0 HB3 HIS A 39 2.066 11.533 2.620 1.00 0.00 H new ATOM 0 HD1 HIS A 39 -0.347 11.466 1.634 1.00 0.00 H new ATOM 0 HD2 HIS A 39 0.044 9.798 5.496 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -2.705 10.733 2.372 1.00 0.00 H new ATOM 596 N VAL A 40 2.218 7.546 2.285 1.00 0.00 N ATOM 597 CA VAL A 40 2.096 6.654 1.133 1.00 0.00 C ATOM 598 C VAL A 40 0.624 6.287 0.944 1.00 0.00 C ATOM 599 O VAL A 40 0.077 5.559 1.769 1.00 0.00 O ATOM 600 CB VAL A 40 2.968 5.405 1.357 1.00 0.00 C ATOM 601 CG1 VAL A 40 2.751 4.348 0.265 1.00 0.00 C ATOM 602 CG2 VAL A 40 4.452 5.783 1.408 1.00 0.00 C ATOM 0 H VAL A 40 2.156 7.056 3.178 1.00 0.00 H new ATOM 0 HA VAL A 40 2.446 7.148 0.227 1.00 0.00 H new ATOM 0 HB VAL A 40 2.665 4.976 2.312 1.00 0.00 H new ATOM 0 HG11 VAL A 40 3.386 3.485 0.463 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.706 4.037 0.262 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.006 4.771 -0.707 1.00 0.00 H new ATOM 0 HG21 VAL A 40 5.051 4.886 1.567 1.00 0.00 H new ATOM 0 HG22 VAL A 40 4.741 6.250 0.467 1.00 0.00 H new ATOM 0 HG23 VAL A 40 4.621 6.482 2.227 1.00 0.00 H new ATOM 612 N VAL A 41 -0.017 6.775 -0.125 1.00 0.00 N ATOM 613 CA VAL A 41 -1.442 6.555 -0.360 1.00 0.00 C ATOM 614 C VAL A 41 -1.648 5.347 -1.281 1.00 0.00 C ATOM 615 O VAL A 41 -1.469 5.465 -2.495 1.00 0.00 O ATOM 616 CB VAL A 41 -2.099 7.832 -0.908 1.00 0.00 C ATOM 617 CG1 VAL A 41 -3.617 7.758 -0.715 1.00 0.00 C ATOM 618 CG2 VAL A 41 -1.560 9.078 -0.198 1.00 0.00 C ATOM 0 H VAL A 41 0.440 7.332 -0.847 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.933 6.325 0.586 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.862 7.906 -1.969 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.078 8.665 -1.105 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.010 6.893 -1.249 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.845 7.663 0.347 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.042 9.966 -0.606 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.771 9.008 0.869 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.483 9.147 -0.352 1.00 0.00 H new ATOM 628 N ALA A 42 -2.013 4.196 -0.705 1.00 0.00 N ATOM 629 CA ALA A 42 -2.180 2.921 -1.394 1.00 0.00 C ATOM 630 C ALA A 42 -3.661 2.613 -1.641 1.00 0.00 C ATOM 631 O ALA A 42 -4.383 2.202 -0.731 1.00 0.00 O ATOM 632 CB ALA A 42 -1.503 1.811 -0.583 1.00 0.00 C ATOM 0 H ALA A 42 -2.207 4.130 0.294 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.703 2.981 -2.372 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.627 0.858 -1.097 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.441 2.032 -0.480 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -1.959 1.753 0.405 1.00 0.00 H new ATOM 638 N ALA A 43 -4.100 2.783 -2.889 1.00 0.00 N ATOM 639 CA ALA A 43 -5.435 2.464 -3.364 1.00 0.00 C ATOM 640 C ALA A 43 -5.463 1.012 -3.857 1.00 0.00 C ATOM 641 O ALA A 43 -4.845 0.678 -4.870 1.00 0.00 O ATOM 642 CB ALA A 43 -5.799 3.447 -4.479 1.00 0.00 C ATOM 0 H ALA A 43 -3.504 3.164 -3.624 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.169 2.558 -2.564 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.800 3.223 -4.849 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.776 4.465 -4.089 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.081 3.354 -5.294 1.00 0.00 H new ATOM 648 N ALA A 44 -6.158 0.130 -3.134 1.00 0.00 N ATOM 649 CA ALA A 44 -6.216 -1.286 -3.475 1.00 0.00 C ATOM 650 C ALA A 44 -7.487 -1.604 -4.258 1.00 0.00 C ATOM 651 O ALA A 44 -8.538 -1.842 -3.669 1.00 0.00 O ATOM 652 CB ALA A 44 -6.087 -2.151 -2.223 1.00 0.00 C ATOM 0 H ALA A 44 -6.692 0.379 -2.301 1.00 0.00 H new ATOM 0 HA ALA A 44 -5.370 -1.521 -4.121 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -6.133 -3.204 -2.502 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.134 -1.946 -1.736 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -6.902 -1.922 -1.537 1.00 0.00 H new ATOM 658 N VAL A 45 -7.354 -1.611 -5.584 1.00 0.00 N ATOM 659 CA VAL A 45 -8.348 -2.014 -6.566 1.00 0.00 C ATOM 660 C VAL A 45 -9.714 -1.391 -6.258 1.00 0.00 C ATOM 661 O VAL A 45 -10.669 -2.077 -5.888 1.00 0.00 O ATOM 662 CB VAL A 45 -8.361 -3.551 -6.686 1.00 0.00 C ATOM 663 CG1 VAL A 45 -9.153 -3.992 -7.918 1.00 0.00 C ATOM 664 CG2 VAL A 45 -6.949 -4.144 -6.821 1.00 0.00 C ATOM 0 H VAL A 45 -6.485 -1.313 -6.027 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.082 -1.628 -7.550 1.00 0.00 H new ATOM 0 HB VAL A 45 -8.822 -3.915 -5.768 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -9.149 -5.080 -7.983 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.180 -3.637 -7.836 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -8.695 -3.573 -8.814 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.016 -5.229 -6.902 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -6.470 -3.742 -7.714 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.359 -3.882 -5.943 1.00 0.00 H new ATOM 674 N LEU A 46 -9.813 -0.072 -6.440 1.00 0.00 N ATOM 675 CA LEU A 46 -11.027 0.646 -6.073 1.00 0.00 C ATOM 676 C LEU A 46 -12.104 0.409 -7.136 1.00 0.00 C ATOM 677 O LEU A 46 -11.748 0.183 -8.294 1.00 0.00 O ATOM 678 CB LEU A 46 -10.751 2.153 -5.974 1.00 0.00 C ATOM 679 CG LEU A 46 -9.558 2.526 -5.085 1.00 0.00 C ATOM 680 CD1 LEU A 46 -9.523 4.051 -4.929 1.00 0.00 C ATOM 681 CD2 LEU A 46 -9.620 1.876 -3.701 1.00 0.00 C ATOM 0 H LEU A 46 -9.075 0.511 -6.835 1.00 0.00 H new ATOM 0 HA LEU A 46 -11.367 0.279 -5.105 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -10.577 2.544 -6.976 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -11.643 2.648 -5.590 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.655 2.155 -5.569 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.680 4.333 -4.299 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -9.414 4.515 -5.909 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -10.450 4.391 -4.468 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -8.749 2.177 -3.118 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.528 2.196 -3.189 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.627 0.791 -3.808 1.00 0.00 H new ATOM 693 N PRO A 47 -13.400 0.478 -6.772 1.00 0.00 N ATOM 694 CA PRO A 47 -14.517 0.370 -7.701 1.00 0.00 C ATOM 695 C PRO A 47 -14.268 1.185 -8.973 1.00 0.00 C ATOM 696 O PRO A 47 -14.270 2.413 -8.945 1.00 0.00 O ATOM 697 CB PRO A 47 -15.751 0.837 -6.923 1.00 0.00 C ATOM 698 CG PRO A 47 -15.405 0.425 -5.493 1.00 0.00 C ATOM 699 CD PRO A 47 -13.904 0.699 -5.423 1.00 0.00 C ATOM 0 HA PRO A 47 -14.656 -0.652 -8.054 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -15.905 1.912 -7.011 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -16.662 0.355 -7.277 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -15.959 1.009 -4.758 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -15.635 -0.624 -5.306 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -13.707 1.719 -5.094 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -13.417 0.034 -4.709 1.00 0.00 H new ATOM 748 N PHE A 51 -9.668 -5.761 -11.166 1.00 0.00 N ATOM 749 CA PHE A 51 -8.507 -6.438 -10.605 1.00 0.00 C ATOM 750 C PHE A 51 -7.363 -6.184 -11.597 1.00 0.00 C ATOM 751 O PHE A 51 -7.648 -5.743 -12.712 1.00 0.00 O ATOM 752 CB PHE A 51 -8.787 -7.952 -10.502 1.00 0.00 C ATOM 753 CG PHE A 51 -9.601 -8.402 -9.303 1.00 0.00 C ATOM 754 CD1 PHE A 51 -9.100 -8.224 -7.998 1.00 0.00 C ATOM 755 CD2 PHE A 51 -10.845 -9.037 -9.489 1.00 0.00 C ATOM 756 CE1 PHE A 51 -9.843 -8.664 -6.890 1.00 0.00 C ATOM 757 CE2 PHE A 51 -11.591 -9.470 -8.377 1.00 0.00 C ATOM 758 CZ PHE A 51 -11.089 -9.283 -7.079 1.00 0.00 C ATOM 0 HA PHE A 51 -8.265 -6.075 -9.606 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -9.307 -8.267 -11.407 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -7.832 -8.477 -10.484 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -8.142 -7.748 -7.849 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -11.227 -9.192 -10.487 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -9.455 -8.526 -5.891 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -12.550 -9.946 -8.522 1.00 0.00 H new ATOM 0 HZ PHE A 51 -11.662 -9.615 -6.226 1.00 0.00 H new ATOM 768 N PRO A 52 -6.098 -6.497 -11.268 1.00 0.00 N ATOM 769 CA PRO A 52 -5.621 -6.978 -9.977 1.00 0.00 C ATOM 770 C PRO A 52 -4.652 -6.012 -9.280 1.00 0.00 C ATOM 771 O PRO A 52 -4.479 -6.092 -8.072 1.00 0.00 O ATOM 772 CB PRO A 52 -4.841 -8.243 -10.344 1.00 0.00 C ATOM 773 CG PRO A 52 -4.154 -7.844 -11.655 1.00 0.00 C ATOM 774 CD PRO A 52 -5.152 -6.882 -12.312 1.00 0.00 C ATOM 0 HA PRO A 52 -6.455 -7.114 -9.289 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -4.119 -8.512 -9.573 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -5.500 -9.101 -10.476 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -3.194 -7.362 -11.473 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -3.960 -8.712 -12.286 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -4.641 -6.008 -12.716 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -5.666 -7.363 -13.144 1.00 0.00 H new ATOM 782 N SER A 53 -4.003 -5.112 -10.017 1.00 0.00 N ATOM 783 CA SER A 53 -2.877 -4.328 -9.537 1.00 0.00 C ATOM 784 C SER A 53 -3.146 -3.286 -8.447 1.00 0.00 C ATOM 785 O SER A 53 -4.172 -2.611 -8.489 1.00 0.00 O ATOM 786 CB SER A 53 -2.243 -3.663 -10.760 1.00 0.00 C ATOM 787 OG SER A 53 -3.288 -3.150 -11.569 1.00 0.00 O ATOM 0 H SER A 53 -4.254 -4.907 -10.984 1.00 0.00 H new ATOM 0 HA SER A 53 -2.221 -5.032 -9.025 1.00 0.00 H new ATOM 0 HB2 SER A 53 -1.570 -2.862 -10.453 1.00 0.00 H new ATOM 0 HB3 SER A 53 -1.646 -4.383 -11.319 1.00 0.00 H new ATOM 0 HG SER A 53 -3.991 -2.776 -10.997 1.00 0.00 H new ATOM 793 N PHE A 54 -2.153 -3.043 -7.574 1.00 0.00 N ATOM 794 CA PHE A 54 -2.216 -1.985 -6.561 1.00 0.00 C ATOM 795 C PHE A 54 -1.990 -0.647 -7.254 1.00 0.00 C ATOM 796 O PHE A 54 -1.014 -0.495 -7.997 1.00 0.00 O ATOM 797 CB PHE A 54 -1.049 -2.060 -5.547 1.00 0.00 C ATOM 798 CG PHE A 54 -1.218 -2.883 -4.288 1.00 0.00 C ATOM 799 CD1 PHE A 54 -2.320 -2.649 -3.443 1.00 0.00 C ATOM 800 CD2 PHE A 54 -0.129 -3.629 -3.796 1.00 0.00 C ATOM 801 CE1 PHE A 54 -2.439 -3.348 -2.230 1.00 0.00 C ATOM 802 CE2 PHE A 54 -0.222 -4.289 -2.559 1.00 0.00 C ATOM 803 CZ PHE A 54 -1.394 -4.179 -1.793 1.00 0.00 C ATOM 0 H PHE A 54 -1.285 -3.578 -7.554 1.00 0.00 H new ATOM 0 HA PHE A 54 -3.178 -2.095 -6.061 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -0.178 -2.446 -6.077 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.812 -1.040 -5.243 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -3.075 -1.931 -3.728 1.00 0.00 H new ATOM 0 HD2 PHE A 54 0.782 -3.694 -4.372 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.334 -3.246 -1.634 1.00 0.00 H new ATOM 0 HE2 PHE A 54 0.607 -4.880 -2.198 1.00 0.00 H new ATOM 0 HZ PHE A 54 -1.492 -4.732 -0.870 1.00 0.00 H new ATOM 813 N GLU A 55 -2.855 0.327 -6.969 1.00 0.00 N ATOM 814 CA GLU A 55 -2.654 1.679 -7.437 1.00 0.00 C ATOM 815 C GLU A 55 -2.121 2.488 -6.252 1.00 0.00 C ATOM 816 O GLU A 55 -2.650 2.361 -5.152 1.00 0.00 O ATOM 817 CB GLU A 55 -3.911 2.262 -8.081 1.00 0.00 C ATOM 818 CG GLU A 55 -4.869 1.260 -8.754 1.00 0.00 C ATOM 819 CD GLU A 55 -5.845 0.617 -7.773 1.00 0.00 C ATOM 820 OE1 GLU A 55 -6.842 1.235 -7.404 1.00 0.00 O ATOM 821 OE2 GLU A 55 -5.550 -0.644 -7.363 1.00 0.00 O ATOM 0 H GLU A 55 -3.701 0.194 -6.414 1.00 0.00 H new ATOM 0 HA GLU A 55 -1.922 1.710 -8.244 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -4.467 2.803 -7.315 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.603 2.994 -8.828 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -5.432 1.772 -9.535 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -4.285 0.479 -9.242 1.00 0.00 H new ATOM 829 N VAL A 56 -1.043 3.255 -6.419 1.00 0.00 N ATOM 830 CA VAL A 56 -0.432 3.958 -5.291 1.00 0.00 C ATOM 831 C VAL A 56 -0.045 5.364 -5.739 1.00 0.00 C ATOM 832 O VAL A 56 0.729 5.492 -6.684 1.00 0.00 O ATOM 833 CB VAL A 56 0.783 3.183 -4.744 1.00 0.00 C ATOM 834 CG1 VAL A 56 1.225 3.715 -3.373 1.00 0.00 C ATOM 835 CG2 VAL A 56 0.542 1.671 -4.621 1.00 0.00 C ATOM 0 H VAL A 56 -0.579 3.404 -7.315 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.150 4.029 -4.474 1.00 0.00 H new ATOM 0 HB VAL A 56 1.568 3.344 -5.482 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.084 3.144 -3.021 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.500 4.766 -3.462 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.405 