USER MOD reduce.3.24.130724 H: found=0, std=0, add=1205, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1205 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: B 63 ASN : amide:sc= 0.908 K(o=3,f=0.94) USER MOD Set 1.2: B 64 LYS NZ :NH3+ -164:sc= 0.687 (180deg=-0.0323) USER MOD Set 1.3: B 66 GLN : amide:sc= 1.39 K(o=3,f=-3.4) USER MOD Set 2.1: B 35 LYS NZ :NH3+ -169:sc= 0.844 (180deg=0) USER MOD Set 2.2: B 39 GLN : amide:sc= 1.45 K(o=2.3,f=-3.2) USER MOD Set 3.1: B 26 LYS NZ :NH3+ -157:sc= 0.271 (180deg=-0.034) USER MOD Set 3.2: B 28 THR OG1 : rot 23:sc= 0.699 USER MOD Set 3.3: B 30 SER OG : rot -151:sc= 1.24 USER MOD Set 4.1: B 18 LYS NZ :NH3+ -124:sc= 1.16 (180deg=0.0129) USER MOD Set 4.2: B 19 TYR OH : rot 170:sc= 0.743 USER MOD Set 4.3: B 40 LYS NZ :NH3+ -174:sc= 0.791 (180deg=-0.0204) USER MOD Set 5.1: B 17 HIS : no HE2:sc= -1.87 K(o=-1.3,f=-6.8!) USER MOD Set 5.2: B 27 HIS : no HE2:sc= 0.537 K(o=-1.3,f=-4.2!) USER MOD Set 6.1: A 63 ASN : amide:sc= 0.744 K(o=1.6,f=-3.4!) USER MOD Set 6.2: A 64 LYS NZ :NH3+ -168:sc= 0.858 (180deg=-0.153) USER MOD Set 7.1: A 27 HIS : no HE2:sc= 1.76 K(o=3.1,f=-9.2!) USER MOD Set 7.2: B 84 TYR OH : rot -13:sc= 1.32 USER MOD Set 8.1: A 17 HIS : no HE2:sc= 0.932 K(o=2,f=-3.4!) USER MOD Set 8.2: A 26 LYS NZ :NH3+ 170:sc= 1.06 (180deg=0.691) USER MOD Single : A 3 SER OG : rot 25:sc= 0.109 USER MOD Single : A 7 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.33) USER MOD Single : A 18 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0545) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -93:sc= 1.18 USER MOD Single : A 22 LYS NZ :NH3+ 152:sc= 0.179 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 164:sc= 1.26 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 166:sc= 0.388 (180deg=0.289) USER MOD Single : A 32 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0296) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 40 LYS NZ :NH3+ 134:sc= 0.0845 (180deg=-0.0645) USER MOD Single : A 55 LYS NZ :NH3+ -173:sc= 0.498 (180deg=0.425) USER MOD Single : A 57 MET CE :methyl 177:sc= 0 (180deg=-0.0224) USER MOD Single : A 66 GLN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.758 K(o=0.76,f=-4.9!) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 TYR OH : rot 80:sc= 0 USER MOD Single : A 75 THR OG1 : rot 77:sc= 1.16 USER MOD Single : A 82 MET CE :methyl 178:sc= 0 (180deg=-0.0117) USER MOD Single : A 84 TYR OH : rot 15:sc= 0.942 USER MOD Single : A 85 ASN : amide:sc= -0.448 X(o=-0.45,f=-0.2) USER MOD Single : B 3 SER OG : rot 180:sc= 0.00195 USER MOD Single : B 7 GLN : amide:sc= -0.0623 K(o=-0.062,f=-0.86) USER MOD Single : B 20 SER OG : rot -80:sc= 0.712 USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 LYS NZ :NH3+ -176:sc= 1.57 (180deg=1.53) USER MOD Single : B 32 LYS NZ :NH3+ -175:sc=-0.00175 (180deg=-0.0397) USER MOD Single : B 57 MET CE :methyl 171:sc= -0.147 (180deg=-0.542) USER MOD Single : B 69 ASN : amide:sc= 0.21 K(o=0.21,f=-3.6!) USER MOD Single : B 71 GLN : amide:sc= -0.561 K(o=-0.56,f=-4.9!) USER MOD Single : B 73 TYR OH : rot 160:sc= 1.01 USER MOD Single : B 75 THR OG1 : rot -77:sc= 1.02 USER MOD Single : B 82 MET CE :methyl 172:sc= -0.189 (180deg=-0.301) USER MOD Single : B 85 ASN : amide:sc= 0.576 K(o=0.58,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -12.759 6.586 9.613 1.00 0.00 N ATOM 31 CA SER A 3 -12.353 7.693 8.760 1.00 0.00 C ATOM 32 C SER A 3 -11.953 7.151 7.381 1.00 0.00 C ATOM 33 O SER A 3 -11.277 6.122 7.332 1.00 0.00 O ATOM 34 CB SER A 3 -11.185 8.457 9.385 1.00 0.00 C ATOM 35 OG SER A 3 -11.529 8.908 10.678 1.00 0.00 O ATOM 0 HA SER A 3 -13.190 8.383 8.652 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.308 7.813 9.439 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.919 9.306 8.755 1.00 0.00 H new ATOM 0 HG SER A 3 -12.237 8.339 11.046 1.00 0.00 H new ATOM 41 N PRO A 4 -12.337 7.819 6.277 1.00 0.00 N ATOM 42 CA PRO A 4 -12.194 7.319 4.916 1.00 0.00 C ATOM 43 C PRO A 4 -10.908 6.539 4.634 1.00 0.00 C ATOM 44 O PRO A 4 -10.970 5.412 4.152 1.00 0.00 O ATOM 45 CB PRO A 4 -12.345 8.544 4.018 1.00 0.00 C ATOM 46 CG PRO A 4 -13.361 9.386 4.787 1.00 0.00 C ATOM 47 CD PRO A 4 -13.028 9.103 6.254 1.00 0.00 C ATOM 0 HA PRO A 4 -12.957 6.565 4.724 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -11.399 9.069 3.884 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -12.706 8.278 3.024 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -13.264 10.446 4.551 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -14.384 9.098 4.546 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -12.399 9.891 6.669 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -13.934 9.068 6.859 1.00 0.00 H new ATOM 55 N LEU A 5 -9.743 7.120 4.936 1.00 0.00 N ATOM 56 CA LEU A 5 -8.474 6.449 4.685 1.00 0.00 C ATOM 57 C LEU A 5 -8.405 5.097 5.397 1.00 0.00 C ATOM 58 O LEU A 5 -8.127 4.083 4.763 1.00 0.00 O ATOM 59 CB LEU A 5 -7.273 7.367 4.972 1.00 0.00 C ATOM 60 CG LEU A 5 -6.939 7.664 6.447 1.00 0.00 C ATOM 61 CD1 LEU A 5 -5.653 8.495 6.491 1.00 0.00 C ATOM 62 CD2 LEU A 5 -8.040 8.444 7.179 1.00 0.00 C ATOM 0 H LEU A 5 -9.657 8.047 5.352 1.00 0.00 H new ATOM 0 HA LEU A 5 -8.416 6.225 3.620 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -6.392 6.921 4.511 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -7.449 8.318 4.469 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.833 6.704 6.952 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.398 8.717 7.527 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.841 7.933 6.030 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -5.804 9.427 5.947 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.738 8.618 8.212 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -8.200 9.401 6.682 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.965 7.868 7.164 1.00 0.00 H new ATOM 74 N ASP A 6 -8.707 5.056 6.698 1.00 0.00 N ATOM 75 CA ASP A 6 -8.669 3.813 7.455 1.00 0.00 C ATOM 76 C ASP A 6 -9.774 2.881 6.995 1.00 0.00 C ATOM 77 O ASP A 6 -9.593 1.671 7.007 1.00 0.00 O ATOM 78 CB ASP A 6 -8.797 4.073 8.955 1.00 0.00 C ATOM 79 CG ASP A 6 -8.749 2.772 9.761 1.00 0.00 C ATOM 80 OD1 ASP A 6 -7.644 2.195 9.876 1.00 0.00 O ATOM 81 OD2 ASP A 6 -9.826 2.365 10.248 1.00 0.00 O ATOM 0 H ASP A 6 -8.980 5.873 7.244 1.00 0.00 H new ATOM 0 HA ASP A 6 -7.704 3.341 7.272 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -7.992 4.732 9.280 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -9.735 4.591 9.156 1.00 0.00 H new ATOM 86 N GLN A 7 -10.918 3.427 6.588 1.00 0.00 N ATOM 87 CA GLN A 7 -12.007 2.614 6.088 1.00 0.00 C ATOM 88 C GLN A 7 -11.610 1.918 4.783 1.00 0.00 C ATOM 89 O GLN A 7 -11.954 0.753 4.574 1.00 0.00 O ATOM 90 CB GLN A 7 -13.261 3.481 5.920 1.00 0.00 C ATOM 91 CG GLN A 7 -14.511 2.662 5.586 1.00 0.00 C ATOM 92 CD GLN A 7 -14.746 1.563 