3.614 -2.662 1.00 0.00 H new ATOM 0 HG21 VAL A 56 1.439 1.190 -4.230 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.292 1.489 -3.943 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.308 1.259 -5.603 1.00 0.00 H new ATOM 845 N HIS A 57 -0.579 6.388 -5.055 1.00 0.00 N ATOM 846 CA HIS A 57 -0.390 7.822 -5.293 1.00 0.00 C ATOM 847 C HIS A 57 0.273 8.184 -6.628 1.00 0.00 C ATOM 848 O HIS A 57 1.486 8.057 -6.783 1.00 0.00 O ATOM 849 CB HIS A 57 0.363 8.468 -4.127 1.00 0.00 C ATOM 850 CG HIS A 57 1.636 7.778 -3.713 1.00 0.00 C ATOM 851 ND1 HIS A 57 2.426 6.957 -4.495 1.00 0.00 N ATOM 852 CD2 HIS A 57 2.249 7.932 -2.507 1.00 0.00 C ATOM 853 CE1 HIS A 57 3.492 6.592 -3.761 1.00 0.00 C ATOM 854 NE2 HIS A 57 3.405 7.183 -2.554 1.00 0.00 N ATOM 0 H HIS A 57 -1.200 6.219 -4.263 1.00 0.00 H new ATOM 0 HA HIS A 57 -1.399 8.228 -5.361 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.600 9.497 -4.396 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -0.304 8.509 -3.266 1.00 0.00 H new ATOM 0 HD1 HIS A 57 2.235 6.678 -5.457 1.00 0.00 H new ATOM 0 HD2 HIS A 57 1.898 8.525 -1.676 1.00 0.00 H new ATOM 0 HE1 HIS A 57 4.285 5.935 -4.085 1.00 0.00 H new ATOM 863 N ASP A 58 -0.524 8.631 -7.600 1.00 0.00 N ATOM 864 CA ASP A 58 -0.083 9.007 -8.941 1.00 0.00 C ATOM 865 C ASP A 58 0.217 7.810 -9.845 1.00 0.00 C ATOM 866 O ASP A 58 0.021 7.904 -11.053 1.00 0.00 O ATOM 867 CB ASP A 58 1.086 10.005 -8.940 1.00 0.00 C ATOM 868 CG ASP A 58 1.404 10.446 -10.360 1.00 0.00 C ATOM 869 OD1 ASP A 58 2.355 9.946 -10.952 1.00 0.00 O ATOM 870 OD2 ASP A 58 0.591 11.398 -10.885 1.00 0.00 O ATOM 0 H ASP A 58 -1.529 8.745 -7.469 1.00 0.00 H new ATOM 0 HA ASP A 58 -0.943 9.520 -9.371 1.00 0.00 H new ATOM 0 HB2 ASP A 58 0.832 10.872 -8.331 1.00 0.00 H new ATOM 0 HB3 ASP A 58 1.965 9.545 -8.489 1.00 0.00 H new ATOM 876 N LYS A 59 0.697 6.705 -9.277 1.00 0.00 N ATOM 877 CA LYS A 59 1.192 5.562 -10.018 1.00 0.00 C ATOM 878 C LYS A 59 0.437 4.277 -9.678 1.00 0.00 C ATOM 879 O LYS A 59 -0.562 4.271 -8.962 1.00 0.00 O ATOM 880 CB LYS A 59 2.671 5.440 -9.639 1.00 0.00 C ATOM 881 CG LYS A 59 3.512 6.565 -10.250 1.00 0.00 C ATOM 882 CD LYS A 59 3.955 6.271 -11.688 1.00 0.00 C ATOM 883 CE LYS A 59 5.211 5.394 -11.740 1.00 0.00 C ATOM 884 NZ LYS A 59 4.942 3.948 -11.608 1.00 0.00 N ATOM 0 H LYS A 59 0.751 6.584 -8.266 1.00 0.00 H new ATOM 0 HA LYS A 59 1.050 5.706 -11.089 1.00 0.00 H new ATOM 0 HB2 LYS A 59 2.771 5.461 -8.554 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.054 4.477 -9.976 1.00 0.00 H new ATOM 0 HG2 LYS A 59 2.936 7.490 -10.236 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.394 6.729 -9.631 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.145 5.774 -12.221 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.148 7.210 -12.206 1.00 0.00 H new ATOM 0 HE2 LYS A 59 5.727 5.572 -12.684 1.00 0.00 H new ATOM 0 HE3 LYS A 59 5.889 5.701 -10.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.727 3.409 -12.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.852 3.702 -10.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 4.058 3.713 -12.103 1.00 0.00 H new ATOM 898 N LYS A 60 0.937 3.167 -10.222 1.00 0.00 N ATOM 899 CA LYS A 60 0.498 1.814 -9.958 1.00 0.00 C ATOM 900 C LYS A 60 1.772 1.016 -9.725 1.00 0.00 C ATOM 901 O LYS A 60 2.690 1.093 -10.538 1.00 0.00 O ATOM 902 CB LYS A 60 -0.305 1.286 -11.148 1.00 0.00 C ATOM 903 CG LYS A 60 -1.651 2.004 -11.329 1.00 0.00 C ATOM 904 CD LYS A 60 -2.268 1.747 -12.712 1.00 0.00 C ATOM 905 CE LYS A 60 -2.517 0.264 -13.009 1.00 0.00 C ATOM 906 NZ LYS A 60 -3.407 -0.350 -12.011 1.00 0.00 N ATOM 0 H LYS A 60 1.702 3.200 -10.896 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.162 1.744 -9.093 1.00 0.00 H new ATOM 0 HB2 LYS A 60 0.286 1.399 -12.057 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.484 0.219 -11.014 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -2.344 1.671 -10.557 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -1.510 3.076 -11.190 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -3.212 2.287 -12.785 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -1.607 2.156 -13.477 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -2.957 0.161 -14.001 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -1.566 -0.268 -13.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -3.391 -1.384 -12.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -3.083 -0.099 -11.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -4.377 -0.002 -12.150 1.00 0.00 H new ATOM 920 N ASN A 61 1.846 0.330 -8.579 1.00 0.00 N ATOM 921 CA ASN A 61 3.040 -0.378 -8.121 1.00 0.00 C ATOM 922 C ASN A 61 4.319 0.464 -8.321 1.00 0.00 C ATOM 923 O ASN A 61 5.292 -0.018 -8.904 1.00 0.00 O ATOM 924 CB ASN A 61 3.175 -1.728 -8.843 1.00 0.00 C ATOM 925 CG ASN A 61 2.098 -2.772 -8.557 1.00 0.00 C ATOM 926 OD1 ASN A 61 2.428 -3.929 -8.314 1.00 0.00 O ATOM 927 ND2 ASN A 61 0.804 -2.455 -8.629 1.00 0.00 N ATOM 0 H ASN A 61 1.060 0.252 -7.933 1.00 0.00 H new ATOM 0 HA ASN A 61 2.924 -0.555 -7.052 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.189 -1.539 -9.916 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.142 -2.157 -8.582 1.00 0.00 H new ATOM 0 HD21 ASN A 61 0.094 -3.173 -8.482 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.525 -1.495 -8.831 1.00 0.00 H new ATOM 934 N PRO A 62 4.358 1.734 -7.881 1.00 0.00 N ATOM 935 CA PRO A 62 5.559 2.541 -7.986 1.00 0.00 C ATOM 936 C PRO A 62 6.627 2.031 -7.034 1.00 0.00 C ATOM 937 O PRO A 62 6.334 1.387 -6.024 1.00 0.00 O ATOM 938 CB PRO A 62 5.157 3.951 -7.553 1.00 0.00 C ATOM 939 CG PRO A 62 4.016 3.686 -6.571 1.00 0.00 C ATOM 940 CD PRO A 62 3.320 2.468 -7.181 1.00 0.00 C ATOM 0 HA PRO A 62 5.959 2.510 -8.999 1.00 0.00 H new ATOM 0 HB2 PRO A 62 5.984 4.481 -7.080 1.00 0.00 H new ATOM 0 HB3 PRO A 62 4.832 4.557 -8.398 1.00 0.00 H new ATOM 0 HG2 PRO A 62 4.386 3.479 -5.567 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.343 4.540 -6.493 1.00 0.00 H new ATOM 0 HD2 PRO A 62 2.858 1.853 -6.409 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.526 2.771 -7.864 1.00 0.00 H new ATOM 948 N THR A 63 7.873 2.366 -7.349 1.00 0.00 N ATOM 949 CA THR A 63 8.975 2.133 -6.440 1.00 0.00 C ATOM 950 C THR A 63 8.997 3.337 -5.489 1.00 0.00 C ATOM 951 O THR A 63 8.629 4.439 -5.891 1.00 0.00 O ATOM 952 CB THR A 63 10.261 1.950 -7.250 1.00 0.00 C ATOM 953 OG1 THR A 63 10.152 0.761 -8.008 1.00 0.00 O ATOM 954 CG2 THR A 63 11.463 1.833 -6.323 1.00 0.00 C ATOM 0 H THR A 63 8.140 2.801 -8.232 1.00 0.00 H new ATOM 0 HA THR A 63 8.873 1.223 -5.848 1.00 0.00 H new ATOM 0 HB THR A 63 10.399 2.813 -7.901 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.769 0.967 -8.886 1.00 0.00 H new ATOM 0 HG21 THR A 63 12.368 1.703 -6.916 1.00 0.00 H new ATOM 0 HG22 THR A 63 11.549 2.739 -5.723 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.333 0.973 -5.666 1.00 0.00 H new ATOM 962 N LEU A 64 9.364 3.145 -4.224 1.00 0.00 N ATOM 963 CA LEU A 64 9.365 4.205 -3.225 1.00 0.00 C ATOM 964 C LEU A 64 10.797 4.489 -2.784 1.00 0.00 C ATOM 965 O LEU A 64 11.467 3.579 -2.303 1.00 0.00 O ATOM 966 CB LEU A 64 8.513 3.784 -2.019 1.00 0.00 C ATOM 967 CG LEU A 64 7.035 4.185 -2.141 1.00 0.00 C ATOM 968 CD1 LEU A 64 6.336 3.578 -3.361 1.00 0.00 C ATOM 969 CD2 LEU A 64 6.307 3.735 -0.873 1.00 0.00 C ATOM 0 H LEU A 64 9.671 2.242 -3.863 1.00 0.00 H new ATOM 0 HA LEU A 64 8.939 5.111 -3.657 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.579 2.703 -1.898 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.929 4.232 -1.117 1.00 0.00 H new ATOM 0 HG LEU A 64 7.001 5.267 -2.268 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.296 3.903 -3.384 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.839 3.907 -4.270 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.375 2.490 -3.299 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.255 4.011 -0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.393 2.653 -0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 64 6.754 4.220 -0.005 1.00 0.00 H new ATOM 981 N GLU A 65 11.273 5.729 -2.946 1.00 0.00 N ATOM 982 CA GLU A 65 12.557 6.158 -2.389 1.00 0.00 C ATOM 983 C GLU A 65 12.246 6.907 -1.097 1.00 0.00 C ATOM 984 O GLU A 65 11.544 7.918 -1.131 1.00 0.00 O ATOM 985 CB GLU A 65 13.362 7.015 -3.373 1.00 0.00 C ATOM 986 CG GLU A 65 14.275 6.128 -4.225 1.00 0.00 C ATOM 987 CD GLU A 65 15.118 6.906 -5.234 1.00 0.00 C ATOM 988 OE1 GLU A 65 16.308 6.627 -5.329 1.00 0.00 O ATOM 989 OE2 GLU A 65 14.505 7.872 -5.977 1.00 0.00 O ATOM 0 H GLU A 65 10.781 6.458 -3.464 1.00 0.00 H new ATOM 0 HA GLU A 65 13.191 5.294 -2.189 1.00 0.00 H new ATOM 0 HB2 GLU A 65 12.684 7.576 -4.017 1.00 0.00 H new ATOM 0 HB3 GLU A 65 13.959 7.745 -2.826 1.00 0.00 H new ATOM 0 HG2 GLU A 65 14.938 5.566 -3.567 1.00 0.00 H new ATOM 0 HG3 GLU A 65 13.664 5.400 -4.759 1.00 0.00 H new ATOM 997 N ILE A 66 12.750 6.390 0.025 1.00 0.00 N ATOM 998 CA ILE A 66 12.450 6.860 1.367 1.00 0.00 C ATOM 999 C ILE A 66 13.736 7.274 2.089 1.00 0.00 C ATOM 1000 O ILE A 66 14.711 6.520 2.060 1.00 0.00 O ATOM 1001 CB ILE A 66 11.739 5.714 2.112 1.00 0.00 C ATOM 1002 CG1 ILE A 66 10.335 5.526 1.508 1.00 0.00 C ATOM 1003 CG2 ILE A 66 11.685 5.958 3.632 1.00 0.00 C ATOM 1004 CD1 ILE A 66 9.472 4.537 2.294 1.00 0.00 C ATOM 0 H ILE A 66 13.401 5.605 0.017 1.00 0.00 H new ATOM 0 HA ILE A 66 11.806 7.739 1.332 1.00 0.00 H new ATOM 0 HB ILE A 66 12.311 4.795 1.981 1.00 0.00 H new ATOM 0 HG12 ILE A 66 9.829 6.491 1.471 1.00 0.00 H new ATOM 0 HG13 ILE A 66 10.432 5.177 0.480 1.00 0.00 H new ATOM 0 HG21 ILE A 66 11.175 5.125 4.116 1.00 0.00 H new ATOM 0 HG22 ILE A 66 12.699 6.040 4.024 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.143 6.882 3.833 1.00 0.00 H new ATOM 0 HD11 ILE A 66 8.495 4.448 1.818 1.00 0.00 H new ATOM 0 HD12 ILE A 66 9.958 3.562 2.309 1.00 0.00 H new ATOM 0 HD13 ILE A 66 9.347 4.896 3.316 1.00 0.00 H new ATOM 1016 N PRO A 67 13.760 8.442 2.757 1.00 0.00 N ATOM 1017 CA PRO A 67 14.875 8.825 3.600 1.00 0.00 C ATOM 1018 C PRO A 67 14.782 8.025 4.909 1.00 0.00 C ATOM 1019 O PRO A 67 13.792 8.113 5.640 1.00 0.00 O ATOM 1020 CB PRO A 67 14.739 10.335 3.809 1.00 0.00 C ATOM 1021 CG PRO A 67 13.240 10.591 3.671 1.00 0.00 C ATOM 1022 CD PRO A 67 12.760 9.499 2.711 1.00 0.00 C ATOM 0 HA PRO A 67 15.852 8.610 3.167 1.00 0.00 H new ATOM 0 HB2 PRO A 67 15.107 10.637 4.789 1.00 0.00 H new ATOM 0 HB3 PRO A 67 15.310 10.894 3.068 1.00 0.00 H new ATOM 0 HG2 PRO A 67 12.734 10.525 4.634 1.00 0.00 H new ATOM 0 HG3 PRO A 67 13.041 11.586 3.274 1.00 0.00 H new ATOM 0 HD2 PRO A 67 11.782 9.122 3.010 1.00 0.00 H new ATOM 0 HD3 PRO A 67 12.655 9.890 1.699 1.00 0.00 H new ATOM 1030 N ALA A 68 15.797 7.205 5.186 1.00 0.00 N ATOM 1031 CA ALA A 68 15.868 6.376 6.381 1.00 0.00 C ATOM 1032 C ALA A 68 15.602 7.201 7.644 1.00 0.00 C ATOM 1033 O ALA A 68 16.096 8.318 7.780 1.00 0.00 O ATOM 1034 CB ALA A 68 17.235 5.690 6.446 1.00 0.00 C ATOM 0 H ALA A 68 16.605 7.100 4.573 1.00 0.00 H new ATOM 0 HA ALA A 68 15.092 5.612 6.327 1.00 0.00 H new ATOM 0 HB1 ALA A 68 17.288 5.069 7.340 1.00 0.00 H new ATOM 0 HB2 ALA A 68 17.371 5.066 5.563 1.00 0.00 H new ATOM 0 HB3 ALA A 68 18.020 6.445 6.481 1.00 0.00 H new ATOM 1040 N GLY A 69 14.795 6.651 8.557 1.00 0.00 N ATOM 1041 CA GLY A 69 14.359 7.344 9.763 1.00 0.00 C ATOM 1042 C GLY A 69 12.992 8.010 9.584 1.00 0.00 C ATOM 1043 O GLY A 69 12.386 8.428 10.567 1.00 0.00 O ATOM 0 H GLY A 69 14.426 5.704 8.474 1.00 0.00 H new ATOM 0 HA2 GLY A 69 14.311 6.636 10.590 1.00 0.00 H new ATOM 0 HA3 GLY A 69 15.097 8.099 10.033 1.00 0.00 H new ATOM 1047 N ALA A 70 12.492 8.118 8.348 1.00 0.00 N ATOM 1048 CA ALA A 70 11.157 8.639 8.102 1.00 0.00 C ATOM 1049 C ALA A 70 10.064 7.829 8.800 1.00 0.00 C ATOM 1050 O ALA A 70 10.211 6.635 9.048 1.00 0.00 O ATOM 1051 CB ALA A 70 10.883 8.637 6.603 1.00 0.00 C ATOM 0 H ALA A 70 12.999 7.849 7.505 1.00 0.00 H new ATOM 0 HA ALA A 70 11.130 9.650 8.509 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.883 9.027 6.415 1.00 0.00 H new ATOM 0 HB2 ALA A 70 11.618 9.264 6.098 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.952 7.618 6.222 1.00 0.00 H new ATOM 1057 N THR A 71 8.944 8.497 9.077 1.00 0.00 N ATOM 1058 CA THR A 71 7.732 7.884 9.578 1.00 0.00 C ATOM 1059 C THR A 71 6.901 7.553 8.340 1.00 0.00 C ATOM 1060 O THR A 71 6.369 8.451 7.685 1.00 0.00 O ATOM 1061 CB THR A 71 7.016 8.855 10.522 1.00 0.00 C ATOM 1062 OG1 THR A 71 7.864 9.133 11.620 1.00 0.00 O ATOM 1063 CG2 THR A 71 5.713 8.246 11.040 1.00 0.00 C ATOM 0 H THR A 71 8.861 9.506 8.953 1.00 0.00 H new ATOM 0 HA THR A 71 7.919 6.981 10.159 1.00 0.00 H new ATOM 0 HB THR A 71 6.782 9.769 9.977 1.00 0.00 H new ATOM 0 HG1 THR A 71 8.016 8.311 12.132 1.00 0.00 H new ATOM 0 HG21 THR A 71 5.221 8.953 11.708 1.00 0.00 H new ATOM 0 HG22 THR A 71 5.056 8.024 10.199 1.00 0.00 H new ATOM 0 HG23 THR A 71 5.932 7.326 11.582 1.00 0.00 H new ATOM 1071 N VAL A 72 6.847 6.269 7.993 1.00 0.00 N ATOM 1072 CA VAL A 72 6.184 5.771 6.807 1.00 0.00 C ATOM 1073 C VAL A 72 4.722 5.502 7.156 1.00 0.00 C ATOM 1074 O VAL A 72 4.373 4.437 7.664 1.00 0.00 O ATOM 1075 CB VAL A 72 6.932 4.539 6.269 1.00 0.00 C ATOM 1076 CG1 VAL A 72 6.308 4.069 4.950 1.00 0.00 C ATOM 1077 CG2 VAL A 72 8.395 4.905 5.984 1.00 0.00 C ATOM 0 H VAL A 72 7.278 5.531 8.550 1.00 0.00 H new ATOM 0 HA VAL A 72 6.199 6.503 5.999 1.00 0.00 H new ATOM 0 HB VAL A 72 6.867 3.750 7.019 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.848 3.197 4.582 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.263 3.806 5.115 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.368 4.870 4.213 1.00 0.00 H new ATOM 0 HG21 VAL A 72 8.921 4.030 5.603 1.00 0.00 H new ATOM 0 HG22 VAL A 72 8.433 5.703 5.242 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.871 5.243 6.904 1.00 0.00 H new ATOM 1087 N ASP A 73 3.866 6.494 6.903 1.00 0.00 N ATOM 1088 CA ASP A 73 2.429 6.356 7.043 1.00 0.00 C ATOM 1089 C ASP A 73 1.910 5.668 5.793 1.00 0.00 C ATOM 1090 O ASP A 73 1.654 6.324 4.783 1.00 0.00 O ATOM 1091 CB ASP A 73 1.748 7.712 7.275 1.00 0.00 C ATOM 1092 CG ASP A 73 1.639 7.998 8.761 1.00 0.00 C ATOM 1093 OD1 ASP A 73 2.505 8.655 9.328 1.00 0.00 O ATOM 1094 OD2 ASP A 73 0.550 7.452 9.364 1.00 0.00 O ATOM 0 H ASP A 73 4.161 7.420 6.593 1.00 0.00 H new ATOM 0 HA ASP A 73 2.194 5.755 7.922 1.00 0.00 H new ATOM 0 HB2 ASP A 73 2.319 8.502 6.786 1.00 0.00 H new ATOM 0 HB3 ASP A 73 0.756 7.710 6.824 1.00 0.00 H new ATOM 1100 N VAL A 74 1.766 4.345 5.865 1.00 0.00 N ATOM 1101 CA VAL A 74 1.167 3.586 4.789 1.00 0.00 C ATOM 1102 C VAL A 74 -0.341 3.763 4.939 1.00 0.00 C ATOM 1103 O VAL A 74 -0.992 3.083 5.732 1.00 0.00 O ATOM 1104 CB VAL A 74 1.632 2.125 4.811 1.00 0.00 C ATOM 1105 CG1 VAL A 74 1.105 1.397 3.567 1.00 0.00 C ATOM 1106 CG2 VAL A 74 3.162 2.033 4.831 1.00 0.00 C ATOM 0 H VAL A 74 2.060 3.783 6.664 1.00 0.00 H new ATOM 0 HA VAL A 74 1.478 3.944 3.807 1.00 0.00 H new ATOM 0 HB VAL A 74 1.241 1.659 5.715 1.00 0.00 H new ATOM 0 HG11 VAL A 74 1.437 0.359 3.585 1.00 0.00 H new ATOM 0 HG12 VAL A 74 0.016 1.430 3.561 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.488 1.885 2.671 1.00 0.00 H new ATOM 0 HG21 VAL A 74 3.463 0.986 4.846 1.00 0.00 H new ATOM 0 HG22 VAL A 74 3.567 2.514 3.941 1.00 0.00 H new ATOM 0 HG23 VAL A 74 3.545 2.534 5.720 1.00 0.00 H new ATOM 1116 N THR A 75 -0.864 4.743 4.207 1.00 0.00 N ATOM 1117 CA THR A 75 -2.258 5.118 4.159 1.00 0.00 C ATOM 1118 C THR A 75 -2.956 4.255 3.116 1.00 0.00 C ATOM 1119 O THR A 75 -2.941 4.567 1.926 1.00 0.00 O ATOM 1120 CB THR A 75 -2.349 6.615 3.838 1.00 0.00 C ATOM 1121 OG1 THR A 75 -1.691 7.339 4.857 1.00 0.00 O ATOM 1122 CG2 THR A 75 -3.792 7.111 3.732 1.00 0.00 C ATOM 0 H THR A 75 -0.286 5.324 3.600 1.00 0.00 H new ATOM 0 HA THR A 75 -2.755 4.952 5.115 1.00 0.00 H new ATOM 0 HB THR A 75 -1.878 6.772 2.868 1.00 0.00 H new ATOM 0 HG1 THR A 75 -1.961 8.280 4.816 1.00 0.00 H new ATOM 0 HG21 THR A 75 -3.795 8.177 3.503 1.00 0.00 H new ATOM 0 HG22 THR A 75 -4.306 6.568 2.938 1.00 0.00 H new ATOM 0 HG23 THR A 75 -4.305 6.942 4.678 1.00 0.00 H new ATOM 1130 N PHE A 76 -3.602 3.180 3.558 1.00 0.00 N ATOM 1131 CA PHE A 76 -4.413 2.383 2.659 1.00 0.00 C ATOM 1132 C PHE A 76 -5.746 3.045 2.375 1.00 0.00 C ATOM 1133 O PHE A 76 -6.256 3.814 3.180 1.00 0.00 O ATOM 1134 CB PHE A 76 -4.809 1.031 3.284 1.00 0.00 C ATOM 1135 CG PHE A 76 -3.967 -0.195 3.007 1.00 0.00 C ATOM 1136 CD1 PHE A 76 -3.804 -0.532 1.649 1.00 0.00 C ATOM 1137 CD2 PHE A 76 -4.044 -1.240 3.951 1.00 0.00 C ATOM 1138 CE1 PHE A 76 -3.994 -1.853 1.220 1.00 0.00 C ATOM 1139 CE2 PHE A 76 -4.198 -2.572 3.524 1.00 0.00 C ATOM 1140 CZ PHE A 76 -4.253 -2.868 2.152 1.00 0.00 C ATOM 0 H PHE A 76 -3.578 2.848 4.522 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.798 2.266 1.766 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.840 1.168 4.365 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.826 0.808 2.962 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -3.531 0.231 0.935 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -3.985 -1.017 5.006 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.941 -2.090 0.168 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -4.274 -3.367 4.251 1.00 0.00 H new ATOM 0 HZ PHE A 76 -4.492 -3.867 1.818 1.00 0.00 H new ATOM 1150 N ILE A 77 -6.302 2.649 1.235 1.00 0.00 N ATOM 1151 CA ILE A 77 -7.674 2.824 0.823 1.00 0.00 C ATOM 1152 C ILE A 77 -7.944 1.480 0.141 1.00 0.00 C ATOM 1153 O ILE A 77 -7.697 1.335 -1.056 1.00 0.00 O ATOM 1154 CB ILE A 77 -7.940 4.047 -0.077 1.00 0.00 C ATOM 1155 CG1 ILE A 77 -7.806 5.375 0.693 1.00 0.00 C ATOM 1156 CG2 ILE A 77 -9.396 3.979 -0.556 1.00 0.00 C ATOM 1157 CD1 ILE A 77 -6.455 6.042 0.436 1.00 0.00 C ATOM 0 H ILE A 77 -5.755 2.160 0.526 1.00 0.00 H new ATOM 0 HA ILE A 77 -8.344 3.053 1.651 1.00 0.00 H new ATOM 0 HB ILE A 77 -7.214 4.022 -0.889 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -8.608 6.051 0.396 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -7.924 5.190 1.761 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -9.609 4.835 -1.196 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -9.551 3.058 -1.118 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -10.064 3.995 0.306 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -6.398 6.976 0.996 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -5.654 5.377 0.757 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -6.349 6.250 -0.629 1.00 0.00 H new ATOM 1169 N ASN A 78 -8.343 0.464 0.911 1.00 0.00 N ATOM 1170 CA ASN A 78 -8.757 -0.816 0.347 1.00 0.00 C ATOM 1171 C ASN A 78 -10.271 -0.853 0.459 1.00 0.00 C ATOM 1172 O ASN A 78 -10.827 -0.813 1.552 1.00 0.00 O ATOM 1173 CB ASN A 78 -8.070 -2.044 0.980 1.00 0.00 C ATOM 1174 CG ASN A 78 -8.792 -3.323 0.534 1.00 0.00 C ATOM 1175 OD1 ASN A 78 -9.424 -3.352 -0.521 1.00 0.00 O ATOM 1176 ND2 ASN A 78 -8.729 -4.392 1.320 1.00 0.00 N ATOM 0 H ASN A 78 -8.387 0.507 1.929 1.00 0.00 H new ATOM 0 HA ASN A 78 -8.437 -0.884 -0.693 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -7.023 -2.082 0.681 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -8.088 -1.964 2.067 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -9.208 -5.251 1.052 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -8.201 -4.353 2.192 1.00 0.00 H new ATOM 1183 N THR A 79 -10.956 -0.843 -0.681 1.00 0.00 N ATOM 1184 CA THR A 79 -12.407 -0.910 -0.759 1.00 0.00 C ATOM 1185 C THR A 79 -12.764 -1.753 -1.986 1.00 0.00 C ATOM 1186 O THR A 79 -13.742 -1.502 -2.686 1.00 0.00 O ATOM 1187 CB THR A 79 -12.972 0.524 -0.714 1.00 0.00 C ATOM 1188 OG1 THR A 79 -12.547 1.116 0.500 1.00 0.00 O ATOM 1189 CG2 THR A 79 -14.499 0.631 -0.753 1.00 0.00 C ATOM 0 H THR A 79 -10.505 -0.787 -1.594 1.00 0.00 H new ATOM 0 HA THR A 79 -12.876 -1.411 0.088 1.00 0.00 H new ATOM 0 HB THR A 79 -12.602 1.019 -1.612 1.00 0.00 H new ATOM 0 HG1 THR A 79 -12.149 1.992 0.315 1.00 0.00 H new ATOM 0 HG21 THR A 79 -14.791 1.680 -0.717 1.00 0.00 H new ATOM 0 HG22 THR A 79 -14.872 0.182 -1.674 1.00 0.00 H new ATOM 0 HG23 THR A 79 -14.922 0.107 0.104 1.00 0.00 H new ATOM 1197 N ASN A 80 -11.973 -2.801 -2.238 1.00 0.00 N ATOM 1198 CA ASN A 80 -12.249 -3.741 -3.315 1.00 0.00 C ATOM 1199 C ASN A 80 -13.339 -4.718 -2.869 1.00 0.00 C ATOM 1200 O ASN A 80 -13.082 -5.905 -2.691 1.00 0.00 O ATOM 1201 CB ASN A 80 -10.958 -4.462 -3.704 1.00 0.00 C ATOM 1202 CG ASN A 80 -11.149 -5.336 -4.938 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -10.901 -6.535 -4.889 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -11.522 -4.741 -6.065 1.00 0.00 N ATOM 0 H ASN A 80 -11.132 -3.015 -1.703 1.00 0.00 H new ATOM 0 HA ASN A 80 -12.614 -3.214 -4.197 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -10.175 -3.728 -3.896 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.620 -5.078 -2.871 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -11.609 -5.284 -6.924 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -11.721 -3.741 -6.072 1.00 0.00 H new ATOM 1211 N LYS A 81 -14.542 -4.180 -2.647 1.00 0.00 N ATOM 1212 CA LYS A 81 -15.772 -4.848 -2.237 1.00 0.00 C ATOM 1213 C LYS A 81 -15.572 -6.249 -1.634 1.00 0.00 C ATOM 1214 O LYS A 81 -15.778 -7.255 -2.308 1.00 0.00 O ATOM 1215 CB LYS A 81 -16.746 -4.891 -3.424 1.00 0.00 C ATOM 1216 CG LYS A 81 -16.947 -3.511 -4.064 1.00 0.00 C ATOM 1217 CD LYS A 81 -18.126 -3.569 -5.043 1.00 0.00 C ATOM 1218 CE LYS A 81 -18.252 -2.284 -5.869 1.00 0.00 C ATOM 1219 NZ LYS A 81 -18.411 -1.095 -5.013 1.00 0.00 N ATOM 0 H LYS A 81 -14.688 -3.177 -2.761 1.00 0.00 H new ATOM 0 HA LYS A 81 -16.190 -4.256 -1.422 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -16.369 -5.586 -4.175 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -17.708 -5.276 -3.087 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -17.137 -2.765 -3.293 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -16.041 -3.205 -4.587 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -17.999 -4.419 -5.713 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -19.050 -3.735 -4.488 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -17.367 -2.166 -6.494 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -19.107 -2.366 -6.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -18.645 -0.271 -5.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -19.177 -1.260 -4.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -17.524 -0.914 -4.502 1.00 0.00 H new ATOM 1233 N GLY A 82 -15.214 -6.322 -0.350 1.00 0.00 N ATOM 1234 CA GLY A 82 -15.074 -7.586 0.367 1.00 0.00 C ATOM 1235 C GLY A 82 -13.641 -8.126 0.398 1.00 0.00 C ATOM 1236 O GLY A 82 -13.265 -8.797 1.358 1.00 0.00 O ATOM 0 H GLY A 82 -15.013 -5.501 0.221 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -15.424 -7.453 1.391 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -15.722 -8.329 -0.097 1.00 0.00 H new ATOM 1240 N PHE A 83 -12.816 -7.848 -0.616 1.00 0.00 N ATOM 1241 CA PHE A 83 -11.479 -8.426 -0.691 1.00 0.00 C ATOM 1242 C PHE A 83 -10.534 -7.677 0.250 1.00 0.00 C ATOM 1243 O PHE A 83 -10.018 -6.609 -0.079 1.00 0.00 O ATOM 1244 CB PHE A 83 -10.959 -8.414 -2.133 1.00 0.00 C ATOM 1245 CG PHE A 83 -11.613 -9.452 -3.027 1.00 0.00 C ATOM 1246 CD1 PHE A 83 -12.896 -9.223 -3.562 1.00 0.00 C ATOM 1247 CD2 PHE A 83 -10.980 -10.691 -3.246 1.00 0.00 C ATOM 1248 CE1 PHE A 83 -13.552 -10.235 -4.282 1.00 0.00 C ATOM 1249 CE2 PHE A 83 -11.627 -11.694 -3.989 1.00 0.00 C ATOM 1250 CZ PHE A 83 -12.917 -11.470 -4.499 1.00 0.00 C ATOM 0 H PHE A 83 -13.053 -7.229 -1.391 1.00 0.00 H new ATOM 0 HA PHE A 83 -11.526 -9.467 -0.372 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -11.122 -7.425 -2.560 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -9.882 -8.583 -2.123 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -13.377 -8.267 -3.418 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -9.995 -10.871 -2.842 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -14.546 -10.064 -4.669 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -11.132 -12.637 -4.168 1.00 0.00 H new ATOM 0 HZ PHE A 83 -13.420 -12.246 -5.057 1.00 0.00 H new ATOM 1260 N GLY A 84 -10.299 -8.245 1.436 1.00 0.00 N ATOM 1261 CA GLY A 84 -9.369 -7.731 2.436 1.00 0.00 C ATOM 1262 C GLY A 84 -7.929 -7.915 1.974 1.00 0.00 C ATOM 1263 O GLY A 84 -7.170 -8.607 2.639 1.00 0.00 O ATOM 0 H GLY A 84 -10.767 -9.101 1.732 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.567 -6.674 2.615 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.522 -8.249 3.383 1.00 0.00 H new ATOM 1267 N HIS A 85 -7.551 -7.303 0.845 1.00 0.00 N ATOM 1268 CA HIS A 85 -6.279 -7.471 0.165 1.00 0.00 C ATOM 1269 C HIS A 85 -5.082 -7.718 1.071 1.00 0.00 C ATOM 1270 O HIS A 85 -4.369 -8.684 0.824 1.00 0.00 O ATOM 1271 CB HIS A 85 -6.022 -6.310 -0.802 1.00 0.00 C ATOM 1272 CG HIS A 85 -6.732 -6.523 -2.112 1.00 0.00 C ATOM 1273 ND1 HIS A 85 -6.328 -7.375 -3.145 1.00 0.00 N