6.616 1.00 0.00 C ATOM 93 OE1 GLN A 7 -15.366 1.799 7.650 1.00 0.00 O ATOM 94 NE2 GLN A 7 -14.215 0.371 6.359 1.00 0.00 N ATOM 0 H GLN A 7 -11.108 4.429 6.597 1.00 0.00 H new ATOM 0 HA GLN A 7 -12.233 1.828 6.809 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -13.435 4.042 6.839 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -13.089 4.211 5.129 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -15.380 3.319 5.548 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -14.404 2.218 4.596 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -13.707 0.216 5.488 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -14.315 -0.388 7.033 1.00 0.00 H new ATOM 103 N ALA A 8 -10.903 2.637 3.909 1.00 0.00 N ATOM 104 CA ALA A 8 -10.511 2.164 2.587 1.00 0.00 C ATOM 105 C ALA A 8 -9.346 1.184 2.709 1.00 0.00 C ATOM 106 O ALA A 8 -9.384 0.078 2.167 1.00 0.00 O ATOM 107 CB ALA A 8 -10.145 3.361 1.708 1.00 0.00 C ATOM 0 H ALA A 8 -10.582 3.584 4.108 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.342 1.636 2.120 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.851 3.010 0.719 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -11.006 4.023 1.617 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -9.316 3.905 2.161 1.00 0.00 H new ATOM 113 N ILE A 9 -8.318 1.581 3.461 1.00 0.00 N ATOM 114 CA ILE A 9 -7.237 0.694 3.860 1.00 0.00 C ATOM 115 C ILE A 9 -7.848 -0.555 4.499 1.00 0.00 C ATOM 116 O ILE A 9 -7.505 -1.675 4.140 1.00 0.00 O ATOM 117 CB ILE A 9 -6.286 1.443 4.814 1.00 0.00 C ATOM 118 CG1 ILE A 9 -5.492 2.489 4.004 1.00 0.00 C ATOM 119 CG2 ILE A 9 -5.387 0.456 5.571 1.00 0.00 C ATOM 120 CD1 ILE A 9 -4.571 3.359 4.865 1.00 0.00 C ATOM 0 H ILE A 9 -8.216 2.534 3.810 1.00 0.00 H new ATOM 0 HA ILE A 9 -6.645 0.379 3.001 1.00 0.00 H new ATOM 0 HB ILE A 9 -6.854 1.973 5.579 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.894 1.976 3.251 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -6.192 3.132 3.471 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -4.724 1.006 6.239 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -6.006 -0.226 6.155 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -4.792 -0.115 4.858 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -4.045 4.071 4.230 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.165 3.900 5.601 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -3.847 2.726 5.378 1.00 0.00 H new ATOM 132 N GLY A 10 -8.785 -0.350 5.424 1.00 0.00 N ATOM 133 CA GLY A 10 -9.522 -1.399 6.095 1.00 0.00 C ATOM 134 C GLY A 10 -10.166 -2.347 5.092 1.00 0.00 C ATOM 135 O GLY A 10 -10.003 -3.557 5.207 1.00 0.00 O ATOM 0 H GLY A 10 -9.054 0.585 5.731 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -8.852 -1.957 6.749 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.291 -0.958 6.729 1.00 0.00 H new ATOM 139 N LEU A 11 -10.880 -1.810 4.097 1.00 0.00 N ATOM 140 CA LEU A 11 -11.465 -2.614 3.034 1.00 0.00 C ATOM 141 C LEU A 11 -10.386 -3.457 2.343 1.00 0.00 C ATOM 142 O LEU A 11 -10.530 -4.676 2.265 1.00 0.00 O ATOM 143 CB LEU A 11 -12.234 -1.719 2.050 1.00 0.00 C ATOM 144 CG LEU A 11 -12.870 -2.480 0.874 1.00 0.00 C ATOM 145 CD1 LEU A 11 -13.905 -3.509 1.343 1.00 0.00 C ATOM 146 CD2 LEU A 11 -13.549 -1.476 -0.065 1.00 0.00 C ATOM 0 H LEU A 11 -11.064 -0.810 4.011 1.00 0.00 H new ATOM 0 HA LEU A 11 -12.185 -3.311 3.463 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.017 -1.190 2.593 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.554 -0.964 1.655 1.00 0.00 H new ATOM 0 HG LEU A 11 -12.076 -3.019 0.358 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -14.327 -4.021 0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -13.424 -4.237 1.997 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -14.701 -3.002 1.888 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -14.002 -2.009 -0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -14.321 -0.933 0.480 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -12.807 -0.772 -0.442 1.00 0.00 H new ATOM 158 N LEU A 12 -9.308 -2.824 1.861 1.00 0.00 N ATOM 159 CA LEU A 12 -8.211 -3.522 1.186 1.00 0.00 C ATOM 160 C LEU A 12 -7.690 -4.676 2.054 1.00 0.00 C ATOM 161 O LEU A 12 -7.644 -5.833 1.631 1.00 0.00 O ATOM 162 CB LEU A 12 -7.077 -2.539 0.853 1.00 0.00 C ATOM 163 CG LEU A 12 -5.981 -3.191 -0.012 1.00 0.00 C ATOM 164 CD1 LEU A 12 -6.357 -3.158 -1.498 1.00 0.00 C ATOM 165 CD2 LEU A 12 -4.638 -2.487 0.198 1.00 0.00 C ATOM 0 H LEU A 12 -9.174 -1.815 1.929 1.00 0.00 H new ATOM 0 HA LEU A 12 -8.589 -3.941 0.254 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.488 -1.677 0.328 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.636 -2.168 1.778 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.890 -4.232 0.299 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -5.565 -3.625 -2.084 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -7.289 -3.702 -1.650 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -6.484 -2.124 -1.818 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.877 -2.962 -0.421 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -4.730 -1.437 -0.081 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -4.349 -2.559 1.247 1.00 0.00 H new ATOM 177 N ILE A 13 -7.292 -4.342 3.283 1.00 0.00 N ATOM 178 CA ILE A 13 -6.798 -5.298 4.258 1.00 0.00 C ATOM 179 C ILE A 13 -7.819 -6.424 4.426 1.00 0.00 C ATOM 180 O ILE A 13 -7.442 -7.589 4.397 1.00 0.00 O ATOM 181 CB ILE A 13 -6.474 -4.580 5.582 1.00 0.00 C ATOM 182 CG1 ILE A 13 -5.227 -3.690 5.413 1.00 0.00 C ATOM 183 CG2 ILE A 13 -6.227 -5.600 6.696 1.00 0.00 C ATOM 184 CD1 ILE A 13 -4.910 -2.866 6.666 1.00 0.00 C ATOM 0 H ILE A 13 -7.307 -3.382 3.628 1.00 0.00 H new ATOM 0 HA ILE A 13 -5.869 -5.750 3.911 1.00 0.00 H new ATOM 0 HB ILE A 13 -7.327 -3.957 5.853 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -4.369 -4.317 5.170 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -5.379 -3.016 4.570 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -5.999 -5.077 7.625 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -7.119 -6.212 6.833 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -5.387 -6.239 6.424 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -4.022 -2.259 6.487 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -5.754 -2.216 6.897 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -4.728 -3.536 7.506 1.00 0.00 H new ATOM 196 N GLY A 14 -9.099 -6.087 4.586 1.00 0.00 N ATOM 197 CA GLY A 14 -10.181 -7.042 4.752 1.00 0.00 C ATOM 198 C GLY A 14 -10.242 -8.029 3.590 1.00 0.00 C ATOM 199 O GLY A 14 -10.179 -9.240 3.798 1.00 0.00 O ATOM 0 H GLY A 14 -9.414 -5.117 4.603 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -10.046 -7.587 5.686 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.129 -6.509 4.828 1.00 0.00 H new ATOM 203 N ILE A 15 -10.367 -7.532 2.356 1.00 