ATOM 1274 CD2 HIS A 85 -7.942 -5.979 -2.434 1.00 0.00 C ATOM 1275 CE1 HIS A 85 -7.292 -7.301 -4.070 1.00 0.00 C ATOM 1276 NE2 HIS A 85 -8.278 -6.490 -3.665 1.00 0.00 N ATOM 0 H HIS A 85 -8.163 -6.644 0.363 1.00 0.00 H new ATOM 0 HA HIS A 85 -6.381 -8.398 -0.399 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -6.359 -5.377 -0.351 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -4.951 -6.211 -0.978 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -8.520 -5.286 -1.840 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -7.277 -7.824 -5.015 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -9.133 -6.286 -4.182 1.00 0.00 H new ATOM 1284 N SER A 86 -4.871 -6.863 2.074 1.00 0.00 N ATOM 1285 CA SER A 86 -3.703 -6.842 2.949 1.00 0.00 C ATOM 1286 C SER A 86 -2.544 -6.174 2.206 1.00 0.00 C ATOM 1287 O SER A 86 -2.329 -6.438 1.023 1.00 0.00 O ATOM 1288 CB SER A 86 -3.320 -8.223 3.532 1.00 0.00 C ATOM 1289 OG SER A 86 -2.572 -9.052 2.664 1.00 0.00 O ATOM 0 H SER A 86 -5.544 -6.133 2.307 1.00 0.00 H new ATOM 0 HA SER A 86 -3.958 -6.256 3.832 1.00 0.00 H new ATOM 0 HB2 SER A 86 -2.746 -8.068 4.446 1.00 0.00 H new ATOM 0 HB3 SER A 86 -4.233 -8.748 3.814 1.00 0.00 H new ATOM 0 HG SER A 86 -2.911 -8.958 1.749 1.00 0.00 H new ATOM 1295 N PHE A 87 -1.843 -5.260 2.878 1.00 0.00 N ATOM 1296 CA PHE A 87 -0.627 -4.644 2.373 1.00 0.00 C ATOM 1297 C PHE A 87 0.450 -5.139 3.329 1.00 0.00 C ATOM 1298 O PHE A 87 0.418 -4.762 4.502 1.00 0.00 O ATOM 1299 CB PHE A 87 -0.742 -3.115 2.406 1.00 0.00 C ATOM 1300 CG PHE A 87 0.267 -2.366 1.556 1.00 0.00 C ATOM 1301 CD1 PHE A 87 1.579 -2.170 2.020 1.00 0.00 C ATOM 1302 CD2 PHE A 87 -0.137 -1.772 0.344 1.00 0.00 C ATOM 1303 CE1 PHE A 87 2.447 -1.302 1.335 1.00 0.00 C ATOM 1304 CE2 PHE A 87 0.763 -0.980 -0.390 1.00 0.00 C ATOM 1305 CZ PHE A 87 2.044 -0.715 0.123 1.00 0.00 C ATOM 0 H PHE A 87 -2.113 -4.925 3.803 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.414 -4.902 1.336 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -1.744 -2.836 2.080 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -0.639 -2.782 3.439 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.921 -2.687 2.904 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -1.141 -1.926 -0.022 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.424 -1.086 1.740 1.00 0.00 H new ATOM 0 HE2 PHE A 87 0.470 -0.575 -1.348 1.00 0.00 H new ATOM 0 HZ PHE A 87 2.717 -0.062 -0.413 1.00 0.00 H new ATOM 1315 N ASP A 88 1.330 -6.032 2.878 1.00 0.00 N ATOM 1316 CA ASP A 88 2.333 -6.691 3.709 1.00 0.00 C ATOM 1317 C ASP A 88 3.706 -6.185 3.283 1.00 0.00 C ATOM 1318 O ASP A 88 3.933 -6.023 2.086 1.00 0.00 O ATOM 1319 CB ASP A 88 2.223 -8.209 3.532 1.00 0.00 C ATOM 1320 CG ASP A 88 0.787 -8.685 3.681 1.00 0.00 C ATOM 1321 OD1 ASP A 88 0.300 -8.795 4.799 1.00 0.00 O ATOM 1322 OD2 ASP A 88 0.115 -8.940 2.529 1.00 0.00 O ATOM 0 H ASP A 88 1.365 -6.323 1.901 1.00 0.00 H new ATOM 0 HA ASP A 88 2.178 -6.464 4.764 1.00 0.00 H new ATOM 0 HB2 ASP A 88 2.600 -8.490 2.549 1.00 0.00 H new ATOM 0 HB3 ASP A 88 2.851 -8.709 4.269 1.00 0.00 H new ATOM 1328 N ILE A 89 4.606 -5.923 4.236 1.00 0.00 N ATOM 1329 CA ILE A 89 5.900 -5.309 3.972 1.00 0.00 C ATOM 1330 C ILE A 89 7.030 -6.189 4.518 1.00 0.00 C ATOM 1331 O ILE A 89 6.969 -6.707 5.635 1.00 0.00 O ATOM 1332 CB ILE A 89 5.921 -3.876 4.534 1.00 0.00 C ATOM 1333 CG1 ILE A 89 4.731 -3.070 3.978 1.00 0.00 C ATOM 1334 CG2 ILE A 89 7.252 -3.203 4.187 1.00 0.00 C ATOM 1335 CD1 ILE A 89 4.715 -1.608 4.430 1.00 0.00 C ATOM 0 H ILE A 89 4.450 -6.136 5.221 1.00 0.00 H new ATOM 0 HA ILE A 89 6.064 -5.232 2.897 1.00 0.00 H new ATOM 0 HB ILE A 89 5.826 -3.912 5.619 1.00 0.00 H new ATOM 0 HG12 ILE A 89 4.757 -3.104 2.889 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.802 -3.548 4.290 1.00 0.00 H new ATOM 0 HG21 ILE A 89 7.262 -2.189 4.587 1.00 0.00 H new ATOM 0 HG22 ILE A 89 8.072 -3.773 4.623 1.00 0.00 H new ATOM 0 HG23 ILE A 89 7.370 -3.167 3.104 1.00 0.00 H new ATOM 0 HD11 ILE A 89 3.850 -1.104 4.000 1.00 0.00 H new ATOM 0 HD12 ILE A 89 4.657 -1.564 5.518 1.00 0.00 H new ATOM 0 HD13 ILE A 89 5.627 -1.114 4.095 1.00 0.00 H new ATOM 1347 N THR A 90 8.068 -6.380 3.705 1.00 0.00 N ATOM 1348 CA THR A 90 9.184 -7.262 4.001 1.00 0.00 C ATOM 1349 C THR A 90 10.356 -6.844 3.112 1.00 0.00 C ATOM 1350 O THR A 90 10.346 -5.731 2.594 1.00 0.00 O ATOM 1351 CB THR A 90 8.726 -8.729 3.863 1.00 0.00 C ATOM 1352 OG1 THR A 90 9.815 -9.627 3.979 1.00 0.00 O ATOM 1353 CG2 THR A 90 7.969 -9.036 2.562 1.00 0.00 C ATOM 0 H THR A 90 8.153 -5.913 2.802 1.00 0.00 H new ATOM 0 HA THR A 90 9.535 -7.179 5.030 1.00 0.00 H new ATOM 0 HB THR A 90 8.027 -8.872 4.687 1.00 0.00 H new ATOM 0 HG1 THR A 90 9.731 -10.137 4.812 1.00 0.00 H new ATOM 0 HG21 THR A 90 7.684 -10.088 2.546 1.00 0.00 H new ATOM 0 HG22 THR A 90 7.074 -8.417 2.507 1.00 0.00 H new ATOM 0 HG23 THR A 90 8.611 -8.822 1.708 1.00 0.00 H new ATOM 1361 N LYS A 91 11.370 -7.695 2.945 1.00 0.00 N ATOM 1362 CA LYS A 91 12.525 -7.426 2.092 1.00 0.00 C ATOM 1363 C LYS A 91 12.676 -8.480 0.990 1.00 0.00 C ATOM 1364 O LYS A 91 13.652 -8.455 0.241 1.00 0.00 O ATOM 1365 CB LYS A 91 13.800 -7.312 2.941 1.00 0.00 C ATOM 1366 CG LYS A 91 13.619 -6.307 4.087 1.00 0.00 C ATOM 1367 CD LYS A 91 14.943 -5.882 4.736 1.00 0.00 C ATOM 1368 CE LYS A 91 15.784 -4.995 3.806 1.00 0.00 C ATOM 1369 NZ LYS A 91 16.860 -4.313 4.547 1.00 0.00 N ATOM 0 H LYS A 91 11.411 -8.604 3.406 1.00 0.00 H new ATOM 0 HA LYS A 91 12.360 -6.471 1.592 1.00 0.00 H new ATOM 0 HB2 LYS A 91 14.056 -8.290 3.349 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.633 -7.001 2.310 1.00 0.00 H new ATOM 0 HG2 LYS A 91 13.108 -5.422 3.708 1.00 0.00 H new ATOM 0 HG3 LYS A 91 12.974 -6.746 4.848 1.00 0.00 H new ATOM 0 HD2 LYS A 91 14.736 -5.343 5.661 1.00 0.00 H new ATOM 0 HD3 LYS A 91 15.516 -6.770 5.005 1.00 0.00 H new ATOM 0 HE2 LYS A 91 16.216 -5.604 3.011 1.00 0.00 H new ATOM 0 HE3 LYS A 91 15.143 -4.255 3.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 16.714 -3.284 4.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 16.848 -4.622 5.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 17.779 -4.550 4.122 1.00 0.00 H new ATOM 1383 N LYS A 92 11.718 -9.402 0.869 1.00 0.00 N ATOM 1384 CA LYS A 92 11.713 -10.370 -0.214 1.00 0.00 C ATOM 1385 C LYS A 92 11.358 -9.647 -1.518 1.00 0.00 C ATOM 1386 O LYS A 92 10.392 -8.887 -1.554 1.00 0.00 O ATOM 1387 CB LYS A 92 10.732 -11.502 0.119 1.00 0.00 C ATOM 1388 CG LYS A 92 11.235 -12.277 1.347 1.00 0.00 C ATOM 1389 CD LYS A 92 10.355 -13.489 1.683 1.00 0.00 C ATOM 1390 CE LYS A 92 8.985 -13.115 2.260 1.00 0.00 C ATOM 1391 NZ LYS A 92 9.090 -12.348 3.512 1.00 0.00 N ATOM 0 H LYS A 92 10.934 -9.493 1.515 1.00 0.00 H new ATOM 0 HA LYS A 92 12.696 -10.824 -0.341 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.741 -11.092 0.316 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.635 -12.175 -0.733 1.00 0.00 H new ATOM 0 HG2 LYS A 92 12.256 -12.613 1.166 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.267 -11.607 2.206 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.209 -14.082 0.780 1.00 0.00 H new ATOM 0 HD3 LYS A 92 10.881 -14.121 2.399 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.432 -12.530 1.525 1.00 0.00 H new ATOM 0 HE3 LYS A 92 8.411 -14.023 2.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.210 -12.450 4.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.888 -12.707 4.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.246 -11.344 3.292 1.00 0.00 H new ATOM 1405 N GLY A 93 12.152 -9.854 -2.573 1.00 0.00 N ATOM 1406 CA GLY A 93 11.995 -9.181 -3.856 1.00 0.00 C ATOM 1407 C GLY A 93 11.217 -10.032 -4.863 1.00 0.00 C ATOM 1408 O GLY A 93 10.980 -11.213 -4.617 1.00 0.00 O ATOM 0 H GLY A 93 12.935 -10.507 -2.554 1.00 0.00 H new ATOM 0 HA2 GLY A 93 11.477 -8.234 -3.707 1.00 0.00 H new ATOM 0 HA3 GLY A 93 12.978 -8.946 -4.264 1.00 0.00 H new ATOM 1412 N PRO A 94 10.815 -9.441 -5.999 1.00 0.00 N ATOM 1413 CA PRO A 94 10.168 -10.154 -7.090 1.00 0.00 C ATOM 1414 C PRO A 94 11.199 -11.030 -7.820 1.00 0.00 C ATOM 1415 O PRO A 94 12.400 -10.816 -7.646 1.00 0.00 O ATOM 1416 CB PRO A 94 9.633 -9.048 -8.011 1.00 0.00 C ATOM 1417 CG PRO A 94 10.642 -7.917 -7.818 1.00 0.00 C ATOM 1418 CD PRO A 94 11.019 -8.045 -6.343 1.00 0.00 C ATOM 0 HA PRO A 94 9.372 -10.818 -6.753 1.00 0.00 H new ATOM 0 HB2 PRO A 94 9.588 -9.375 -9.050 1.00 0.00 H new ATOM 0 HB3 PRO A 94 8.625 -8.742 -7.730 1.00 0.00 H new ATOM 0 HG2 PRO A 94 11.509 -8.034 -8.468 1.00 0.00 H new ATOM 0 HG3 PRO A 94 10.205 -6.943 -8.040 1.00 0.00 H new ATOM 0 HD2 PRO A 94 12.055 -7.750 -6.178 1.00 0.00 H new ATOM 0 HD3 PRO A 94 10.400 -7.396 -5.724 1.00 0.00 H new ATOM 1426 N PRO A 95 10.776 -11.966 -8.688 1.00 0.00 N ATOM 1427 CA PRO A 95 9.398 -12.357 -8.964 1.00 0.00 C ATOM 1428 C PRO A 95 8.773 -13.065 -7.763 1.00 0.00 C ATOM 1429 O PRO A 95 9.370 -13.988 -7.211 1.00 0.00 O ATOM 1430 CB PRO A 95 9.468 -13.308 -10.169 1.00 0.00 C ATOM 1431 CG PRO A 95 10.825 -13.006 -10.805 1.00 0.00 C ATOM 1432 CD PRO A 95 11.678 -12.657 -9.589 1.00 0.00 C ATOM 0 HA PRO A 95 8.776 -11.486 -9.169 1.00 0.00 H new ATOM 0 HB2 PRO A 95 9.397 -14.350 -9.859 1.00 0.00 H new ATOM 0 HB3 PRO A 95 8.651 -13.127 -10.868 1.00 0.00 H new ATOM 0 HG2 PRO A 95 11.221 -13.865 -11.348 1.00 0.00 H new ATOM 0 HG3 PRO A 95 10.768 -12.180 -11.514 1.00 0.00 H new ATOM 0 HD2 PRO A 95 12.090 -13.553 -9.125 1.00 0.00 H new ATOM 0 HD3 PRO A 95 12.521 -12.024 -9.866 1.00 0.00 H new ATOM 1440 N TYR A 96 7.575 -12.646 -7.355 1.00 0.00 N ATOM 1441 CA TYR A 96 6.858 -13.318 -6.283 1.00 0.00 C ATOM 1442 C TYR A 96 6.177 -14.565 -6.829 1.00 0.00 C ATOM 1443 O TYR A 96 5.776 -14.614 -7.992 1.00 0.00 O ATOM 1444 CB TYR A 96 5.858 -12.371 -5.627 1.00 0.00 C ATOM 1445 CG TYR A 96 6.525 -11.155 -5.023 1.00 0.00 C ATOM 1446 CD1 TYR A 96 7.319 -11.317 -3.874 1.00 0.00 C ATOM 1447 CD2 TYR A 96 6.505 -9.916 -5.692 1.00 0.00 C ATOM 1448 CE1 TYR A 96 8.090 -10.250 -3.393 1.00 0.00 C ATOM 1449 CE2 TYR A 96 7.285 -8.851 -5.211 1.00 0.00 C ATOM 1450 CZ TYR A 96 8.074 -9.015 -4.062 1.00 0.00 C ATOM 1451 OH TYR A 96 8.833 -7.978 -3.617 1.00 0.00 O ATOM 0 H TYR A 96 7.085 -11.845 -7.753 1.00 0.00 H new ATOM 0 HA TYR A 96 7.565 -13.623 -5.511 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.126 -12.050 -6.368 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.311 -12.906 -4.850 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.335 -12.267 -3.360 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.892 -9.785 -6.572 1.00 0.00 H new ATOM 0 HE1 TYR A 96 8.696 -10.377 -2.508 1.00 0.00 H new ATOM 0 HE2 TYR A 96 7.277 -7.903 -5.727 1.00 0.00 H new ATOM 0 HH TYR A 96 9.337 -8.258 -2.825 1.00 0.00 H new ATOM 1461 N ALA A 97 6.053 -15.577 -5.976 1.00 0.00 N ATOM 1462 CA ALA A 97 5.410 -16.828 -6.329 1.00 0.00 C ATOM 1463 C ALA A 97 3.899 -16.675 -6.194 1.00 0.00 C ATOM 1464 O ALA A 97 3.410 -15.822 -5.455 1.00 0.00 O ATOM 1465 CB ALA A 97 5.937 -17.953 -5.435 1.00 0.00 C ATOM 0 H ALA A 97 6.399 -15.547 -5.017 1.00 0.00 H new ATOM 0 HA ALA A 97 5.639 -17.085 -7.363 1.00 0.00 H new ATOM 0 HB1 ALA A 97 5.450 -18.890 -5.705 1.00 0.00 H new ATOM 0 HB2 ALA A 97 7.014 -18.051 -5.571 1.00 0.00 H new ATOM 0 HB3 ALA A 97 5.722 -17.720 -4.392 1.00 0.00 H new ATOM 1471 N VAL A 98 3.154 -17.519 -6.911 1.00 0.00 N ATOM 1472 CA VAL A 98 1.705 -17.564 -6.798 1.00 0.00 C ATOM 1473 C VAL A 98 1.318 -17.941 -5.364 1.00 0.00 C ATOM 1474 O VAL A 98 0.334 -17.426 -4.838 1.00 0.00 O ATOM 1475 CB VAL A 98 1.126 -18.513 -7.859 1.00 0.00 C ATOM 1476 CG1 VAL A 98 -0.387 -18.715 -7.692 1.00 0.00 C ATOM 1477 CG2 VAL A 98 1.397 -17.964 -9.267 1.00 0.00 C ATOM 0 H VAL A 98 3.540 -18.184 -7.581 1.00 0.00 H new ATOM 0 HA VAL A 98 1.272 -16.583 -6.995 1.00 0.00 H new ATOM 0 HB VAL A 98 1.619 -19.476 -7.724 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -0.751 -19.393 -8.464 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -0.591 -19.141 -6.710 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -0.895 -17.755 -7.784 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.982 -18.646 -10.009 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.930 -16.985 -9.372 1.00 0.00 H new ATOM 0 HG23 VAL A 98 2.472 -17.871 -9.421 1.00 0.00 H new ATOM 1487 N MET A 99 2.109 -18.799 -4.712 1.00 0.00 N ATOM 1488 CA MET A 99 1.910 -19.117 -3.308 1.00 0.00 C ATOM 1489 C MET A 99 2.480 -17.945 -2.499 1.00 0.00 C ATOM 1490 O MET