0.00 N ATOM 204 CA ILE A 15 -10.483 -8.419 1.202 1.00 0.00 C ATOM 205 C ILE A 15 -9.227 -9.282 1.044 1.00 0.00 C ATOM 206 O ILE A 15 -9.332 -10.449 0.678 1.00 0.00 O ATOM 207 CB ILE A 15 -10.879 -7.671 -0.084 1.00 0.00 C ATOM 208 CG1 ILE A 15 -9.818 -6.649 -0.517 1.00 0.00 C ATOM 209 CG2 ILE A 15 -12.250 -7.009 0.116 1.00 0.00 C ATOM 210 CD1 ILE A 15 -10.104 -6.023 -1.881 1.00 0.00 C ATOM 0 H ILE A 15 -10.390 -6.536 2.135 1.00 0.00 H new ATOM 0 HA ILE A 15 -11.311 -9.102 1.393 1.00 0.00 H new ATOM 0 HB ILE A 15 -10.945 -8.396 -0.895 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -9.757 -5.859 0.232 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -8.844 -7.137 -0.546 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -12.534 -6.478 -0.793 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -12.995 -7.774 0.337 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -12.196 -6.304 0.946 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -9.317 -5.311 -2.127 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -10.136 -6.804 -2.640 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -11.064 -5.507 -1.850 1.00 0.00 H new ATOM 222 N PHE A 16 -8.043 -8.742 1.355 1.00 0.00 N ATOM 223 CA PHE A 16 -6.831 -9.551 1.378 1.00 0.00 C ATOM 224 C PHE A 16 -6.959 -10.653 2.440 1.00 0.00 C ATOM 225 O PHE A 16 -6.853 -11.842 2.138 1.00 0.00 O ATOM 226 CB PHE A 16 -5.609 -8.648 1.603 1.00 0.00 C ATOM 227 CG PHE A 16 -4.274 -9.359 1.496 1.00 0.00 C ATOM 228 CD1 PHE A 16 -3.705 -9.603 0.232 1.00 0.00 C ATOM 229 CD2 PHE A 16 -3.602 -9.790 2.656 1.00 0.00 C ATOM 230 CE1 PHE A 16 -2.452 -10.232 0.128 1.00 0.00 C ATOM 231 CE2 PHE A 16 -2.367 -10.453 2.549 1.00 0.00 C ATOM 232 CZ PHE A 16 -1.784 -10.662 1.288 1.00 0.00 C ATOM 0 H PHE A 16 -7.904 -7.759 1.591 1.00 0.00 H new ATOM 0 HA PHE A 16 -6.692 -10.048 0.418 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -5.634 -7.837 0.875 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -5.686 -8.193 2.591 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -4.233 -9.306 -0.662 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -4.036 -9.611 3.629 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.003 -10.385 -0.842 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -1.865 -10.803 3.439 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.825 -11.152 1.210 1.00 0.00 H new ATOM 242 N HIS A 17 -7.239 -10.249 3.681 1.00 0.00 N ATOM 243 CA HIS A 17 -7.418 -11.110 4.840 1.00 0.00 C ATOM 244 C HIS A 17 -8.452 -12.207 4.575 1.00 0.00 C ATOM 245 O HIS A 17 -8.314 -13.307 5.100 1.00 0.00 O ATOM 246 CB HIS A 17 -7.780 -10.261 6.069 1.00 0.00 C ATOM 247 CG HIS A 17 -7.926 -11.036 7.357 1.00 0.00 C ATOM 248 ND1 HIS A 17 -7.471 -12.313 7.600 1.00 0.00 N ATOM 249 CD2 HIS A 17 -8.596 -10.622 8.477 1.00 0.00 C ATOM 250 CE1 HIS A 17 -7.874 -12.663 8.831 1.00 0.00 C ATOM 251 NE2 HIS A 17 -8.555 -11.663 9.410 1.00 0.00 N ATOM 0 H HIS A 17 -7.352 -9.262 3.911 1.00 0.00 H new ATOM 0 HA HIS A 17 -6.477 -11.621 5.043 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -7.012 -9.500 6.205 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -8.715 -9.738 5.869 1.00 0.00 H new ATOM 0 HD1 HIS A 17 -6.926 -12.889 6.959 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -9.072 -9.662 8.615 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -7.677 -13.619 9.293 1.00 0.00 H new ATOM 259 N LYS A 18 -9.471 -11.937 3.756 1.00 0.00 N ATOM 260 CA LYS A 18 -10.446 -12.952 3.375 1.00 0.00 C ATOM 261 C LYS A 18 -9.737 -14.214 2.869 1.00 0.00 C ATOM 262 O LYS A 18 -10.072 -15.320 3.285 1.00 0.00 O ATOM 263 CB LYS A 18 -11.414 -12.387 2.328 1.00 0.00 C ATOM 264 CG LYS A 18 -12.615 -13.314 2.104 1.00 0.00 C ATOM 265 CD LYS A 18 -13.552 -12.704 1.053 1.00 0.00 C ATOM 266 CE LYS A 18 -14.717 -13.642 0.715 1.00 0.00 C ATOM 267 NZ LYS A 18 -15.573 -13.905 1.885 1.00 0.00 N ATOM 0 H LYS A 18 -9.640 -11.019 3.344 1.00 0.00 H new ATOM 0 HA LYS A 18 -11.029 -13.234 4.252 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -11.766 -11.407 2.650 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -10.886 -12.242 1.386 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.273 -14.295 1.774 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -13.152 -13.462 3.041 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -13.944 -11.756 1.422 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -12.988 -12.484 0.147 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -15.317 -13.202 -0.081 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -14.324 -14.585 0.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -16.402 -14.459 1.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -15.034 -14.439 2.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -15.887 -13.002 2.295 1.00 0.00 H new ATOM 281 N TYR A 19 -8.749 -14.045 1.986 1.00 0.00 N ATOM 282 CA TYR A 19 -7.922 -15.134 1.478 1.00 0.00 C ATOM 283 C TYR A 19 -6.840 -15.475 2.500 1.00 0.00 C ATOM 284 O TYR A 19 -6.692 -16.627 2.932 1.00 0.00 O ATOM 285 CB TYR A 19 -7.316 -14.713 0.138 1.00 0.00 C ATOM 286 CG TYR A 19 -8.335 -14.590 -0.978 1.00 0.00 C ATOM 287 CD1 TYR A 19 -8.775 -15.737 -1.667 1.00 0.00 C ATOM 288 CD2 TYR A 19 -8.882 -13.334 -1.293 1.00 0.00 C ATOM 289 CE1 TYR A 19 -9.718 -15.618 -2.702 1.00 0.00 C ATOM 290 CE2 TYR A 19 -9.852 -13.222 -2.303 1.00 0.00 C ATOM 291 CZ TYR A 19 -10.257 -14.360 -3.019 1.00 0.00 C ATOM 292 OH TYR A 19 -11.195 -14.245 -4.001 1.00 0.00 O ATOM 0 H TYR A 19 -8.501 -13.134 1.601 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.524 -16.028 1.319 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -6.809 -13.756 0.263 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.558 -15.440 -0.153 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -8.387 -16.709 -1.400 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -8.556 -12.454 -0.758 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -10.028 -16.493 -3.253 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -10.287 -12.260 -2.529 1.00 0.00 H new ATOM 0 HH TYR A 19 -11.462 -13.306 -4.090 1.00 0.00 H new ATOM 302 N SER A 20 -6.092 -14.446 2.898 1.00 0.00 N ATOM 303 CA SER A 20 -5.070 -14.518 3.922 1.00 0.00 C ATOM 304 C SER A 20 -5.719 -14.593 5.305 1.00 0.00 C ATOM 305 O SER A 20 -5.545 -13.711 6.143 1.00 0.00 O ATOM 306 CB SER A 20 -4.117 -13.335 3.750 1.00 0.00 C ATOM 307 OG SER A 20 -3.587 -13.376 2.443 1.00 0.00 O ATOM 0 H SER A 20 -6.190 -13.513 2.499 1.00 0.00 H new ATOM 0 HA SER A 20 -4.476 -15.426 3.823 1.00 0.00 H new ATOM 0 HB2 SER A 20 -4.645 -12.396 3.916 1.00 0.00 H new ATOM 0 HB3 SER A 20 -3.315 -13.384 4.486 1.00 0.00 H new ATOM 0 HG SER A 20 -2.739 -13.868 2.449 1.00 0.00 H new ATOM 313 N GLY A 21 -6.487 -15.655 5.526 1.00 0.00 N ATOM 314 CA GLY A 21 -7.224 -15.914 6.746 1.00 0.00 C ATOM 315 C GLY A 21 -7.768 -17.331 