A 99 3.617 -17.544 -2.749 1.00 0.00 O ATOM 1491 CB MET A 99 2.621 -20.427 -2.961 1.00 0.00 C ATOM 1492 CG MET A 99 2.011 -21.608 -3.727 1.00 0.00 C ATOM 1493 SD MET A 99 2.555 -23.246 -3.184 1.00 0.00 S ATOM 1494 CE MET A 99 4.338 -23.032 -3.331 1.00 0.00 C ATOM 0 H MET A 99 2.895 -19.284 -5.144 1.00 0.00 H new ATOM 0 HA MET A 99 0.854 -19.255 -3.078 1.00 0.00 H new ATOM 0 HB2 MET A 99 3.681 -20.343 -3.200 1.00 0.00 H new ATOM 0 HB3 MET A 99 2.550 -20.610 -1.889 1.00 0.00 H new ATOM 0 HG2 MET A 99 0.926 -21.556 -3.638 1.00 0.00 H new ATOM 0 HG3 MET A 99 2.250 -21.496 -4.785 1.00 0.00 H new ATOM 0 HE1 MET A 99 4.830 -23.999 -3.225 1.00 0.00 H new ATOM 0 HE2 MET A 99 4.574 -22.609 -4.307 1.00 0.00 H new ATOM 0 HE3 MET A 99 4.689 -22.358 -2.549 1.00 0.00 H new ATOM 1504 N PRO A 100 1.716 -17.363 -1.562 1.00 0.00 N ATOM 1505 CA PRO A 100 2.130 -16.169 -0.848 1.00 0.00 C ATOM 1506 C PRO A 100 3.242 -16.497 0.150 1.00 0.00 C ATOM 1507 O PRO A 100 2.991 -17.008 1.242 1.00 0.00 O ATOM 1508 CB PRO A 100 0.859 -15.641 -0.182 1.00 0.00 C ATOM 1509 CG PRO A 100 0.011 -16.889 0.035 1.00 0.00 C ATOM 1510 CD PRO A 100 0.389 -17.785 -1.145 1.00 0.00 C ATOM 0 HA PRO A 100 2.558 -15.410 -1.502 1.00 0.00 H new ATOM 0 HB2 PRO A 100 1.081 -15.140 0.760 1.00 0.00 H new ATOM 0 HB3 PRO A 100 0.348 -14.916 -0.816 1.00 0.00 H new ATOM 0 HG2 PRO A 100 0.235 -17.366 0.989 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -1.054 -16.656 0.037 1.00 0.00 H new ATOM 0 HD2 PRO A 100 0.388 -18.835 -0.853 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -0.328 -17.680 -1.960 1.00 0.00 H new ATOM 1518 N VAL A 101 4.485 -16.175 -0.213 1.00 0.00 N ATOM 1519 CA VAL A 101 5.626 -16.376 0.663 1.00 0.00 C ATOM 1520 C VAL A 101 5.586 -15.235 1.679 1.00 0.00 C ATOM 1521 O VAL A 101 6.078 -14.136 1.419 1.00 0.00 O ATOM 1522 CB VAL A 101 6.937 -16.413 -0.145 1.00 0.00 C ATOM 1523 CG1 VAL A 101 8.108 -16.813 0.764 1.00 0.00 C ATOM 1524 CG2 VAL A 101 6.859 -17.425 -1.296 1.00 0.00 C ATOM 0 H VAL A 101 4.722 -15.770 -1.119 1.00 0.00 H new ATOM 0 HA VAL A 101 5.582 -17.335 1.179 1.00 0.00 H new ATOM 0 HB VAL A 101 7.092 -15.414 -0.554 1.00 0.00 H new ATOM 0 HG11 VAL A 101 9.029 -16.836 0.182 1.00 0.00 H new ATOM 0 HG12 VAL A 101 8.207 -16.087 1.571 1.00 0.00 H new ATOM 0 HG13 VAL A 101 7.921 -17.801 1.185 1.00 0.00 H new ATOM 0 HG21 VAL A 101 7.801 -17.425 -1.845 1.00 0.00 H new ATOM 0 HG22 VAL A 101 6.674 -18.421 -0.893 1.00 0.00 H new ATOM 0 HG23 VAL A 101 6.047 -17.149 -1.969 1.00 0.00 H new ATOM 1534 N ILE A 102 4.954 -15.500 2.825 1.00 0.00 N ATOM 1535 CA ILE A 102 4.698 -14.505 3.854 1.00 0.00 C ATOM 1536 C ILE A 102 5.927 -14.210 4.710 1.00 0.00 C ATOM 1537 O ILE A 102 6.624 -13.231 4.458 1.00 0.00 O ATOM 1538 CB ILE A 102 3.455 -14.867 4.695 1.00 0.00 C ATOM 1539 CG1 ILE A 102 3.263 -16.375 4.936 1.00 0.00 C ATOM 1540 CG2 ILE A 102 2.224 -14.291 3.991 1.00 0.00 C ATOM 1541 CD1 ILE A 102 2.363 -16.622 6.150 1.00 0.00 C ATOM 0 H ILE A 102 4.603 -16.428 3.062 1.00 0.00 H new ATOM 0 HA ILE A 102 4.471 -13.570 3.341 1.00 0.00 H new ATOM 0 HB ILE A 102 3.600 -14.436 5.686 1.00 0.00 H new ATOM 0 HG12 ILE A 102 2.823 -16.836 4.052 1.00 0.00 H new ATOM 0 HG13 ILE A 102 4.232 -16.849 5.094 1.00 0.00 H new ATOM 0 HG21 ILE A 102 1.330 -14.533 4.566 1.00 0.00 H new ATOM 0 HG22 ILE A 102 2.323 -13.208 3.913 1.00 0.00 H new ATOM 0 HG23 ILE A 102 2.141 -14.721 2.993 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.242 -17.695 6.301 1.00 0.00 H new ATOM 0 HD12 ILE A 102 2.818 -16.180 7.036 1.00 0.00 H new ATOM 0 HD13 ILE A 102 1.387 -16.167 5.978 1.00 0.00 H new ATOM 1553 N ASP A 103 6.175 -14.997 5.760 1.00 0.00 N ATOM 1554 CA ASP A 103 7.239 -14.668 6.695 1.00 0.00 C ATOM 1555 C ASP A 103 8.627 -14.794 6.061 1.00 0.00 C ATOM 1556 O ASP A 103 8.813 -15.628 5.178 1.00 0.00 O ATOM 1557 CB ASP A 103 7.099 -15.460 8.003 1.00 0.00 C ATOM 1558 CG ASP A 103 6.145 -14.763 8.965 1.00 0.00 C ATOM 1559 OD1 ASP A 103 5.146 -15.351 9.359 1.00 0.00 O ATOM 1560 OD2 ASP A 103 6.478 -13.490 9.320 1.00 0.00 O ATOM 0 H ASP A 103 5.660 -15.851 5.977 1.00 0.00 H new ATOM 0 HA ASP A 103 7.132 -13.615 6.957 1.00 0.00 H new ATOM 0 HB2 ASP A 103 6.734 -16.464 7.787 1.00 0.00 H new ATOM 0 HB3 ASP A 103 8.077 -15.571 8.472 1.00 0.00 H new ATOM 1566 N PRO A 104 9.614 -14.000 6.511 1.00 0.00 N ATOM 1567 CA PRO A 104 9.530 -13.014 7.589 1.00 0.00 C ATOM 1568 C PRO A 104 8.862 -11.702 7.148 1.00 0.00 C ATOM 1569 O PRO A 104 9.422 -10.962 6.340 1.00 0.00 O ATOM 1570 CB PRO A 104 10.984 -12.770 8.011 1.00 0.00 C ATOM 1571 CG PRO A 104 11.777 -13.026 6.729 1.00 0.00 C ATOM 1572 CD PRO A 104 10.992 -14.160 6.073 1.00 0.00 C ATOM 0 HA PRO A 104 8.908 -13.383 8.404 1.00 0.00 H new ATOM 0 HB2 PRO A 104 11.130 -11.754 8.377 1.00 0.00 H new ATOM 0 HB3 PRO A 104 11.288 -13.444 8.812 1.00 0.00 H new ATOM 0 HG2 PRO A 104 11.818 -12.141 6.094 1.00 0.00 H new ATOM 0 HG3 PRO A 104 12.807 -13.315 6.940 1.00 0.00 H new ATOM 0 HD2 PRO A 104 11.065 -14.107 4.987 1.00 0.00 H new ATOM 0 HD3 PRO A 104 11.386 -15.131 6.372 1.00 0.00 H new ATOM 1580 N ILE A 105 7.677 -11.397 7.689 1.00 0.00 N ATOM 1581 CA ILE A 105 7.010 -10.118 7.470 1.00 0.00 C ATOM 1582 C ILE A 105 7.547 -9.154 8.521 1.00 0.00 C ATOM 1583 O ILE A 105 7.728 -9.551 9.671 1.00 0.00 O ATOM 1584 CB ILE A 105 5.479 -10.264 7.551 1.00 0.00 C ATOM 1585 CG1 ILE A 105 4.896 -11.061 6.371 1.00 0.00 C ATOM 1586 CG2 ILE A 105 4.770 -8.904 7.648 1.00 0.00 C ATOM 1587 CD1 ILE A 105 5.201 -10.465 4.990 1.00 0.00 C ATOM 0 H ILE A 105 7.156 -12.034 8.291 1.00 0.00 H new ATOM 0 HA ILE A 105 7.217 -9.738 6.470 1.00 0.00 H new ATOM 0 HB ILE A 105 5.293 -10.824 8.468 1.00 0.00 H new ATOM 0 HG12 ILE A 105 5.285 -12.078 6.408 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.815 -11.129 6.493 1.00 0.00 H new ATOM 0 HG21 ILE A 105 3.692 -9.059 7.703 1.00 0.00 H new ATOM 0 HG22 ILE A 105 5.108 -8.381 8.543 1.00 0.00 H new ATOM 0 HG23 ILE A 105 5.007 -8.307 6.767 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.753 -11.090 4.217 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.787 -9.459 4.929 1.00 0.00 H new ATOM 0 HD13 ILE A 105 6.280 -10.423 4.842 1.00 0.00 H new ATOM 1599 N VAL A 106 7.807 -7.904 8.127 1.00 0.00 N ATOM 1600 CA VAL A 106 8.210 -6.872 9.065 1.00 0.00 C ATOM 1601 C VAL A 106 6.941 -6.111 9.443 1.00 0.00 C ATOM 1602 O VAL A 106 6.302 -6.434 10.440 1.00 0.00 O ATOM 1603 CB VAL A 106 9.332 -6.003 8.462 1.00 0.00 C ATOM 1604 CG1 VAL A 106 9.754 -4.901 9.445 1.00 0.00 C ATOM 1605 CG2 VAL A 106 10.558 -6.872 8.143 1.00 0.00 C ATOM 0 H VAL A 106 7.743 -7.589 7.159 1.00 0.00 H new ATOM 0 HA VAL A 106 8.650 -7.277 9.976 1.00 0.00 H new ATOM 0 HB VAL A 106 8.949 -5.547 7.549 1.00 0.00 H new ATOM 0 HG11 VAL A 106 10.547 -4.300 8.999 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.898 -4.265 9.668 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.118 -5.355 10.367 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.345 -6.249 7.718 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.921 -7.340 9.058 1.00 0.00 H new ATOM 0 HG23 VAL A 106 10.280 -7.645 7.426 1.00 0.00 H new ATOM 1615 N ALA A 107 6.585 -5.094 8.658 1.00 0.00 N ATOM 1616 CA ALA A 107 5.335 -4.367 8.823 1.00 0.00 C ATOM 1617 C ALA A 107 4.272 -4.977 7.918 1.00 0.00 C ATOM 1618 O ALA A 107 4.588 -5.731 7.001 1.00 0.00 O ATOM 1619 CB ALA A 107 5.558 -2.879 8.546 1.00 0.00 C ATOM 0 H ALA A 107 7.161 -4.753 7.888 1.00 0.00 H new ATOM 0 HA ALA A 107 4.980 -4.451 9.850 1.00 0.00 H new ATOM 0 HB1 ALA A 107 4.618 -2.341 8.671 1.00 0.00 H new ATOM 0 HB2 ALA A 107 6.297 -2.486 9.244 1.00 0.00 H new ATOM 0 HB3 ALA A 107 5.917 -2.749 7.525 1.00 0.00 H new ATOM 1625 N GLY A 108 3.006 -4.630 8.123 1.00 0.00 N ATOM 1626 CA GLY A 108 1.960 -5.069 7.227 1.00 0.00 C ATOM 1627 C GLY A 108 0.607 -4.748 7.830 1.00 0.00 C ATOM 1628 O GLY A 108 0.543 -4.224 8.939 1.00 0.00 O ATOM 0 H GLY A 108 2.688 -4.049 8.899 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.065 -4.576 6.260 1.00 0.00 H new ATOM 0 HA3 GLY A 108 2.045 -6.141 7.049 1.00 0.00 H new ATOM 1632 N THR A 109 -0.462 -5.087 7.113 1.00 0.00 N ATOM 1633 CA THR A 109 -1.836 -4.947 7.561 1.00 0.00 C ATOM 1634 C THR A 109 -2.527 -6.293 7.461 1.00 0.00 C ATOM 1635 O THR A 109 -2.560 -6.894 6.393 1.00 0.00 O ATOM 1636 CB THR A 109 -2.533 -3.892 6.699 1.00 0.00 C ATOM 1637 OG1 THR A 109 -2.075 -3.948 5.360 1.00 0.00 O ATOM 1638 CG2 THR A 109 -2.240 -2.525 7.301 1.00 0.00 C ATOM 0 H THR A 109 -0.388 -5.479 6.174 1.00 0.00 H new ATOM 0 HA THR A 109 -1.875 -4.620 8.600 1.00 0.00 H new ATOM 0 HB THR A 109 -3.607 -4.079 6.684 1.00 0.00 H new ATOM 0 HG1 THR A 109 -2.674 -3.425 4.787 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.726 -1.753 6.705 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.620 -2.488 8.322 1.00 0.00 H new ATOM 0 HG23 THR A 109 -1.164 -2.354 7.308 1.00 0.00 H new ATOM 1646 N GLY A 110 -3.095 -6.766 8.570 1.00 0.00 N ATOM 1647 CA GLY A 110 -3.664 -8.098 8.643 1.00 0.00 C ATOM 1648 C GLY A 110 -5.056 -8.185 8.008 1.00 0.00 C ATOM 1649 O GLY A 110 -6.002 -8.585 8.677 1.00 0.00 O ATOM 0 H GLY A 110 -3.170 -6.233 9.437 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -2.997 -8.801 8.143 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -3.726 -8.405 9.687 1.00 0.00 H new ATOM 1653 N PHE A 111 -5.155 -7.868 6.710 1.00 0.00 N ATOM 1654 CA PHE A 111 -6.359 -7.978 5.880 1.00 0.00 C ATOM 1655 C PHE A 111 -7.389 -6.905 6.279 1.00 0.00 C ATOM 1656 O PHE A 111 -8.180 -7.085 7.201 1.00 0.00 O ATOM 1657 CB PHE A 111 -6.904 -9.421 5.852 1.00 0.00 C ATOM 1658 CG PHE A 111 -5.878 -10.482 5.446 1.00 0.00 C ATOM 1659 CD1 PHE A 111 -4.920 -10.949 6.368 1.00 0.00 C ATOM 1660 CD2 PHE A 111 -5.806 -10.937 4.114 1.00 0.00 C ATOM 1661 CE1 PHE A 111 -3.784 -11.647 5.919 1.00 0.00 C ATOM 1662 CE2 PHE A 111 -4.674 -11.639 3.662 1.00 0.00 C ATOM 1663 CZ PHE A 111 -3.637 -11.951 4.555 1.00 0.00 C ATOM 0 H PHE A 111 -4.357 -7.510 6.186 1.00 0.00 H new ATOM 0 HA PHE A 111 -6.100 -7.768 4.842 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -7.291 -9.668 6.840 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -7.745 -9.464 5.160 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -5.059 -10.770 7.424 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -6.625 -10.746 3.436 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -3.024 -11.950 6.624 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -4.603 -11.938 2.627 1.00 0.00 H new ATOM 0 HZ PHE A 111 -2.733 -12.421 4.197 1.00 0.00 H new ATOM 1673 N SER A 112 -7.347 -5.767 5.579 1.00 0.00 N ATOM 1674 CA SER A 112 -8.102 -4.547 5.845 1.00 0.00 C ATOM 1675 C SER A 112 -9.626 -4.665 5.674 1.00 0.00 C ATOM 1676 O SER A 112 -10.096 -5.585 5.007 1.00 0.00 O ATOM 1677 CB SER A 112 -7.512 -3.472 4.918 1.00 0.00 C ATOM 1678 OG SER A 112 -7.071 -4.036 3.684 1.00 0.00 O ATOM 0 H SER A 112 -6.746 -5.671 4.761 1.00 0.00 H new ATOM 0 HA SER A 112 -7.997 -4.296 6.900 1.00 0.00 H new ATOM 0 HB2 SER A 112 -8.262 -2.706 4.722 1.00 0.00 H new ATOM 0 HB3 SER A 112 -6.676 -2.980 5.415 1.00 0.00 H new ATOM 0 HG SER A 112 -6.202 -3.654 3.442 1.00 0.00 H new ATOM 1684 N PRO A 113 -10.401 -3.725 6.259 1.00 0.00 N ATOM 1685 CA PRO A 113 -11.847 -3.634 6.074 1.00 0.00 C ATOM 1686 C PRO A 113 -12.140 -3.249 4.623 1.00 0.00 C ATOM 1687 O PRO A 113 -11.296 -2.630 3.978 1.00 0.00 O ATOM 1688 CB PRO A 113 -12.319 -2.535 7.034 1.00 0.00 C ATOM 1689 CG PRO A 113 -11.101 -1.616 7.111 1.00 0.00 C ATOM 1690 CD PRO A 113 -9.951 -2.623 7.101 1.00 0.00 C ATOM 0 HA PRO A 113 -12.357 -4.576 6.278 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -13.197 -2.013 6.653 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -12.586 -2.937 8.011 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -11.052 -0.930 6.265 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -11.104 -1.007 8.015 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -9.040 -2.174 6.705 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -9.724 -2.968 8.110 1.00 0.00 H new ATOM 1698 N VAL A 114 -13.328 -3.601 4.110 1.00 0.00 N ATOM 1699 CA VAL A 114 -13.640 -3.426 2.695 1.00 0.00 C ATOM 1700 C VAL A 114 -15.128 -3.109 2.459 1.00 0.00 C ATOM 1701 O VAL A 114 -15.914 -4.019 2.189 1.00 0.00 O ATOM 1702 CB VAL A 114 -13.217 -4.691 1.920 1.00 0.00 C ATOM 1703 CG1 VAL A 114 -12.863 -4.311 0.481 1.00 0.00 C ATOM 1704 CG2 VAL A 114 -12.031 -5.438 2.526 1.00 0.00 C ATOM 0 H VAL A 114 -14.085 -4.008 4.659 1.00 0.00 H new ATOM 0 HA VAL A 114 -13.080 -2.566 2.327 1.00 0.00 H new ATOM 0 HB VAL A 114 -14.072 -5.366 1.968 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -12.564 -5.204 -0.068 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -13.732 -3.863 -0.001 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -12.041 -3.595 0.485 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -11.803 -6.313 1.917 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -11.163 -4.780 2.555 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -12.280 -5.756 3.539 1.00 0.00 H new ATOM 1714 N PRO A 115 -15.537 -1.835 2.546 1.00 0.00 N ATOM 1715 CA PRO A 115 -16.895 -1.411 2.233 1.00 0.00 C ATOM 1716 C PRO A 115 -17.313 -1.771 0.802 1.00 0.00 C ATOM 1717 O PRO A 115 -16.473 -2.080 -0.043 1.00 0.00 O ATOM 1718 CB PRO A 115 -16.913 0.103 2.445 1.00 0.00 C ATOM 1719 CG PRO A 115 -15.774 0.339 3.437 1.00 0.00 C ATOM 1720 CD PRO A 115 -14.748 -0.716 3.023 1.00 0.00 C ATOM 0 HA PRO A 115 -17.612 -1.925 2.874 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -16.750 0.641 1.511 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -17.869 0.441 2.844 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -15.371 1.349 3.359 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -16.100 0.205 4.468 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -14.086 -0.339 2.244 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -14.118 -1.006 3.864 1.00 0.00 H new ATOM 1728 N LYS A 116 -18.620 -1.698 0.527 1.00 0.00 N ATOM 1729 CA LYS A 116 -19.206 -2.119 -0.745 1.00 0.00 C ATOM 1730 C LYS A 116 -19.530 -0.958 -1.692 1.00 0.00 C ATOM 1731 O LYS A 116 -20.134 -1.189 -2.739 1.00 0.00 O ATOM 1732 CB LYS A 116 -20.448 -2.979 -0.465 1.00 0.00 C ATOM 1733 CG LYS A 116 -20.148 -4.256 0.337 1.00 0.00 C ATOM 1734 CD LYS A 116 -19.355 -5.276 -0.491 1.00 0.00 C ATOM 1735 CE LYS A 116 -19.167 -6.588 0.278 1.00 0.00 C ATOM 1736 NZ LYS A 116 -18.553 -7.626 -0.572 1.00 0.00 N ATOM 0 H LYS A 116 -19.307 -1.340 1.191 1.00 0.00 H new ATOM 0 HA LYS A 116 -18.455 -2.708 -1.272 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -21.178 -2.381 0.081 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -20.908 -3.256 -1.413 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -19.584 -3.998 1.233 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -21.084 -4.706 0.668 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -19.877 -5.472 -1.428 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -18.381 -4.860 -0.749 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -18.539 -6.413 1.152 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -20.132 -6.939 0.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -17.859 -8.165 -0.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -19.291 -8.270 -0.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -18.075 -7.176 -1.379 1.00 0.00 H new ATOM 1750 N ASP A 117 -19.136 0.267 -1.332 1.00 0.00 N ATOM 1751 CA ASP A 117 -19.267 1.555 -2.033 1.00 0.00 C ATOM 1752 C ASP A 117 -19.536 2.664 -1.012 1.00 0.00 C ATOM 1753 O ASP A 117 -19.875 2.378 0.135 1.00 0.00 O ATOM 1754 CB ASP A 117 -20.347 1.609 -3.135 1.00 0.00 C ATOM 1755 CG ASP A 117 -21.767 1.565 -2.579 1.00 0.00 C ATOM 1756 OD1 ASP A 117 -22.313 2.623 -2.281 1.00 0.00 O ATOM 1757 OD2 ASP A 117 -22.346 0.339 -2.469 1.00 0.00 O ATOM 0 H ASP A 117 -18.662 0.398 -0.438 1.00 0.00 H new ATOM 0 HA ASP A 117 -18.318 1.695 -2.551 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -20.219 2.521 -3.718 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -20.204 0.772 -3.818 1.00 0.00 H new ATOM 1763 N GLY A 118 -19.403 3.924 -1.447 1.00 0.00 N ATOM 1764 CA GLY A 118 -19.669 5.124 -0.659 1.00 0.00 C ATOM 1765 C GLY A 118 -18.608 5.328 0.411 1.00 0.00 C ATOM 1766 O GLY A 118 -17.847 6.293 0.339 1.00 0.00 O ATOM 0 H GLY A 118 -19.095 4.138 -2.395 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -19.699 5.994 -1.315 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -20.650 5.044 -0.191 1.00 0.00 H new ATOM 1770 N LYS A 119 -18.571 4.416 1.385 1.00 0.00 N ATOM 1771 CA LYS A 119 -17.562 4.378 2.423 1.00 0.00 C ATOM 1772 C LYS A 119 -16.292 3.759 1.841 1.00 0.00 C ATOM 1773 O LYS A 119 -16.360 3.014 0.865 1.00 0.00 O ATOM 1774 CB LYS A 119 -18.064 3.588 3.637 1.00 0.00 C ATOM 1775 CG LYS A 119 -19.255 4.280 4.310 1.00 0.00 C ATOM 1776 CD LYS A 119 -19.701 3.481 5.539 1.00 0.00 C ATOM 1777 CE LYS A 119 -20.872 4.180 6.236 1.00 0.00 C ATOM 1778 NZ LYS A 119 -21.326 3.420 7.415 1.00 0.00 N ATOM 0 H LYS A 119 -19.262 3.670 1.468 1.00 0.00 H new ATOM 0 HA LYS A 119 -17.344 5.388 2.769 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -18.355 2.585 3.324 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -17.254 3.474 4.358 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -18.978 5.292 4.605 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -20.081 4.368 3.604 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -19.996 2.475 5.239 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -18.868 3.375 6.233 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -20.570 5.182 6.541 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -21.699 4.295 5.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -22.120 3.919 7.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -21.636 2.472 7.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -20.543 3.332 8.094 1.00 0.00 H new ATOM 1792 N PHE A 120 -15.143 4.090 2.433 1.00 0.00 N ATOM 1793 CA PHE A 120 -13.818 3.730 1.948 1.00 0.00 C ATOM 1794 C PHE A 120 -12.925 3.289 3.094 1.00 0.00 C ATOM 1795 O PHE A 120 -12.541 4.122 3.910 1.00 0.00 O ATOM 1796 CB PHE A 120 -13.225 4.942 1.228 1.00 0.00 C ATOM 1797 CG PHE A 120 -13.581 4.909 -0.248 1.00 0.00 C ATOM 1798 CD1 PHE A 120 -12.842 4.103 -1.134 1.00 0.00 C ATOM 1799 CD2 PHE A 120 -14.826 5.405 -0.665 1.00 0.00 C ATOM 1800 CE1 PHE A 120 -13.242 3.974 -2.476 1.00 0.00 C ATOM 1801 CE2 PHE A 120 -15.264 5.224 -1.987 1.00 0.00 C ATOM 1802 CZ PHE A 120 -14.439 4.566 -2.912 1.00 0.00 C ATOM 0 H PHE A 120 -15.113 4.636 3.294 1.00 0.00 H new ATOM 0 HA PHE A 120 -13.892 2.891 1.257 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -13.601 5.860 1.679 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -12.142 4.949 1.347 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -11.964 3.582 -0.782 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -15.454 5.932 0.038 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -12.629 3.420 -3.171 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -16.233 5.590 -2.291 1.00 0.00 H new ATOM 0 HZ PHE A 120 -14.723 4.515 -3.953 1.00 0.00 H new ATOM 1812 N GLY A 121 -12.606 1.997 3.151 1.00 0.00 N ATOM 1813 CA GLY A 121 -11.801 1.390 4.199 1.00 0.00 C ATOM 1814 C GLY A 121 -10.356 1.872 4.130 1.00 0.00 C ATOM 1815 O GLY A 121 -9.663 1.559 3.161 1.00 0.00 O ATOM 0 H GLY A 121 -12.912 1.327 2.446 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -12.223 1.635 5.174 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -11.831 0.305 4.102 1.00 0.00 H new ATOM 1819 N TYR A 122 -9.902 2.615 5.146 1.00 0.00 N ATOM 1820 CA TYR A 122 -8.539 3.113 5.236 1.00 0.00 C ATOM 1821 C TYR A 122 -7.852 2.642 6.510 1.00 0.00 C ATOM 1822 O TYR A 122 -8.479 2.169 7.460 1.00 0.00 O ATOM 1823 CB TYR A 122 -8.478 4.643 5.108 1.00 0.00 C ATOM 1824 CG TYR A 122 -8.890 5.439 6.333 1.00 0.00 C ATOM 1825 CD1 TYR A 122 -7.931 5.777 7.310 1.00 0.00 C ATOM 1826 CD2 TYR A 122 -10.190 5.960 6.429 1.00 0.00 C ATOM 1827 CE1 TYR A 122 -8.285 6.599 8.393 1.00 0.00 C ATOM 1828 CE2 TYR A 122 -10.536 6.799 7.505 1.00 0.00 C ATOM 1829 CZ TYR A 122 -9.587 7.111 8.489 1.00 0.00 C ATOM 1830 OH TYR A 122 -9.932 7.885 9.555 1.00 0.00 O ATOM 0 H TYR A 122 -10.486 2.887 5.937 1.00 0.00 H new ATOM 0 HA TYR A 122 -7.994 2.693 4.391 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -7.458 4.924 4.845 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -9.115 4.942 4.276 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -6.921 5.403 7.226 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -10.925 5.717 5.676 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -7.554 6.837 9.152 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -11.535 7.204 7.573 1.00 0.00 H new ATOM 0 HH TYR A 122 -10.869 8.160 9.470 1.00 0.00 H new ATOM 1840 N THR A 123 -6.530 2.782 6.514 1.00 0.00 N ATOM 1841 CA THR A 123 -5.665 2.412 7.610 1.00 0.00 C ATOM 1842 C THR A 123 -4.374 3.192 7.409 1.00 0.00 C ATOM 1843 O THR A 123 -3.745 3.023 6.369 1.00 0.00 O ATOM 1844 CB THR A 123 -5.431 0.896 7.540 1.00 0.00 C ATOM 1845 OG1 THR A 123 -6.641 0.200 7.715 1.00 0.00 O ATOM 1846 CG2 THR A 123 -4.368 0.406 8.521 1.00 0.00 C ATOM 0 H THR A 123 -6.021 3.172 5.721 1.00 0.00 H new ATOM 0 HA THR A 123 -6.085 2.641 8.589 1.00 0.00 H new ATOM 0 HB THR A 123 -5.043 0.685 6.543 1.00 0.00 H new ATOM 0 HG1 THR A 123 -6.452 -0.742 7.906 1.00 0.00 H new ATOM 0 HG21 THR A 123 -4.251 -0.673 8.421 1.00 0.00 H new ATOM 0 HG22 THR A 123 -3.419 0.896 8.304 1.00 0.00 H new ATOM 0 HG23 THR A 123 -4.675 0.645 9.539 1.00 0.00 H new ATOM 1854 N ASP A 124 -4.002 4.050 8.363 1.00 0.00 N ATOM 1855 CA ASP A 124 -2.753 4.807 8.342 1.00 0.00 C ATOM 1856 C ASP A 124 -1.718 4.055 9.169 1.00 0.00 C ATOM 1857 O ASP A 124 -1.341 4.521 10.248 1.00 0.00 O ATOM 1858 CB ASP A 124 -2.967 6.215 8.919 1.00 0.00 C ATOM 1859 CG ASP A 124 -3.848 7.076 8.037 1.00 0.00 C ATOM 1860 OD1 ASP A 124 -3.393 7.541 6.996 1.00 0.00 O ATOM 1861 OD2 ASP A 124 -5.118 7.274 8.473 1.00 0.00 O ATOM 0 H ASP A 124 -4.574 4.240 9.186 1.00 0.00 H new ATOM 0 HA ASP A 124 -2.406 4.912 7.314 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -3.417 6.134 9.908 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -2.000 6.702 9.048 1.00 0.00 H new ATOM 1867 N PHE A 125 -1.274 2.882 8.703 1.00 0.00 N ATOM 1868 CA PHE A 125 -0.315 2.145 9.511 1.00 0.00 C ATOM 1869 C PHE A 125 1.015 2.894 9.466 1.00 0.00 C ATOM 1870 O PHE A 125 1.630 3.074 8.416 1.00 0.00 O ATOM 1871 CB PHE A 125 -0.249 0.644 9.235 1.00 0.00 C ATOM 1872 CG PHE A 125 0.288 0.158 7.908 1.00 0.00 C ATOM 1873 CD1 PHE A 125 -0.550 0.128 6.777 1.00 0.00 C ATOM 1874 CD2 PHE A 125 1.506 -0.551 7.891 1.00 0.00 C ATOM 1875 CE1 PHE A 125 -0.207 -0.669 5.670 1.00 0.00 C ATOM 1876 CE2 PHE A 125 1.834 -1.366 6.797 1.00 0.00 C ATOM 1877 CZ PHE A 125 0.957 -1.456 5.706 1.00 0.00 C ATOM 0 H PHE A 125 -1.547 2.447 7.822 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.659 2.125 10.545 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.359 0.193 10.019 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -1.258 0.246 9.346 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.455 0.716 6.759 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.189 -0.467 8.723 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -0.837 -0.676 4.793 1.00 0.00 H new ATOM 0 HE2 PHE A 125 2.759 -1.923 6.795 1.00 0.00 H new ATOM 0 HZ PHE A 125 1.177 -2.131 4.892 1.00 0.00 H new ATOM 1887 N THR A 126 1.388 3.401 10.635 1.00 0.00 N ATOM 1888 CA THR A 126 2.504 4.304 10.844 1.00 0.00 C ATOM 1889 C THR A 126 3.768 3.506 11.170 1.00 0.00 C ATOM 1890 O THR A 126 4.069 3.256 12.335 1.00 0.00 O ATOM 1891 CB THR A 126 2.073 5.294 11.938 1.00 0.00 C ATOM 1892 OG1 THR A 126 0.870 5.934 11.536 1.00 0.00 O ATOM 1893 CG2 THR A 126 3.119 6.383 12.175 1.00 0.00 C ATOM 0 H THR A 126 0.895 3.181 11.501 1.00 0.00 H new ATOM 0 HA THR A 126 2.759 4.875 9.952 1.00 0.00 H new ATOM 0 HB THR A 126 1.944 4.725 12.859 1.00 0.00 H new ATOM 0 HG1 THR A 126 1.050 6.518 10.770 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.770 7.059 12.956 1.00 0.00 H new ATOM 0 HG22 THR A 126 4.058 5.924 12.484 1.00 0.00 H new ATOM 0 HG23 THR A 126 3.276 6.944 11.254 1.00 0.00 H new ATOM 1901 N TRP A 127 4.493 3.086 10.130 1.00 0.00 N ATOM 1902 CA TRP A 127 5.669 2.235 10.247 1.00 0.00 C ATOM 1903 C TRP A 127 6.948 3.075 10.319 1.00 0.00 C ATOM 1904 O TRP A 127 7.062 4.108 9.663 1.00 0.00 O ATOM 1905 CB TRP A 127 5.699 1.277 9.044 1.00 0.00 C ATOM 1906 CG TRP A 127 6.923 0.420 8.866 1.00 0.00 C ATOM 1907 CD1 TRP A 127 7.583 -0.236 9.845 1.00 0.00 C ATOM 1908 CD2 TRP A 127 7.653 0.122 7.637 1.00 0.00 C ATOM 1909 NE1 TRP A 127 8.670 -0.899 9.313 1.00 0.00 N ATOM 1910 CE2 TRP A 127 8.760 -0.719 7.949 1.00 0.00 C ATOM 1911 CE3 TRP A 127 7.503 0.487 6.286 1.00 0.00 C ATOM 1912 CZ2 TRP A 127 9.674 -1.148 6.973 1.00 0.00 C ATOM 1913 CZ3 TRP A 127 8.408 0.058 5.301 1.00 0.00 C ATOM 1914 CH2 TRP A 127 9.491 -0.761 5.636 1.00 0.00 C ATOM 0 H TRP A 127 4.271 3.336 9.166 1.00 0.00 H new ATOM 0 HA TRP A 127 5.616 1.658 11.170 1.00 0.00 H new ATOM 0 HB2 TRP A 127 4.835 0.617 9.119 1.00 0.00 H new ATOM 0 HB3 TRP A 127 5.570 1.870 8.139 1.00 0.00 H new ATOM 0 HD1 TRP A 127 7.302 -0.241 10.888 1.00 0.00 H new ATOM 0 HE1 TRP A 127 9.327 -1.454 9.862 1.00 0.00 H new ATOM 0 HE3 TRP A 127 6.671 1.113 5.