6.668 1.00 0.00 C ATOM 316 O GLY A 21 -7.434 -18.169 7.501 1.00 0.00 O ATOM 0 H GLY A 21 -6.614 -16.386 4.827 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -6.576 -15.801 7.615 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -8.038 -15.198 6.860 1.00 0.00 H new ATOM 320 N LYS A 22 -8.574 -17.617 5.638 1.00 0.00 N ATOM 321 CA LYS A 22 -9.048 -18.976 5.412 1.00 0.00 C ATOM 322 C LYS A 22 -7.901 -19.896 4.986 1.00 0.00 C ATOM 323 O LYS A 22 -7.896 -21.070 5.348 1.00 0.00 O ATOM 324 CB LYS A 22 -10.225 -18.997 4.426 1.00 0.00 C ATOM 325 CG LYS A 22 -9.868 -18.563 2.998 1.00 0.00 C ATOM 326 CD LYS A 22 -11.140 -18.492 2.147 1.00 0.00 C ATOM 327 CE LYS A 22 -10.838 -17.853 0.789 1.00 0.00 C ATOM 328 NZ LYS A 22 -12.002 -17.912 -0.109 1.00 0.00 N ATOM 0 H LYS A 22 -8.905 -16.931 4.959 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.428 -19.368 6.355 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -10.637 -20.006 4.393 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -11.011 -18.344 4.805 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.376 -17.591 3.015 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -9.164 -19.269 2.558 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -11.545 -19.494 2.003 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -11.902 -17.912 2.668 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -10.541 -16.814 0.933 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -9.994 -18.364 0.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -11.965 -17.116 -0.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -11.989 -18.808 -0.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -12.876 -17.853 0.451 1.00 0.00 H new ATOM 342 N GLU A 23 -6.949 -19.374 4.199 1.00 0.00 N ATOM 343 CA GLU A 23 -5.833 -20.150 3.671 1.00 0.00 C ATOM 344 C GLU A 23 -4.495 -19.479 3.986 1.00 0.00 C ATOM 345 O GLU A 23 -3.639 -20.083 4.626 1.00 0.00 O ATOM 346 CB GLU A 23 -6.022 -20.341 2.162 1.00 0.00 C ATOM 347 CG GLU A 23 -7.108 -21.380 1.852 1.00 0.00 C ATOM 348 CD GLU A 23 -7.519 -21.321 0.385 1.00 0.00 C ATOM 349 OE1 GLU A 23 -6.706 -21.767 -0.452 1.00 0.00 O ATOM 350 OE2 GLU A 23 -8.630 -20.810 0.126 1.00 0.00 O ATOM 0 H GLU A 23 -6.938 -18.395 3.913 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.817 -21.128 4.152 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.289 -19.388 1.705 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -5.079 -20.656 1.714 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -6.740 -22.378 2.090 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.978 -21.202 2.484 1.00 0.00 H new ATOM 357 N GLY A 24 -4.282 -18.249 3.510 1.00 0.00 N ATOM 358 CA GLY A 24 -2.992 -17.593 3.695 1.00 0.00 C ATOM 359 C GLY A 24 -2.822 -17.171 5.157 1.00 0.00 C ATOM 360 O GLY A 24 -3.795 -16.815 5.819 1.00 0.00 O ATOM 0 H GLY A 24 -4.975 -17.698 3.003 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.187 -18.269 3.407 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.923 -16.720 3.046 1.00 0.00 H new ATOM 364 N ASP A 25 -1.594 -17.185 5.680 1.00 0.00 N ATOM 365 CA ASP A 25 -1.321 -17.021 7.110 1.00 0.00 C ATOM 366 C ASP A 25 -1.393 -15.561 7.587 1.00 0.00 C ATOM 367 O ASP A 25 -0.559 -15.142 8.393 1.00 0.00 O ATOM 368 CB ASP A 25 0.054 -17.638 7.430 1.00 0.00 C ATOM 369 CG ASP A 25 1.236 -16.814 6.910 1.00 0.00 C ATOM 370 OD1 ASP A 25 1.012 -15.986 5.999 1.00 0.00 O ATOM 371 OD2 ASP A 25 2.346 -17.018 7.445 1.00 0.00 O ATOM 0 H ASP A 25 -0.753 -17.312 5.117 1.00 0.00 H new ATOM 0 HA ASP A 25 -2.107 -17.542 7.656 1.00 0.00 H new ATOM 0 HB2 ASP A 25 0.149 -17.751 8.510 1.00 0.00 H new ATOM 0 HB3 ASP A 25 0.102 -18.638 6.999 1.00 0.00 H new ATOM 376 N LYS A 26 -2.341 -14.771 7.069 1.00 0.00 N ATOM 377 CA LYS A 26 -2.439 -13.316 7.234 1.00 0.00 C ATOM 378 C LYS A 26 -1.304 -12.576 6.513 1.00 0.00 C ATOM 379 O LYS A 26 -1.548 -11.631 5.768 1.00 0.00 O ATOM 380 CB LYS A 26 -2.582 -12.897 8.707 1.00 0.00 C ATOM 381 CG LYS A 26 -3.805 -13.563 9.358 1.00 0.00 C ATOM 382 CD LYS A 26 -3.927 -13.236 10.854 1.00 0.00 C ATOM 383 CE LYS A 26 -4.235 -11.764 11.161 1.00 0.00 C ATOM 384 NZ LYS A 26 -5.527 -11.339 10.596 1.00 0.00 N ATOM 0 H LYS A 26 -3.097 -15.147 6.496 1.00 0.00 H new ATOM 0 HA LYS A 26 -3.364 -13.009 6.747 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -1.681 -13.171 9.255 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.677 -11.813 8.772 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -4.709 -13.237 8.843 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.737 -14.643 9.230 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.713 -13.856 11.286 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.996 -13.510 11.350 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.245 -11.614 12.241 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -3.440 -11.136 10.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -5.775 -10.399 10.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.455 -11.296 9.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.264 -12.022 10.864 1.00 0.00 H new ATOM 398 N HIS A 27 -0.065 -13.011 6.727 1.00 0.00 N ATOM 399 CA HIS A 27 1.146 -12.367 6.258 1.00 0.00 C ATOM 400 C HIS A 27 1.438 -12.670 4.790 1.00 0.00 C ATOM 401 O HIS A 27 2.223 -11.948 4.177 1.00 0.00 O ATOM 402 CB HIS A 27 2.303 -12.807 7.160 1.00 0.00 C ATOM 403 CG HIS A 27 2.033 -12.505 8.614 1.00 0.00 C ATOM 404 ND1 HIS A 27 1.255 -13.259 9.469 1.00 0.00 N ATOM 405 CD2 HIS A 27 2.330 -11.332 9.252 1.00 0.00 C ATOM 406 CE1 HIS A 27 1.107 -12.554 10.603 1.00 0.00 C ATOM 407 NE2 HIS A 27 1.741 -11.372 10.518 1.00 0.00 N ATOM 0 H HIS A 27 0.124 -13.862 7.257 1.00 0.00 H new ATOM 0 HA HIS A 27 1.017 -11.286 6.315 1.00 0.00 H new ATOM 0 HB2 HIS A 27 2.472 -13.877 7.037 1.00 0.00 H new ATOM 0 HB3 HIS A 27 3.218 -12.302 6.849 1.00 0.00 H new ATOM 0 HD1 HIS A 27 0.864 -14.181 9.276 1.00 0.00 H new ATOM 0 HD2 HIS A 27 2.916 -10.519 8.849 1.00 0.00 H new ATOM 0 HE1 HIS A 27 0.553 -12.892 11.467 1.00 0.00 H new ATOM 415 N THR A 28 0.843 -13.716 4.210 1.00 0.00 N ATOM 416 CA THR A 28 1.031 -14.081 2.822 1.00 0.00 C ATOM 417 C THR A 28 -0.302 -14.550 2.240 1.00 0.00 C ATOM 418 O THR A 28 -1.274 -14.770 2.968 1.00 0.00 O ATOM 419 CB THR A 28 2.113 -15.169 2.692 1.00 0.00 C ATOM 420 OG1 THR A 28 1.590 -16.428 3.065 1.00 0.00 O ATOM 421 CG2 THR A 28 3.367 -14.904 3.533 1.00 0.00 C ATOM 0 H THR A 28 0.207 -14.338 4.710 1.00 0.00 H new ATOM 0 HA THR A 28 1.373 -13.213 2.259 1.00 0.00 H new ATOM 0 HB THR A 28 2.411 -15.156 1.644 1.00 0.00 H new ATOM 0 HG1 THR A 28 2.182 -17.138 2.739 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.081 -15.715 3.387 1.00 0.00 H new ATOM 0 HG22 THR A 28 3.820 -13.962 3.224 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.093 -14.847 4.587 1.00 0.00 H new ATOM 429 N LEU A 29 -0.327 -14.690 