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 10.512 -1.771 7.249 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 8.266 0.364 4.275 1.00 0.00 H new ATOM 0 HH2 TRP A 127 10.180 -1.093 4.873 1.00 0.00 H new ATOM 1925 N HIS A 128 7.913 2.619 11.120 1.00 0.00 N ATOM 1926 CA HIS A 128 9.257 3.171 11.196 1.00 0.00 C ATOM 1927 C HIS A 128 10.171 2.096 10.600 1.00 0.00 C ATOM 1928 O HIS A 128 10.294 1.024 11.194 1.00 0.00 O ATOM 1929 CB HIS A 128 9.601 3.521 12.645 1.00 0.00 C ATOM 1930 CG HIS A 128 8.834 4.735 13.098 1.00 0.00 C ATOM 1931 ND1 HIS A 128 7.602 4.734 13.727 1.00 0.00 N ATOM 1932 CD2 HIS A 128 9.112 6.019 12.718 1.00 0.00 C ATOM 1933 CE1 HIS A 128 7.152 6.001 13.746 1.00 0.00 C ATOM 1934 NE2 HIS A 128 8.052 6.796 13.135 1.00 0.00 N ATOM 0 H HIS A 128 7.771 1.831 11.751 1.00 0.00 H new ATOM 0 HA HIS A 128 9.369 4.103 10.643 1.00 0.00 H new ATOM 0 HB2 HIS A 128 9.369 2.676 13.293 1.00 0.00 H new ATOM 0 HB3 HIS A 128 10.671 3.707 12.735 1.00 0.00 H new ATOM 0 HD1 HIS A 128 7.121 3.919 14.108 1.00 0.00 H new ATOM 0 HD2 HIS A 128 9.992 6.359 12.193 1.00 0.00 H new ATOM 0 HE1 HIS A 128 6.219 6.329 14.181 1.00 0.00 H new ATOM 1943 N PRO A 129 10.743 2.325 9.409 1.00 0.00 N ATOM 1944 CA PRO A 129 11.499 1.333 8.672 1.00 0.00 C ATOM 1945 C PRO A 129 12.960 1.284 9.134 1.00 0.00 C ATOM 1946 O PRO A 129 13.378 2.065 9.988 1.00 0.00 O ATOM 1947 CB PRO A 129 11.414 1.821 7.226 1.00 0.00 C ATOM 1948 CG PRO A 129 11.507 3.335 7.388 1.00 0.00 C ATOM 1949 CD PRO A 129 10.684 3.565 8.656 1.00 0.00 C ATOM 0 HA PRO A 129 11.110 0.325 8.813 1.00 0.00 H new ATOM 0 HB2 PRO A 129 12.226 1.427 6.615 1.00 0.00 H new ATOM 0 HB3 PRO A 129 10.481 1.520 6.749 1.00 0.00 H new ATOM 0 HG2 PRO A 129 12.537 3.671 7.503 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.093 3.864 6.530 1.00 0.00 H new ATOM 0 HD2 PRO A 129 11.089 4.393 9.238 1.00 0.00 H new ATOM 0 HD3 PRO A 129 9.654 3.822 8.410 1.00 0.00 H new ATOM 1957 N THR A 130 13.745 0.385 8.533 1.00 0.00 N ATOM 1958 CA THR A 130 15.192 0.310 8.687 1.00 0.00 C ATOM 1959 C THR A 130 15.771 0.394 7.272 1.00 0.00 C ATOM 1960 O THR A 130 15.039 0.185 6.304 1.00 0.00 O ATOM 1961 CB THR A 130 15.623 -0.949 9.454 1.00 0.00 C ATOM 1962 OG1 THR A 130 15.148 -2.130 8.839 1.00 0.00 O ATOM 1963 CG2 THR A 130 15.108 -0.908 10.895 1.00 0.00 C ATOM 0 H THR A 130 13.375 -0.331 7.908 1.00 0.00 H new ATOM 0 HA THR A 130 15.576 1.129 9.296 1.00 0.00 H new ATOM 0 HB THR A 130 16.713 -0.962 9.446 1.00 0.00 H new ATOM 0 HG1 THR A 130 15.444 -2.909 9.355 1.00 0.00 H new ATOM 0 HG21 THR A 130 15.425 -1.809 11.420 1.00 0.00 H new ATOM 0 HG22 THR A 130 15.513 -0.032 11.401 1.00 0.00 H new ATOM 0 HG23 THR A 130 14.019 -0.854 10.891 1.00 0.00 H new ATOM 1971 N ALA A 131 17.049 0.753 7.128 1.00 0.00 N ATOM 1972 CA ALA A 131 17.601 1.004 5.804 1.00 0.00 C ATOM 1973 C ALA A 131 17.679 -0.246 4.918 1.00 0.00 C ATOM 1974 O ALA A 131 17.746 -1.373 5.410 1.00 0.00 O ATOM 1975 CB ALA A 131 18.954 1.718 5.895 1.00 0.00 C ATOM 0 H ALA A 131 17.706 0.873 7.899 1.00 0.00 H new ATOM 0 HA ALA A 131 16.895 1.668 5.306 1.00 0.00 H new ATOM 0 HB1 ALA A 131 19.342 1.892 4.891 1.00 0.00 H new ATOM 0 HB2 ALA A 131 18.828 2.673 6.406 1.00 0.00 H new ATOM 0 HB3 ALA A 131 19.656 1.098 6.453 1.00 0.00 H new ATOM 1981 N GLY A 132 17.710 -0.018 3.603 1.00 0.00 N ATOM 1982 CA GLY A 132 17.896 -1.014 2.563 1.00 0.00 C ATOM 1983 C GLY A 132 16.661 -1.167 1.679 1.00 0.00 C ATOM 1984 O GLY A 132 15.681 -0.429 1.803 1.00 0.00 O ATOM 0 H GLY A 132 17.599 0.921 3.221 1.00 0.00 H new ATOM 0 HA2 GLY A 132 18.750 -0.736 1.945 1.00 0.00 H new ATOM 0 HA3 GLY A 132 18.133 -1.974 3.021 1.00 0.00 H new ATOM 1988 N THR A 133 16.749 -2.115 0.746 1.00 0.00 N ATOM 1989 CA THR A 133 15.734 -2.363 -0.260 1.00 0.00 C ATOM 1990 C THR A 133 14.622 -3.239 0.315 1.00 0.00 C ATOM 1991 O THR A 133 14.666 -4.464 0.215 1.00 0.00 O ATOM 1992 CB THR A 133 16.394 -2.995 -1.495 1.00 0.00 C ATOM 1993 OG1 THR A 133 17.599 -2.306 -1.777 1.00 0.00 O ATOM 1994 CG2 THR A 133 15.470 -2.908 -2.715 1.00 0.00 C ATOM 0 H THR A 133 17.550 -2.743 0.673 1.00 0.00 H new ATOM 0 HA THR A 133 15.271 -1.425 -0.567 1.00 0.00 H new ATOM 0 HB THR A 133 16.594 -4.046 -1.285 1.00 0.00 H new ATOM 0 HG1 THR A 133 18.027 -2.705 -2.563 1.00 0.00 H new ATOM 0 HG21 THR A 133 15.960 -3.362 -3.576 1.00 0.00 H new ATOM 0 HG22 THR A 133 14.540 -3.437 -2.506 1.00 0.00 H new ATOM 0 HG23 THR A 133 15.251 -1.862 -2.932 1.00 0.00 H new ATOM 2002 N TYR A 134 13.632 -2.603 0.934 1.00 0.00 N ATOM 2003 CA TYR A 134 12.417 -3.263 1.379 1.00 0.00 C ATOM 2004 C TYR A 134 11.492 -3.453 0.174 1.00 0.00 C ATOM 2005 O TYR A 134 11.800 -2.999 -0.928 1.00 0.00 O ATOM 2006 CB TYR A 134 11.756 -2.435 2.489 1.00 0.00 C ATOM 2007 CG TYR A 134 12.168 -2.821 3.886 1.00 0.00 C ATOM 2008 CD1 TYR A 134 13.371 -2.356 4.446 1.00 0.00 C ATOM 2009 CD2 TYR A 134 11.270 -3.564 4.668 1.00 0.00 C ATOM 2010 CE1 TYR A 134 13.659 -2.626 5.795 1.00 0.00 C ATOM 2011 CE2 TYR A 134 11.531 -3.781 6.023 1.00 0.00 C ATOM 2012 CZ TYR A 134 12.716 -3.295 6.594 1.00 0.00 C ATOM 2013 OH TYR A 134 12.882 -3.370 7.941 1.00 0.00 O ATOM 0 H TYR A 134 13.655 -1.605 1.141 1.00 0.00 H new ATOM 0 HA TYR A 134 12.641 -4.245 1.797 1.00 0.00 H new ATOM 0 HB2 TYR A 134 11.994 -1.383 2.331 1.00 0.00 H new ATOM 0 HB3 TYR A 134 10.674 -2.533 2.403 1.00 0.00 H new ATOM 0 HD1 TYR A 134 14.070 -1.795 3.843 1.00 0.00 H new ATOM 0 HD2 TYR A 134 10.374 -3.969 4.221 1.00 0.00 H new ATOM 0 HE1 TYR A 134 14.605 -2.319 6.217 1.00 0.00 H new ATOM 0 HE2 TYR A 134 10.821 -4.323 6.630 1.00 0.00 H new ATOM 0 HH TYR A 134 13.760 -3.008 8.183 1.00 0.00 H new ATOM 2023 N TYR A 135 10.363 -4.133 0.378 1.00 0.00 N ATOM 2024 CA TYR A 135 9.359 -4.398 -0.634 1.00 0.00 C ATOM 2025 C TYR A 135 7.987 -4.515 0.026 1.00 0.00 C ATOM 2026 O TYR A 135 7.896 -4.957 1.175 1.00 0.00 O ATOM 2027 CB TYR A 135 9.664 -5.705 -1.373 1.00 0.00 C ATOM 2028 CG TYR A 135 10.922 -5.705 -2.220 1.00 0.00 C ATOM 2029 CD1 TYR A 135 12.158 -6.047 -1.644 1.00 0.00 C ATOM 2030 CD2 TYR A 135 10.850 -5.432 -3.596 1.00 0.00 C ATOM 2031 CE1 TYR A 135 13.320 -6.102 -2.428 1.00 0.00 C ATOM 2032 CE2 TYR A 135 12.010 -5.505 -4.386 1.00 0.00 C ATOM 2033 CZ TYR A 135 13.245 -5.824 -3.802 1.00 0.00 C ATOM 2034 OH TYR A 135 14.359 -5.911 -4.583 1.00 0.00 O ATOM 0 H TYR A 135 10.121 -4.525 1.288 1.00 0.00 H new ATOM 0 HA TYR A 135 9.367 -3.575 -1.348 1.00 0.00 H new ATOM 0 HB2 TYR A 135 9.743 -6.506 -0.638 1.00 0.00 H new ATOM 0 HB3 TYR A 135 8.816 -5.944 -2.015 1.00 0.00 H new ATOM 0 HD1 TYR A 135 12.213 -6.269 -0.589 1.00 0.00 H new ATOM 0 HD2 TYR A 135 9.905 -5.166 -4.046 1.00 0.00 H new ATOM 0 HE1 TYR A 135 14.268 -6.357 -1.977 1.00 0.00 H new ATOM 0 HE2 TYR A 135 11.950 -5.315 -5.447 1.00 0.00 H new ATOM 0 HH TYR A 135 14.128 -5.687 -5.509 1.00 0.00 H new ATOM 2044 N TYR A 136 6.935 -4.134 -0.704 1.00 0.00 N ATOM 2045 CA TYR A 136 5.548 -4.327 -0.305 1.00 0.00 C ATOM 2046 C TYR A 136 4.917 -5.342 -1.247 1.00 0.00 C ATOM 2047 O TYR A 136 5.279 -5.380 -2.425 1.00 0.00 O ATOM 2048 CB TYR A 136 4.749 -3.021 -0.297 1.00 0.00 C ATOM 2049 CG TYR A 136 4.647 -2.260 -1.609 1.00 0.00 C ATOM 2050 CD1 TYR A 136 5.616 -1.292 -1.919 1.00 0.00 C ATOM 2051 CD2 TYR A 136 3.506 -2.387 -2.429 1.00 0.00 C ATOM 2052 CE1 TYR A 136 5.433 -0.426 -3.009 1.00 0.00 C ATOM 2053 CE2 TYR A 136 3.323 -1.520 -3.523 1.00 0.00 C ATOM 2054 CZ TYR A 136 4.273 -0.524 -3.795 1.00 0.00 C ATOM 2055 OH TYR A 136 4.112 0.284 -4.879 1.00 0.00 O ATOM 0 H TYR A 136 7.032 -3.673 -1.609 1.00 0.00 H new ATOM 0 HA TYR A 136 5.529 -4.695 0.721 1.00 0.00 H new ATOM 0 HB2 TYR A 136 3.738 -3.246 0.042 1.00 0.00 H new ATOM 0 HB3 TYR A 136 5.194 -2.357 0.445 1.00 0.00 H new ATOM 0 HD1 TYR A 136 6.508 -1.213 -1.315 1.00 0.00 H new ATOM 0 HD2 TYR A 136 2.772 -3.150 -2.217 1.00 0.00 H new ATOM 0 HE1 TYR A 136 6.183 0.315 -3.243 1.00 0.00 H new ATOM 0 HE2 TYR A 136 2.452 -1.622 -4.153 1.00 0.00 H new ATOM 0 HH TYR A 136 4.964 0.719 -5.092 1.00 0.00 H new ATOM 2065 N VAL A 137 3.989 -6.151 -0.728 1.00 0.00 N ATOM 2066 CA VAL A 137 3.261 -7.166 -1.472 1.00 0.00 C ATOM 2067 C VAL A 137 1.897 -7.426 -0.826 1.00 0.00 C ATOM 2068 O VAL A 137 1.750 -7.275 0.387 1.00 0.00 O ATOM 2069 CB VAL A 137 4.047 -8.492 -1.516 1.00 0.00 C ATOM 2070 CG1 VAL A 137 5.318 -8.435 -2.360 1.00 0.00 C ATOM 2071 CG2 VAL A 137 4.437 -8.992 -0.123 1.00 0.00 C ATOM 0 H VAL A 137 3.720 -6.111 0.255 1.00 0.00 H new ATOM 0 HA VAL A 137 3.127 -6.794 -2.488 1.00 0.00 H new ATOM 0 HB VAL A 137 3.347 -9.184 -1.984 1.00 0.00 H new ATOM 0 HG11 VAL A 137 5.812 -9.406 -2.339 1.00 0.00 H new ATOM 0 HG12 VAL A 137 5.061 -8.180 -3.388 1.00 0.00 H new ATOM 0 HG13 VAL A 137 5.990 -7.678 -1.956 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.988 -9.928 -0.213 1.00 0.00 H new ATOM 0 HG22 VAL A 137 5.064 -8.248 0.368 1.00 0.00 H new ATOM 0 HG23 VAL A 137 3.537 -9.156 0.470 1.00 0.00 H new ATOM 2081 N CYS A 138 0.898 -7.819 -1.623 1.00 0.00 N ATOM 2082 CA CYS A 138 -0.386 -8.304 -1.119 1.00 0.00 C ATOM 2083 C CYS A 138 -0.330 -9.833 -1.077 1.00 0.00 C ATOM 2084 O CYS A 138 -0.384 -10.488 -2.118 1.00 0.00 O ATOM 2085 CB CYS A 138 -1.516 -7.873 -2.042 1.00 0.00 C ATOM 2086 SG CYS A 138 -3.074 -8.739 -1.793 1.00 0.00 S ATOM 0 H CYS A 138 0.960 -7.809 -2.641 1.00 0.00 H new ATOM 0 HA CYS A 138 -0.571 -7.892 -0.127 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -1.686 -6.805 -1.909 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -1.198 -8.019 -3.074 1.00 0.00 H new ATOM 0 HG CYS A 138 -3.390 -8.709 -0.532 1.00 0.00 H new ATOM 2091 N GLN A 139 -0.232 -10.416 0.119 1.00 0.00 N ATOM 2092 CA GLN A 139 -0.035 -11.851 0.327 1.00 0.00 C ATOM 2093 C GLN A 139 -1.286 -12.713 0.086 1.00 0.00 C ATOM 2094 O GLN A 139 -1.481 -13.715 0.771 1.00 0.00 O ATOM 2095 CB GLN A 139 0.555 -12.055 1.731 1.00 0.00 C ATOM 2096 CG GLN A 139 1.969 -11.459 1.843 1.00 0.00 C ATOM 2097 CD GLN A 139 3.064 -12.317 1.203 1.00 0.00 C ATOM 2098 OE1 GLN A 139 2.794 -13.305 0.529 1.00 0.00 O ATOM 2099 NE2 GLN A 139 4.323 -11.963 1.436 1.00 0.00 N ATOM 0 H GLN A 139 -0.289 -9.890 0.991 1.00 0.00 H new ATOM 0 HA GLN A 139 0.662 -12.206 -0.433 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -0.096 -11.590 2.471 1.00 0.00 H new ATOM 0 HB3 GLN A 139 0.589 -13.120 1.961 1.00 0.00 H new ATOM 0 HG2 GLN A 139 1.974 -10.475 1.375 1.00 0.00 H new ATOM 0 HG3 GLN A 139 2.207 -11.312 2.897 1.00 0.00 H new ATOM 0 HE21 GLN A 139 4.525 -11.137 2.000 1.00 0.00 H new ATOM 0 HE22 GLN A 139 5.088 -12.517 1.051 1.00 0.00 H new ATOM 2108 N ILE A 140 -2.145 -12.348 -0.870 1.00 0.00 N ATOM 2109 CA ILE A 140 -3.237 -13.213 -1.311 1.00 0.00 C ATOM 2110 C ILE A 140 -2.675 -14.012 -2.495 1.00 0.00 C ATOM 2111 O ILE A 140 -1.975 -13.416 -3.319 1.00 0.00 O ATOM 2112 CB ILE A 140 -4.493 -12.392 -1.655 1.00 0.00 C ATOM 2113 CG1 ILE A 140 -5.071 -11.829 -0.346 1.00 0.00 C ATOM 2114 CG2 ILE A 140 -5.557 -13.232 -2.379 1.00 0.00 C ATOM 2115 CD1 ILE A 140 -6.408 -11.105 -0.529 1.00 0.00 C ATOM 0 H ILE A 140 -2.102 -11.452 -1.355 1.00 0.00 H new ATOM 0 HA ILE A 140 -3.573 -13.895 -0.530 1.00 0.00 H new ATOM 0 HB ILE A 140 -4.209 -11.588 -2.335 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -5.203 -12.645 0.364 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -4.350 -11.139 0.093 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -6.424 -12.609 -2.600 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -5.143 -13.621 -3.309 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -5.861 -14.063 -1.742 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -6.756 -10.734 0.435 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -6.277 -10.267 -1.214 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -7.144 -11.797 -0.939 1.00 0.00 H new ATOM 2127 N PRO A 141 -2.932 -15.329 -2.602 1.00 0.00 N ATOM 2128 CA PRO A 141 -2.398 -16.146 -3.679 1.00 0.00 C ATOM 2129 C PRO A 141 -2.497 -15.475 -5.051 1.00 0.00 C ATOM 2130 O PRO