0.918 1.00 0.00 N ATOM 430 CA LEU A 29 -1.426 -15.200 0.111 1.00 0.00 C ATOM 431 C LEU A 29 -0.824 -16.243 -0.833 1.00 0.00 C ATOM 432 O LEU A 29 0.070 -15.915 -1.609 1.00 0.00 O ATOM 433 CB LEU A 29 -2.068 -14.014 -0.628 1.00 0.00 C ATOM 434 CG LEU A 29 -3.352 -14.365 -1.400 1.00 0.00 C ATOM 435 CD1 LEU A 29 -4.263 -13.133 -1.462 1.00 0.00 C ATOM 436 CD2 LEU A 29 -3.051 -14.819 -2.836 1.00 0.00 C ATOM 0 H LEU A 29 0.476 -14.432 0.345 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.214 -15.674 0.696 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.296 -13.231 0.096 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.341 -13.600 -1.326 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.838 -15.185 -0.872 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -5.173 -13.380 -2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -4.521 -12.820 -0.450 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -3.743 -12.321 -1.971 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.985 -15.057 -3.346 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -2.539 -14.019 -3.371 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.415 -15.704 -2.812 1.00 0.00 H new ATOM 448 N SER A 30 -1.263 -17.503 -0.743 1.00 0.00 N ATOM 449 CA SER A 30 -0.648 -18.620 -1.454 1.00 0.00 C ATOM 450 C SER A 30 -1.335 -18.893 -2.796 1.00 0.00 C ATOM 451 O SER A 30 -2.476 -18.482 -3.006 1.00 0.00 O ATOM 452 CB SER A 30 -0.601 -19.857 -0.553 1.00 0.00 C ATOM 453 OG SER A 30 0.092 -19.539 0.638 1.00 0.00 O ATOM 0 H SER A 30 -2.061 -17.774 -0.169 1.00 0.00 H new ATOM 0 HA SER A 30 0.379 -18.349 -1.698 1.00 0.00 H new ATOM 0 HB2 SER A 30 -1.612 -20.191 -0.321 1.00 0.00 H new ATOM 0 HB3 SER A 30 -0.104 -20.679 -1.069 1.00 0.00 H new ATOM 0 HG SER A 30 0.123 -20.328 1.219 1.00 0.00 H new ATOM 459 N LYS A 31 -0.627 -19.569 -3.710 1.00 0.00 N ATOM 460 CA LYS A 31 -1.038 -19.756 -5.100 1.00 0.00 C ATOM 461 C LYS A 31 -2.512 -20.144 -5.238 1.00 0.00 C ATOM 462 O LYS A 31 -3.226 -19.562 -6.051 1.00 0.00 O ATOM 463 CB LYS A 31 -0.131 -20.797 -5.781 1.00 0.00 C ATOM 464 CG LYS A 31 -0.221 -20.795 -7.316 1.00 0.00 C ATOM 465 CD LYS A 31 0.128 -19.450 -7.980 1.00 0.00 C ATOM 466 CE LYS A 31 1.452 -18.876 -7.459 1.00 0.00 C ATOM 467 NZ LYS A 31 1.827 -17.631 -8.150 1.00 0.00 N ATOM 0 H LYS A 31 0.267 -20.010 -3.495 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.927 -18.795 -5.602 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.902 -20.611 -5.487 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.393 -21.789 -5.413 1.00 0.00 H new ATOM 0 HG2 LYS A 31 0.448 -21.562 -7.706 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.233 -21.077 -7.607 1.00 0.00 H new ATOM 0 HD2 LYS A 31 0.192 -19.585 -9.060 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.674 -18.736 -7.795 1.00 0.00 H new ATOM 0 HE2 LYS A 31 1.368 -18.685 -6.389 1.00 0.00 H new ATOM 0 HE3 LYS A 31 2.243 -19.615 -7.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.585 -17.155 -7.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.162 -17.854 -9.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 0.999 -17.004 -8.210 1.00 0.00 H new ATOM 481 N LYS A 32 -2.972 -21.117 -4.446 1.00 0.00 N ATOM 482 CA LYS A 32 -4.355 -21.575 -4.466 1.00 0.00 C ATOM 483 C LYS A 32 -5.332 -20.401 -4.330 1.00 0.00 C ATOM 484 O LYS A 32 -6.310 -20.323 -5.071 1.00 0.00 O ATOM 485 CB LYS A 32 -4.559 -22.634 -3.373 1.00 0.00 C ATOM 486 CG LYS A 32 -5.985 -23.201 -3.382 1.00 0.00 C ATOM 487 CD LYS A 32 -6.100 -24.353 -2.377 1.00 0.00 C ATOM 488 CE LYS A 32 -7.559 -24.780 -2.173 1.00 0.00 C ATOM 489 NZ LYS A 32 -8.174 -25.257 -3.425 1.00 0.00 N ATOM 0 H LYS A 32 -2.388 -21.609 -3.770 1.00 0.00 H new ATOM 0 HA LYS A 32 -4.567 -22.037 -5.430 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.845 -23.445 -3.516 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.350 -22.194 -2.398 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.698 -22.416 -3.131 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.238 -23.554 -4.382 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -5.517 -25.204 -2.730 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -5.673 -24.048 -1.422 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -7.604 -25.569 -1.423 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.132 -23.938 -1.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.143 -25.583 -3.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -8.200 -24.481 -4.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -7.613 -26.044 -3.809 1.00 0.00 H new ATOM 503 N GLU A 33 -5.064 -19.471 -3.412 1.00 0.00 N ATOM 504 CA GLU A 33 -5.887 -18.287 -3.233 1.00 0.00 C ATOM 505 C GLU A 33 -5.843 -17.406 -4.478 1.00 0.00 C ATOM 506 O GLU A 33 -6.854 -16.823 -4.856 1.00 0.00 O ATOM 507 CB GLU A 33 -5.434 -17.482 -2.013 1.00 0.00 C ATOM 508 CG GLU A 33 -5.570 -18.266 -0.703 1.00 0.00 C ATOM 509 CD GLU A 33 -4.275 -18.976 -0.333 1.00 0.00 C ATOM 510 OE1 GLU A 33 -4.015 -20.051 -0.912 1.00 0.00 O ATOM 511 OE2 GLU A 33 -3.548 -18.416 0.517 1.00 0.00 O ATOM 0 H GLU A 33 -4.269 -19.523 -2.775 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.912 -18.619 -3.070 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.394 -17.182 -2.146 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -6.023 -16.567 -1.947 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -5.854 -17.586 0.100 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -6.372 -18.998 -0.799 1.00 0.00 H new ATOM 518 N LEU A 34 -4.674 -17.286 -5.110 1.00 0.00 N ATOM 519 CA LEU A 34 -4.527 -16.482 -6.316 1.00 0.00 C ATOM 520 C LEU A 34 -5.366 -17.086 -7.449 1.00 0.00 C ATOM 521 O LEU A 34 -6.115 -16.377 -8.122 1.00 0.00 O ATOM 522 CB LEU A 34 -3.040 -16.358 -6.680 1.00 0.00 C ATOM 523 CG LEU A 34 -2.741 -15.206 -7.654 1.00 0.00 C ATOM 524 CD1 LEU A 34 -2.917 -13.838 -6.979 1.00 0.00 C ATOM 525 CD2 LEU A 34 -1.294 -15.334 -8.147 1.00 0.00 C ATOM 0 H LEU A 34 -3.814 -17.739 -4.802 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.901 -15.473 -6.143 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -2.462 -16.211 -5.768 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.703 -17.295 -7.124 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.443 -15.271 -8.486 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -2.698 -13.047 -7.696 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -3.944 -13.735 -6.628 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.235 -13.759 -6.133 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.072 -14.521 -8.839 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.614 -15.283 -7.297 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.166 -16.289 -8.657 1.00 0.00 H new ATOM 537 N LYS A 35 -5.271 -18.407 -7.633 1.00 0.00 N ATOM 538 CA LYS A 35 -6.107 -19.143 -8.573 1.00 0.00 C ATOM 539 C LYS A 35 -7.587 -18.897 -8.257 1.00 0.00 C ATOM 540 O LYS A 35 -8.352 -18.463 -9.118 1.00 0.00 O ATOM 541 CB LYS A 35 -5.752 -20.637 -8.560 1.00 0.00 C ATOM 542 CG LYS A 35 -4.312 -20.933 -9.005 1.00 0.00 C ATOM 543 CD LYS A 35 -4.042 -20.522 -10.459 1.00 0.00 C ATOM 544 CE LYS A 35 -2.669 -21.026 -10.913 1.00 0.00 C ATOM 545 NZ LYS A 35 -2.375 -20.608 -12.295 1.00 0.00 N ATOM 0 H LYS A 35 -4.607 -18.994 -7.129 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.918 -18.781 -9.584 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.899 -21.028 -7.553 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -6.442 -21.171 -9.213 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.619 -20.407 -8.349 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.113 -21.999 -8.891 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -4.818 -20.928 -11.108 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -4.086 -19.437 -10.550 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -1.899 -20.643 -10.243 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -2.638 -22.113 -10.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -1.439 -20.964 -12.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -3.097 -20.994 -12.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -2.381 -19.570 -12.352 1.00 0.00 H new ATOM 559 N GLU A 36 -7.978 -19.123 -6.999 1.00 0.00 N ATOM 560 CA GLU A 36 -9.332 -18.871 -6.533 1.00 0.00 C ATOM 561 C GLU A 36 -9.767 -17.448 -6.894 1.00 0.00 C ATOM 562 O GLU A 36 -10.873 -17.256 -7.387 1.00 0.00 O ATOM 563 CB GLU A 36 -9.426 -19.128 -5.024 1.00 0.00 C ATOM 564 CG GLU A 36 -10.883 -19.092 -4.538 1.00 0.00 C ATOM 565 CD GLU A 36 -11.011 -19.304 -3.033 1.00 0.00 C ATOM 566 OE1 GLU A 36 -10.004 -19.079 -2.326 1.00 0.00 O ATOM 567 OE2 GLU A 36 -12.134 -19.654 -2.611 1.00 0.00 O ATOM 0 H GLU A 36 -7.356 -19.488 -6.277 1.00 0.00 H new ATOM 0 HA GLU A 36 -10.016 -19.558 -7.032 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -8.987 -20.098 -4.791 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -8.844 -18.378 -4.489 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -11.326 -18.132 -4.804 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -11.454 -19.861 -5.058 1.00 0.00 H new ATOM 574 N LEU A 37 -8.913 -16.450 -6.655 1.00 0.00 N ATOM 575 CA LEU A 37 -9.212 -15.070 -6.998 1.00 0.00 C ATOM 576 C LEU A 37 -9.521 -14.950 -8.488 1.00 0.00 C ATOM 577 O LEU A 37 -10.611 -14.506 -8.832 1.00 0.00 O ATOM 578 CB LEU A 37 -8.077 -14.130 -6.569 1.00 0.00 C ATOM 579 CG LEU A 37 -8.369 -12.657 -6.913 1.00 0.00 C ATOM 580 CD1 LEU A 37 -9.451 -12.065 -6.003 1.00 0.00 C ATOM 581 CD2 LEU A 37 -7.076 -11.847 -6.770 1.00 0.00 C ATOM 0 H LEU A 37 -8.000 -16.582 -6.220 1.00 0.00 H new ATOM 0 HA LEU A 37 -10.100 -14.761 -6.447 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.918 -14.224 -5.495 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.152 -14.437 -7.056 1.00 0.00 H new ATOM 0 HG LEU A 37 -8.738 -12.610 -7.938 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.628 -11.025 -6.277 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.374 -12.633 -6.118 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.121 -12.115 -4.965 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.272 -10.802 -7.012 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.712 -11.920 -5.745 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.322 -12.241 -7.452 1.00 0.00 H new ATOM 593 N ILE A 38 -8.594 -15.325 -9.379 1.00 0.00 N ATOM 594 CA ILE A 38 -8.837 -15.153 -10.813 1.00 0.00 C ATOM 595 C ILE A 38 -10.090 -15.910 -11.268 1.00 0.00 C ATOM 596 O ILE A 38 -10.831 -15.414 -12.118 1.00 0.00 O ATOM 597 CB ILE A 38 -7.603 -15.473 -11.678 1.00 0.00 C ATOM 598 CG1 ILE A 38 -7.080 -16.902 -11.492 1.00 0.00 C ATOM 599 CG2 ILE A 38 -6.506 -14.439 -11.396 1.00 0.00 C ATOM 600 CD1 ILE A 38 -5.980 -17.275 -12.490 1.00 0.00 C ATOM 0 H ILE A 38 -7.693 -15.738 -9.140 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.031 -14.092 -10.970 1.00 0.00 H new ATOM 0 HB ILE A 38 -7.911 -15.413 -12.722 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -6.695 -17.012 -10.478 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -7.909 -17.602 -11.596 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.631 -14.662 -12.006 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.874 -13.442 -11.640 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.233 -14.477 -10.342 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -5.653 -18.298 -12.305 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.368 -17.196 -13.506 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.135 -16.597 -12.370 1.00 0.00 H new ATOM 612 N GLN A 39 -10.341 -17.089 -10.685 1.00 0.00 N ATOM 613 CA GLN A 39 -11.548 -17.861 -10.942 1.00 0.00 C ATOM 614 C GLN A 39 -12.793 -17.074 -10.521 1.00 0.00 C ATOM 615 O GLN A 39 -13.623 -16.749 -11.365 1.00 0.00 O ATOM 616 CB GLN A 39 -11.474 -19.216 -10.224 1.00 0.00 C ATOM 617 CG GLN A 39 -10.433 -20.143 -10.865 1.00 0.00 C ATOM 618 CD GLN A 39 -10.143 -21.347 -9.975 1.00 0.00 C ATOM 619 OE1 GLN A 39 -9.018 -21.554 -9.534 1.00 0.00 O ATOM 620 NE2 GLN A 39 -11.160 -22.158 -9.696 1.00 0.00 N ATOM 0 H GLN A 39 -9.706 -17.530 -10.020 1.00 0.00 H new ATOM 0 HA GLN A 39 -11.623 -18.049 -12.013 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -11.224 -19.058 -9.175 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -12.453 -19.695 -10.250 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.794 -20.484 -11.835 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -9.511 -19.590 -11.044 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -12.087 -21.963 -10.076 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -11.013 -22.974 -9.102 1.00 0.00 H new ATOM 629 N LYS A 40 -12.940 -16.757 -9.232 1.00 0.00 N ATOM 630 CA LYS A 40 -14.114 -16.063 -8.708 1.00 0.00 C ATOM 631 C LYS A 40 -14.314 -14.708 -9.394 1.00 0.00 C ATOM 632 O LYS A 40 -15.437 -14.335 -9.725 1.00 0.00 O ATOM 633 CB LYS A 40 -13.989 -15.889 -7.186 1.00 0.00 C ATOM 634 CG LYS A 40 -13.923 -17.214 -6.409 1.00 0.00 C ATOM 635 CD LYS A 40 -15.260 -17.965 -6.381 1.00 0.00 C ATOM 636 CE LYS A 40 -15.094 -19.340 -5.725 1.00 0.00 C ATOM 637 NZ LYS A 40 -14.708 -19.241 -4.306 1.00 0.00 N ATOM 0 H LYS A 40 -12.243 -16.977 -8.521 1.00 0.00 H new ATOM 0 HA LYS A 40 -14.992 -16.672 -8.922 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -13.093 -15.308 -6.969 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -14.839 -15.310 -6.826 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -13.164 -17.854 -6.858 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -13.605 -17.012 -5.386 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -15.999 -17.381 -5.832 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -15.638 -18.084 -7.397 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -16.029 -19.894 -5.807 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -14.338 -19.909 -6.