A 141 -3.550 -14.959 -5.421 1.00 0.00 O ATOM 2131 CB PRO A 141 -3.170 -17.465 -3.623 1.00 0.00 C ATOM 2132 CG PRO A 141 -3.487 -17.604 -2.135 1.00 0.00 C ATOM 2133 CD PRO A 141 -3.708 -16.157 -1.687 1.00 0.00 C ATOM 0 HA PRO A 141 -1.328 -16.304 -3.543 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -4.076 -17.430 -4.229 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -2.573 -18.300 -3.990 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -4.373 -18.217 -1.968 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -2.667 -18.073 -1.591 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -4.765 -15.894 -1.725 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -3.380 -16.013 -0.657 1.00 0.00 H new ATOM 2141 N GLY A 142 -1.382 -15.435 -5.781 1.00 0.00 N ATOM 2142 CA GLY A 142 -1.313 -14.856 -7.114 1.00 0.00 C ATOM 2143 C GLY A 142 -1.189 -13.330 -7.127 1.00 0.00 C ATOM 2144 O GLY A 142 -0.670 -12.776 -8.093 1.00 0.00 O ATOM 0 H GLY A 142 -0.492 -15.810 -5.454 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -0.460 -15.284 -7.640 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -2.206 -15.142 -7.669 1.00 0.00 H new ATOM 2148 N HIS A 143 -1.635 -12.619 -6.088 1.00 0.00 N ATOM 2149 CA HIS A 143 -1.683 -11.160 -6.128 1.00 0.00 C ATOM 2150 C HIS A 143 -0.279 -10.551 -6.221 1.00 0.00 C ATOM 2151 O HIS A 143 -0.003 -9.745 -7.117 1.00 0.00 O ATOM 2152 CB HIS A 143 -2.480 -10.625 -4.935 1.00 0.00 C ATOM 2153 CG HIS A 143 -3.976 -10.855 -5.006 1.00 0.00 C ATOM 2154 ND1 HIS A 143 -4.934 -10.068 -4.367 1.00 0.00 N ATOM 2155 CD2 HIS A 143 -4.621 -11.846 -5.697 1.00 0.00 C ATOM 2156 CE1 HIS A 143 -6.123 -10.599 -4.679 1.00 0.00 C ATOM 2157 NE2 HIS A 143 -5.966 -11.669 -5.475 1.00 0.00 N ATOM 0 H HIS A 143 -1.966 -13.029 -5.215 1.00 0.00 H new ATOM 0 HA HIS A 143 -2.204 -10.853 -7.035 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -2.099 -11.090 -4.026 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -2.297 -9.554 -4.846 1.00 0.00 H new ATOM 0 HD1 HIS A 143 -4.763 -9.252 -3.780 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -4.162 -12.616 -6.299 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -7.075 -10.220 -4.338 1.00 0.00 H new ATOM 2165 N ALA A 144 0.614 -10.948 -5.310 1.00 0.00 N ATOM 2166 CA ALA A 144 2.010 -10.527 -5.360 1.00 0.00 C ATOM 2167 C ALA A 144 2.634 -10.909 -6.706 1.00 0.00 C ATOM 2168 O ALA A 144 3.346 -10.111 -7.305 1.00 0.00 O ATOM 2169 CB ALA A 144 2.805 -11.137 -4.204 1.00 0.00 C ATOM 0 H ALA A 144 0.390 -11.563 -4.527 1.00 0.00 H new ATOM 0 HA ALA A 144 2.045 -9.442 -5.257 1.00 0.00 H new ATOM 0 HB1 ALA A 144 3.843 -10.809 -4.263 1.00 0.00 H new ATOM 0 HB2 ALA A 144 2.375 -10.813 -3.256 1.00 0.00 H new ATOM 0 HB3 ALA A 144 2.764 -12.224 -4.268 1.00 0.00 H new ATOM 2175 N ALA A 145 2.372 -12.133 -7.176 1.00 0.00 N ATOM 2176 CA ALA A 145 2.922 -12.631 -8.431 1.00 0.00 C ATOM 2177 C ALA A 145 2.476 -11.777 -9.622 1.00 0.00 C ATOM 2178 O ALA A 145 3.279 -11.483 -10.503 1.00 0.00 O ATOM 2179 CB ALA A 145 2.542 -14.103 -8.629 1.00 0.00 C ATOM 0 H ALA A 145 1.772 -12.802 -6.694 1.00 0.00 H new ATOM 0 HA ALA A 145 4.008 -12.559 -8.377 1.00 0.00 H new ATOM 0 HB1 ALA A 145 2.959 -14.463 -9.570 1.00 0.00 H new ATOM 0 HB2 ALA A 145 2.940 -14.696 -7.805 1.00 0.00 H new ATOM 0 HB3 ALA A 145 1.456 -14.198 -8.653 1.00 0.00 H new ATOM 2185 N THR A 146 1.196 -11.393 -9.663 1.00 0.00 N ATOM 2186 CA THR A 146 0.631 -10.684 -10.803 1.00 0.00 C ATOM 2187 C THR A 146 0.996 -9.199 -10.787 1.00 0.00 C ATOM 2188 O THR A 146 1.598 -8.713 -11.742 1.00 0.00 O ATOM 2189 CB THR A 146 -0.889 -10.887 -10.874 1.00 0.00 C ATOM 2190 OG1 THR A 146 -1.491 -10.628 -9.623 1.00 0.00 O ATOM 2191 CG2 THR A 146 -1.240 -12.311 -11.318 1.00 0.00 C ATOM 0 H THR A 146 0.531 -11.566 -8.909 1.00 0.00 H new ATOM 0 HA THR A 146 1.070 -11.109 -11.705 1.00 0.00 H new ATOM 0 HB THR A 146 -1.273 -10.182 -11.611 1.00 0.00 H new ATOM 0 HG1 THR A 146 -1.355 -11.396 -9.029 1.00 0.00 H new ATOM 0 HG21 THR A 146 -2.323 -12.423 -11.358 1.00 0.00 H new ATOM 0 HG22 THR A 146 -0.819 -12.498 -12.306 1.00 0.00 H new ATOM 0 HG23 THR A 146 -0.828 -13.026 -10.606 1.00 0.00 H new ATOM 2199 N GLY A 147 0.615 -8.454 -9.744 1.00 0.00 N ATOM 2200 CA GLY A 147 0.849 -7.011 -9.772 1.00 0.00 C ATOM 2201 C GLY A 147 0.401 -6.261 -8.524 1.00 0.00 C ATOM 2202 O GLY A 147 -0.008 -5.103 -8.615 1.00 0.00 O ATOM 0 H GLY A 147 0.161 -8.810 -8.903 1.00 0.00 H new ATOM 0 HA2 GLY A 147 1.914 -6.834 -9.921 1.00 0.00 H new ATOM 0 HA3 GLY A 147 0.332 -6.591 -10.635 1.00 0.00 H new ATOM 2206 N MET A 148 0.454 -6.897 -7.354 1.00 0.00 N ATOM 2207 CA MET A 148 0.176 -6.216 -6.102 1.00 0.00 C ATOM 2208 C MET A 148 1.474 -6.117 -5.305 1.00 0.00 C ATOM 2209 O MET A 148 1.595 -6.784 -4.276 1.00 0.00 O ATOM 2210 CB MET A 148 -0.915 -6.969 -5.336 1.00 0.00 C ATOM 2211 CG MET A 148 -2.209 -7.107 -6.144 1.00 0.00 C ATOM 2212 SD MET A 148 -3.781 -6.950 -5.242 1.00 0.00 S ATOM 2213 CE MET A 148 -3.765 -5.185 -4.922 1.00 0.00 C ATOM 0 H MET A 148 0.688 -7.885 -7.253 1.00 0.00 H new ATOM 0 HA MET A 148 -0.195 -5.207 -6.282 1.00 0.00 H new ATOM 0 HB2 MET A 148 -0.549 -7.961 -5.070 1.00 0.00 H new ATOM 0 HB3 MET A 148 -1.127 -6.446 -4.403 1.00 0.00 H new ATOM 0 HG2 MET A 148 -2.196 -6.354 -6.932 1.00 0.00 H new ATOM 0 HG3 MET A 148 -2.198 -8.081 -6.634 1.00 0.00 H new ATOM 0 HE1 MET A 148 -4.186 -4.990 -3.935 1.00 0.00 H new ATOM 0 HE2 MET A 148 -2.739 -4.818 -4.958 1.00 0.00 H new ATOM 0 HE3 MET A 148 -4.360 -4.673 -5.678 1.00 0.00 H new ATOM 2223 N PHE A 149 2.438 -5.308 -5.773 1.00 0.00 N ATOM 2224 CA PHE A 149 3.747 -5.197 -5.137 1.00 0.00 C ATOM 2225 C PHE A 149 4.482 -3.890 -5.479 1.00 0.00 C ATOM 2226 O PHE A 149 3.943 -3.034 -6.174 1.00 0.00 O ATOM 2227 CB PHE A 149 4.585 -6.425 -5.522 1.00 0.00 C ATOM 2228 CG PHE A 149 4.984 -6.506 -6.988 1.00 0.00 C ATOM 2229 CD1 PHE A 149 6.191 -5.936 -7.437 1.00 0.00 C ATOM 2230 CD2 PHE A 149 4.177 -7.217 -7.894 1.00 0.00 C ATOM 2231 CE1 PHE A 149 6.610 -6.123 -8.766 1.00 0.00 C ATOM 2232 CE2 PHE A 149 4.618 -7.446 -9.209 1.00 0.00 C ATOM 2233 CZ PHE A 149 5.832 -6.893 -9.647 1.00 0.00 C ATOM 0 H PHE A 149 2.327 -4.719 -6.598 1.00 0.00 H new ATOM 0 HA PHE A 149 3.597 -5.166 -4.058 1.00 0.00 H new ATOM 0 HB2 PHE A 149 5.490 -6.431 -4.915 1.00 0.00 H new ATOM 0 HB3 PHE A 149 4.023 -7.323 -5.265 1.00 0.00 H new ATOM 0 HD1 PHE A 149 6.797 -5.354 -6.758 1.00 0.00 H new ATOM 0 HD2 PHE A 149 3.214 -7.589 -7.578 1.00 0.00 H new ATOM 0 HE1 PHE A 149 7.530 -5.675 -9.110 1.00 0.00 H new ATOM 0 HE2 PHE A 149 4.024 -8.047 -9.882 1.00 0.00 H new ATOM 0 HZ PHE A 149 6.167 -7.059 -10.660 1.00 0.00 H new ATOM 2243 N GLY A 150 5.714 -3.726 -4.979 1.00 0.00 N ATOM 2244 CA GLY A 150 6.608 -2.615 -5.305 1.00 0.00 C ATOM 2245 C GLY A 150 7.771 -2.591 -4.320 1.00 0.00 C ATOM 2246 O GLY A 150 7.726 -3.282 -3.300 1.00 0.00 O ATOM 0 H GLY A 150 6.125 -4.384 -4.317 1.00 0.00 H new ATOM 0 HA2 GLY A 150 6.982 -2.722 -6.323 1.00 0.00 H new ATOM 0 HA3 GLY A 150 6.063 -1.672 -5.264 1.00 0.00 H new ATOM 2250 N LYS A 151 8.826 -1.837 -4.647 1.00 0.00 N ATOM 2251 CA LYS A 151 10.059 -1.791 -3.870 1.00 0.00 C ATOM 2252 C LYS A 151 10.063 -0.537 -2.992 1.00 0.00 C ATOM 2253 O LYS A 151 9.492 0.485 -3.373 1.00 0.00 O ATOM 2254 CB LYS A 151 11.295 -1.834 -4.787 1.00 0.00 C ATOM 2255 CG LYS A 151 11.075 -2.594 -6.105 1.00 0.00 C ATOM 2256 CD LYS A 151 12.403 -2.903 -6.814 1.00 0.00 C ATOM 2257 CE LYS A 151 13.145 -1.661 -7.328 1.00 0.00 C ATOM 2258 NZ LYS A 151 12.390 -0.953 -8.377 1.00 0.00 N ATOM 0 H LYS A 151 8.843 -1.235 -5.471 1.00 0.00 H new ATOM 0 HA LYS A 151 10.106 -2.670 -3.228 1.00 0.00 H new ATOM 0 HB2 LYS A 151 11.599 -0.813 -5.016 1.00 0.00 H new ATOM 0 HB3 LYS A 151 12.119 -2.299 -4.246 1.00 0.00 H new ATOM 0 HG2 LYS A 151 10.545 -3.525 -5.904 1.00 0.00 H new ATOM 0 HG3 LYS A 151 10.440 -2.002 -6.764 1.00 0.00 H new ATOM 0 HD2 LYS A 151 13.053 -3.442 -6.125 1.00 0.00 H new ATOM 0 HD3 LYS A 151 12.207 -3.569 -7.654 1.00 0.00 H new ATOM 0 HE2 LYS A 151 13.331 -0.982 -6.496 1.00 0.00 H new ATOM 0 HE3 LYS A 151 14.117 -1.958 -7.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 13.027 -0.311 -8.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 11.987 -1.644 -9.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 11.622 -0.403 -7.941 1.00 0.00 H new ATOM 2272 N ILE A 152 10.712 -0.610 -1.830 1.00 0.00 N ATOM 2273 CA ILE A 152 10.846 0.459 -0.856 1.00 0.00 C ATOM 2274 C ILE A 152 12.343 0.637 -0.575 1.00 0.00 C ATOM 2275 O ILE A 152 12.906 -0.049 0.274 1.00 0.00 O ATOM 2276 CB ILE A 152 10.078 0.099 0.431 1.00 0.00 C ATOM 2277 CG1 ILE A 152 8.637 -0.362 0.176 1.00 0.00 C ATOM 2278 CG2 ILE A 152 10.090 1.287 1.394 1.00 0.00 C ATOM 2279 CD1 ILE A 152 7.834 -0.546 1.466 1.00 0.00 C ATOM 0 H ILE A 152 11.182 -1.465 -1.532 1.00 0.00 H new ATOM 0 HA ILE A 152 10.425 1.390 -1.235 1.00 0.00 H new ATOM 0 HB ILE A 152 10.596 -0.751 0.876 1.00 0.00 H new ATOM 0 HG12 ILE A 152 8.134 0.368 -0.458 1.00 0.00 H new ATOM 0 HG13 ILE A 152 8.654 -1.303 -0.373 1.00 0.00 H new ATOM 0 HG21 ILE A 152 9.545 1.025 2.301 1.00 0.00 H new ATOM 0 HG22 ILE A 152 11.120 1.539 1.649 1.00 0.00 H new ATOM 0 HG23 ILE A 152 9.614 2.145 0.919 1.00 0.00 H new ATOM 0 HD11 ILE A 152 6.823 -0.873 1.222 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.317 -1.297 2.091 1.00 0.00 H new ATOM 0 HD13 ILE A 152 7.789 0.400 2.005 1.00 0.00 H new ATOM 2291 N VAL A 153 13.009 1.552 -1.276 1.00 0.00 N ATOM 2292 CA VAL A 153 14.405 1.863 -1.016 1.00 0.00 C ATOM 2293 C VAL A 153 14.468 2.798 0.188 1.00 0.00 C ATOM 2294 O VAL A 153 14.325 4.014 0.044 1.00 0.00 O ATOM 2295 CB VAL A 153 15.060 2.493 -2.252 1.00 0.00 C ATOM 2296 CG1 VAL A 153 16.562 2.688 -1.996 1.00 0.00 C ATOM 2297 CG2 VAL A 153 14.877 1.602 -3.487 1.00 0.00 C ATOM 0 H VAL A 153 12.596 2.094 -2.035 1.00 0.00 H new ATOM 0 HA VAL A 153 14.960 0.951 -0.796 1.00 0.00 H new ATOM 0 HB VAL A 153 14.580 3.454 -2.438 1.00 0.00 H new ATOM 0 HG11 VAL A 153 17.026 3.136 -2.875 1.00 0.00 H new ATOM 0 HG12 VAL A 153 16.703 3.345 -1.137 1.00 0.00 H new ATOM 0 HG13 VAL A 153 17.025 1.722 -1.794 1.00 0.00 H new ATOM 0 HG21 VAL A 153 15.351 2.073 -4.349 1.00 0.00 H new ATOM 0 HG22 VAL A 153 15.336 0.630 -3.306 1.00 0.00 H new ATOM 0 HG23 VAL A 153 13.813 1.469 -3.685 1.00 0.00 H new ATOM 2307 N VAL A 154 14.686 2.238 1.375 1.00 0.00 N ATOM 2308 CA VAL A 154 14.853 3.024 2.583 1.00 0.00 C ATOM 2309 C VAL A 154 16.324 3.421 2.672 1.00 0.00 C ATOM 2310 O VAL A 154 17.137 2.667 3.196 1.00 0.00 O ATOM 2311 CB VAL A 154 14.368 2.227 3.804 1.00 0.00 C ATOM 2312 CG1 VAL A 154 14.403 3.119 5.051 1.00 0.00 C ATOM 2313 CG2 VAL A 154 12.934 1.727 3.593 1.00 0.00 C ATOM 0 H VAL A 154 14.751 1.231 1.521 1.00 0.00 H new ATOM 0 HA VAL A 154 14.249 3.931 2.560 1.00 0.00 H new ATOM 0 HB VAL A 154 15.029 1.370 3.936 1.00 0.00 H new ATOM 0 HG11 VAL A 154 14.058 2.550 5.915 1.00 0.00 H new ATOM 0 HG12 VAL A 154 15.423 3.461 5.225 1.00 0.00 H new ATOM 0 HG13 VAL A 154 13.752 3.980 4.901 1.00 0.00 H new ATOM 0 HG21 VAL A 154 12.612 1.166 4.470 1.00 0.00 H new ATOM 0 HG22 VAL A 154 12.270 2.578 3.443 1.00 0.00 H new ATOM 0 HG23 VAL A 154 12.899 1.081 2.716 1.00 0.00 H new ATOM 2323 N LYS A 155 16.695 4.576 2.123 1.00 0.00 N ATOM 2324 CA LYS A 155 18.060 5.082 2.203 1.00 0.00 C ATOM 2325 C LYS A 155 18.027 6.605 2.229 1.00 0.00 C ATOM 2326 O LYS A 155 17.905 7.201 3.299 1.00 0.00 O ATOM 2327 CB LYS A 155 18.922 4.572 1.038 1.00 0.00 C ATOM 2328 CG LYS A 155 19.017 3.043 0.938 1.00 0.00 C ATOM 2329 CD LYS A 155 19.966 2.641 -0.197 1.00 0.00 C ATOM 2330 CE LYS A 155 20.051 1.114 -0.303 1.00 0.00 C ATOM 2331 NZ LYS A 155 20.928 0.701 -1.412 1.00 0.00 N ATOM 0 H LYS A 155 16.057 5.185 1.611 1.00 0.00 H new ATOM 0 HA LYS A 155 18.517 4.712 3.121 1.00 0.00 H new ATOM 0 HB2 LYS A 155 18.515 4.960 0.104 1.00 0.00 H new ATOM 0 HB3 LYS A 155 19.928 4.980 1.141 1.00 0.00 H new ATOM 0 HG2 LYS A 155 19.374 2.632 1.882 1.00 0.00 H new ATOM 0 HG3 LYS A 155 18.028 2.621 0.760 1.00 0.00 H new ATOM 0 HD2 LYS A 155 19.614 3.059 -1.140 1.00 0.00 H new ATOM 0 HD3 LYS A 155 20.958 3.056 -0.015 1.00 0.00 H new ATOM 0 HE2 LYS A 155 20.428 0.703 0.634 1.00 0.00 H new ATOM 0 HE3 LYS A 155 19.053 0.702 -0.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 20.965 -0.337 -1.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 20.554 1.074 -2.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 21.886 1.075 -1.255 1.00 0.00 H new