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -15.291 -19.891 -3.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -13.705 -19.495 -4.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -14.855 -18.267 -3.973 1.00 0.00 H new ATOM 651 N GLU A 41 -13.222 -13.973 -9.613 1.00 0.00 N ATOM 652 CA GLU A 41 -13.222 -12.704 -10.321 1.00 0.00 C ATOM 653 C GLU A 41 -13.485 -12.901 -11.827 1.00 0.00 C ATOM 654 O GLU A 41 -13.782 -11.936 -12.524 1.00 0.00 O ATOM 655 CB GLU A 41 -11.881 -12.011 -10.032 1.00 0.00 C ATOM 656 CG GLU A 41 -11.846 -10.529 -10.435 1.00 0.00 C ATOM 657 CD GLU A 41 -10.487 -9.880 -10.177 1.00 0.00 C ATOM 658 OE1 GLU A 41 -9.539 -10.620 -9.838 1.00 0.00 O ATOM 659 OE2 GLU A 41 -10.417 -8.641 -10.330 1.00 0.00 O ATOM 0 H GLU A 41 -12.295 -14.255 -9.293 1.00 0.00 H new ATOM 0 HA GLU A 41 -14.035 -12.067 -9.972 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -11.663 -12.093 -8.967 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -11.088 -12.540 -10.561 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -12.092 -10.438 -11.493 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -12.613 -9.988 -9.882 1.00 0.00 H new ATOM 816 N GLU A 52 -4.179 -8.803 -16.126 1.00 0.00 N ATOM 817 CA GLU A 52 -2.897 -8.125 -16.153 1.00 0.00 C ATOM 818 C GLU A 52 -2.472 -7.674 -14.755 1.00 0.00 C ATOM 819 O GLU A 52 -1.293 -7.804 -14.447 1.00 0.00 O ATOM 820 CB GLU A 52 -2.885 -6.972 -17.161 1.00 0.00 C ATOM 821 CG GLU A 52 -2.978 -7.427 -18.629 1.00 0.00 C ATOM 822 CD GLU A 52 -1.704 -8.121 -19.097 1.00 0.00 C ATOM 823 OE1 GLU A 52 -0.672 -7.420 -19.178 1.00 0.00 O ATOM 824 OE2 GLU A 52 -1.778 -9.341 -19.365 1.00 0.00 O ATOM 0 HA GLU A 52 -2.154 -8.846 -16.494 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -3.719 -6.304 -16.944 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -1.970 -6.394 -17.027 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -3.823 -8.106 -18.745 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -3.174 -6.563 -19.264 1.00 0.00 H new ATOM 831 N ILE A 53 -3.370 -7.170 -13.892 1.00 0.00 N ATOM 832 CA ILE A 53 -2.944 -6.820 -12.531 1.00 0.00 C ATOM 833 C ILE A 53 -2.307 -8.046 -11.860 1.00 0.00 C ATOM 834 O ILE A 53 -1.180 -7.980 -11.366 1.00 0.00 O ATOM 835 CB ILE A 53 -4.099 -6.215 -11.702 1.00 0.00 C ATOM 836 CG1 ILE A 53 -4.461 -4.825 -12.262 1.00 0.00 C ATOM 837 CG2 ILE A 53 -3.723 -6.078 -10.218 1.00 0.00 C ATOM 838 CD1 ILE A 53 -5.698 -4.201 -11.607 1.00 0.00 C ATOM 0 H ILE A 53 -4.354 -7.002 -14.101 1.00 0.00 H new ATOM 0 HA ILE A 53 -2.188 -6.037 -12.588 1.00 0.00 H new ATOM 0 HB ILE A 53 -4.952 -6.890 -11.776 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -3.612 -4.156 -12.126 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.632 -4.909 -13.335 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -4.561 -5.649 -9.668 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.487 -7.061 -9.810 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.854 -5.427 -10.121 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -5.892 -3.225 -12.051 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -6.560 -4.849 -11.766 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -5.524 -4.085 -10.537 1.00 0.00 H new ATOM 850 N VAL A 54 -3.019 -9.176 -11.864 1.00 0.00 N ATOM 851 CA VAL A 54 -2.521 -10.409 -11.272 1.00 0.00 C ATOM 852 C VAL A 54 -1.217 -10.843 -11.950 1.00 0.00 C ATOM 853 O VAL A 54 -0.247 -11.176 -11.269 1.00 0.00 O ATOM 854 CB VAL A 54 -3.612 -11.493 -11.313 1.00 0.00 C ATOM 855 CG1 VAL A 54 -3.052 -12.852 -10.872 1.00 0.00 C ATOM 856 CG2 VAL A 54 -4.765 -11.098 -10.378 1.00 0.00 C ATOM 0 H VAL A 54 -3.949 -9.257 -12.275 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.281 -10.240 -10.222 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.971 -11.578 -12.339 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -3.843 -13.601 -10.910 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -2.242 -13.146 -11.540 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.673 -12.776 -9.853 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.537 -11.867 -10.408 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.390 -11.000 -9.359 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -5.187 -10.147 -10.702 1.00 0.00 H new ATOM 866 N LYS A 55 -1.183 -10.839 -13.286 1.00 0.00 N ATOM 867 CA LYS A 55 0.007 -11.215 -14.035 1.00 0.00 C ATOM 868 C LYS A 55 1.203 -10.365 -13.603 1.00 0.00 C ATOM 869 O LYS A 55 2.276 -10.902 -13.349 1.00 0.00 O ATOM 870 CB LYS A 55 -0.241 -11.085 -15.543 1.00 0.00 C ATOM 871 CG LYS A 55 0.862 -11.795 -16.343 1.00 0.00 C ATOM 872 CD LYS A 55 0.730 -11.530 -17.848 1.00 0.00 C ATOM 873 CE LYS A 55 1.280 -10.149 -18.228 1.00 0.00 C ATOM 874 NZ LYS A 55 1.115 -9.890 -19.669 1.00 0.00 N ATOM 0 H LYS A 55 -1.977 -10.576 -13.870 1.00 0.00 H new ATOM 0 HA LYS A 55 0.236 -12.258 -13.819 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.211 -11.513 -15.794 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.276 -10.031 -15.820 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.838 -11.455 -15.998 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.814 -12.868 -16.157 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.266 -12.301 -18.402 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.318 -11.598 -18.140 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.764 -9.378 -17.656 1.00 0.00 H new ATOM 0 HE3 LYS A 55 2.336 -10.089 -17.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.599 -9.005 -19.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.526 -10.676 -20.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 0.103 -9.806 -19.893 1.00 0.00 H new ATOM 888 N LEU A 56 1.031 -9.045 -13.523 1.00 0.00 N ATOM 889 CA LEU A 56 2.086 -8.133 -13.112 1.00 0.00 C ATOM 890 C LEU A 56 2.539 -8.453 -11.687 1.00 0.00 C ATOM 891 O LEU A 56 3.739 -8.513 -11.430 1.00 0.00 O ATOM 892 CB LEU A 56 1.623 -6.675 -13.246 1.00 0.00 C ATOM 893 CG LEU A 56 1.457 -6.223 -14.709 1.00 0.00 C ATOM 894 CD1 LEU A 56 0.626 -4.935 -14.749 1.00 0.00 C ATOM 895 CD2 LEU A 56 2.811 -5.965 -15.382 1.00 0.00 C ATOM 0 H LEU A 56 0.150 -8.581 -13.744 1.00 0.00 H new ATOM 0 HA LEU A 56 2.944 -8.265 -13.771 1.00 0.00 H new ATOM 0 HB2 LEU A 56 0.674 -6.553 -12.725 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.344 -6.025 -12.751 1.00 0.00 H new ATOM 0 HG LEU A 56 0.955 -7.023 -15.252 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.506 -4.611 -15.783 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.355 -5.121 -14.311 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.135 -4.156 -14.182 1.00 0.00 H new ATOM 0 HD21 LEU A 56 2.651 -5.648 -16.413 1.00 0.00 H new ATOM 0 HD22 LEU A 56 3.343 -5.183 -14.841 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.403 -6.880 -15.372 1.00 0.00 H new ATOM 907 N MET A 57 1.600 -8.677 -10.762 1.00 0.00 N ATOM 908 CA MET A 57 1.952 -9.055 -9.396 1.00 0.00 C ATOM 909 C MET A 57 2.813 -10.323 -9.390 1.00 0.00 C ATOM 910 O MET A 57 3.869 -10.364 -8.759 1.00 0.00 O ATOM 911 CB MET A 57 0.682 -9.227 -8.553 1.00 0.00 C ATOM 912 CG MET A 57 1.027 -9.343 -7.063 1.00 0.00 C ATOM 913 SD MET A 57 -0.373 -9.233 -5.921 1.00 0.00 S ATOM 914 CE MET A 57 -1.355 -10.653 -6.449 1.00 0.00 C ATOM 0 H MET A 57 0.598 -8.603 -10.936 1.00 0.00 H new ATOM 0 HA MET A 57 2.546 -8.258 -8.949 1.00 0.00 H new ATOM 0 HB2 MET A 57 0.017 -8.378 -8.712 1.00 0.00 H new ATOM 0 HB3 MET A 57 0.144 -10.118 -8.876 1.00 0.00 H new ATOM 0 HG2 MET A 57 1.532 -10.295 -6.899 1.00 0.00 H new ATOM 0 HG3 MET A 57 1.739 -8.557 -6.812 1.00 0.00 H new ATOM 0 HE1 MET A 57 -2.228 -10.752 -5.804 1.00 0.00 H new ATOM 0 HE2 MET A 57 -1.680 -10.508 -7.479 1.00 0.00 H new ATOM 0 HE3 MET A 57 -0.751 -11.558 -6.383 1.00 0.00 H new ATOM 924 N ASP A 58 2.360 -11.361 -10.100 1.00 0.00 N ATOM 925 CA ASP A 58 3.084 -12.620 -10.222 1.00 0.00 C ATOM 926 C ASP A 58 4.482 -12.384 -10.806 1.00 0.00 C ATOM 927 O ASP A 58 5.478 -12.832 -10.247 1.00 0.00 O ATOM 928 CB ASP A 58 2.268 -13.592 -11.082 1.00 0.00 C ATOM 929 CG ASP A 58 2.959 -14.944 -11.210 1.00 0.00 C ATOM 930 OD1 ASP A 58 3.776 -15.079 -12.146 1.00 0.00 O ATOM 931 OD2 ASP A 58 2.638 -15.823 -10.381 1.00 0.00 O ATOM 0 H ASP A 58 1.475 -11.346 -10.607 1.00 0.00 H new ATOM 0 HA ASP A 58 3.219 -13.062 -9.235 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.281 -13.728 -10.641 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.118 -13.164 -12.073 1.00 0.00 H new ATOM 936 N ASP A 59 4.543 -11.663 -11.928 1.00 0.00 N ATOM 937 CA ASP A 59 5.774 -11.317 -12.629 1.00 0.00 C ATOM 938 C ASP A 59 6.750 -10.604 -11.688 1.00 0.00 C ATOM 939 O ASP A 59 7.935 -10.927 -11.656 1.00 0.00 O ATOM 940 CB ASP A 59 5.427 -10.460 -13.855 1.00 0.00 C ATOM 941 CG ASP A 59 6.638 -10.198 -14.741 1.00 0.00 C ATOM 942 OD1 ASP A 59 7.446 -9.321 -14.368 1.00 0.00 O ATOM 943 OD2 ASP A 59 6.756 -10.889 -15.776 1.00 0.00 O ATOM 0 H ASP A 59 3.709 -11.294 -12.385 1.00 0.00 H new ATOM 0 HA ASP A 59 6.273 -12.224 -12.971 1.00 0.00 H new ATOM 0 HB2 ASP A 59 4.655 -10.961 -14.439 1.00 0.00 H new ATOM 0 HB3 ASP A 59 5.010 -9.509 -13.524 1.00 0.00 H new ATOM 948 N LEU A 60 6.259 -9.640 -10.904 1.00 0.00 N ATOM 949 CA LEU A 60 7.067 -9.003 -9.875 1.00 0.00 C ATOM 950 C LEU A 60 7.574 -10.078 -8.913 1.00 0.00 C ATOM 951 O LEU A 60 8.782 -10.244 -8.740 1.00 0.00 O ATOM 952 CB LEU A 60 6.254 -7.897 -9.179 1.00 0.00 C ATOM 953 CG LEU A 60 7.076 -6.995 -8.236 1.00 0.00 C ATOM 954 CD1 LEU A 60 6.297 -5.702 -7.972 1.00 0.00 C ATOM 955 CD2 LEU A 60 7.375 -7.648 -6.879 1.00 0.00 C ATOM 0 H LEU A 60 5.304 -9.287 -10.967 1.00 0.00 H new ATOM 0 HA LEU A 60 7.939 -8.514 -10.309 1.00 0.00 H new ATOM 0 HB2 LEU A 60 5.786 -7.274 -9.941 1.00 0.00 H new ATOM 0 HB3 LEU A 60 5.449 -8.360 -8.608 1.00 0.00 H new ATOM 0 HG LEU A 60 8.027 -6.808 -8.735 1.00 0.00 H new ATOM 0 HD11 LEU A 60 6.873 -5.060 -7.306 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.123 -5.183 -8.915 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.341 -5.942 -7.507 1.00 0.00 H new ATOM 0 HD21 LEU A 60 7.956 -6.960 -6.264 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.438 -7.883 -6.374 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.944 -8.565 -7.034 1.00 0.00 H new ATOM 967 N ASP A 61 6.661 -10.827 -8.288 1.00 0.00 N ATOM 968 CA ASP A 61 7.035 -11.819 -7.291 1.00 0.00 C ATOM 969 C ASP A 61 7.556 -13.122 -7.911 1.00 0.00 C ATOM 970 O ASP A 61 7.054 -14.207 -7.622 1.00 0.00 O ATOM 971 CB ASP A 61 5.883 -12.063 -6.306 1.00 0.00 C ATOM 972 CG ASP A 61 6.276 -13.081 -5.235 1.00 0.00 C ATOM 973 OD1 ASP A 61 7.476 -13.134 -4.885 1.00 0.00 O ATOM 974 OD2 ASP A 61 5.379 -13.845 -4.824 1.00 0.00 O ATOM 0 H ASP A 61 5.658 -10.761 -8.459 1.00 0.00 H new ATOM 0 HA ASP A 61 7.874 -11.409 -6.729 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.602 -11.123 -5.832 1.00 0.00 H new ATOM 0 HB3 ASP A 61 5.008 -12.421 -6.848 1.00 0.00 H new ATOM 979 N ARG A 62 8.624 -13.042 -8.706 1.00 0.00 N ATOM 980 CA ARG A 62 9.351 -14.246 -9.101 1.00 0.00 C ATOM 981 C ARG A 62 10.059 -14.823 -7.870 1.00 0.00 C ATOM 982 O ARG A 62 10.256 -16.032 -7.781 1.00 0.00 O ATOM 983 CB ARG A 62 10.367 -13.939 -10.208 1.00 0.00 C ATOM 984 CG ARG A 62 9.691 -13.900 -11.582 1.00 0.00 C ATOM 985 CD ARG A 62 10.720 -13.565 -12.668 1.00 0.00 C ATOM 986 NE ARG A 62 10.110 -13.559 -14.005 1.00 0.00 N ATOM 987 CZ ARG A 62 9.506 -12.503 -14.567 1.00 0.00 C ATOM 988 NH1 ARG A 62 9.354 -11.363 -13.887 1.00 0.00 N ATOM 989 NH2 ARG A 62 9.032 -12.593 -15.813 1.00 0.00 N ATOM 0 H ARG A 62 8.999 -12.171 -9.083 1.00 0.00 H new ATOM 0 HA ARG A 62 8.645 -14.976 -9.497 1.00 0.00 H new ATOM 0 HB2 ARG A 62 10.848 -12.981 -10.009 1.00 0.00 H new ATOM 0 HB3 ARG A 62 11.151 -14.696 -10.206 1.00 0.00 H new ATOM 0 HG2 ARG A 62 9.227 -14.863 -11.795 1.00 0.00 H new ATOM 0 HG3 ARG A 62 8.895 -13.156 -11.583 1.00 0.00 H new ATOM 0 HD2 ARG A 62 11.161 -12.589 -12.464 1.00 0.00 H new ATOM 0 HD3 ARG A 62 11.530 -14.293 -12.640 1.00 0.00 H new ATOM 0 HE ARG A 62 10.149 -14.423 -14.546 1.00 0.00 H new ATOM 0 HH11 ARG A 62 9.699 -11.290 -12.930 1.00 0.00 H new ATOM 0 HH12 ARG A 62 8.893 -10.566 -14.325 1.00 0.00 H new ATOM 0 HH21 ARG A 62 9.130 -13.464 -16.334 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.572 -11.791 -16.243 1.00 0.00 H new ATOM 1003 N ASN A 63 10.459 -13.953 -6.933 1.00 0.00 N ATOM 1004 CA ASN A 63 11.220 -14.317 -5.744 1.00 0.00 C ATOM 1005 C ASN A 63 10.568 -15.459 -4.964 1.00 0.00 C ATOM 1006 O ASN A 63 11.226 -16.456 -4.681 1.00 0.00 O ATOM 1007 CB ASN A 63 11.403 -13.090 -4.841 1.00 0.00 C ATOM 1008 CG ASN A 63 12.141 -13.451 -3.552 1.00 0.00 C ATOM 1009 OD1 ASN A 63 11.581 -13.381 -2.463 1.00 0.00 O ATOM 1010 ND2 ASN A 63 13.407 -13.840 -3.658 1.00 0.00 N ATOM 0 H ASN A 63 10.255 -12.955 -6.988 1.00 0.00 H new ATOM 0 HA ASN A 63 12.195 -14.673 -6.077 1.00 0.00 H new ATOM 0 HB2 ASN A 63 11.959 -12.321 -5.377 1.00 0.00 H new ATOM 0 HB3 ASN A 63 10.428 -12.667 -4.598 1.00 0.00 H new ATOM 0 HD21 ASN A 63 13.936 -14.089 -2.822 1.00 0.00 H new ATOM 0 HD22 ASN A 63 13.850 -13.890 -4.575 1.00 0.00 H new ATOM 1017 N LYS A 64 9.298 -15.290 -4.584 1.00 0.00 N ATOM 1018 CA LYS A 64 8.577 -16.271 -3.781 1.00 0.00 C ATOM 1019 C LYS A 64 7.671 -17.111 -4.674 1.00 0.00 C ATOM 1020 O LYS A 64 7.763 -18.339 -4.688 1.00 0.00 O ATOM 1021 CB LYS A 64 7.824 -15.572 -2.643 1.00 0.00 C ATOM 1022 CG LYS A 64 8.763 -14.638 -1.871 1.00 0.00 C ATOM 1023 CD LYS A 64 8.143 -14.202 -0.540 1.00 0.00 C ATOM 1024 CE LYS A 64 8.957 -13.072 0.105 1.00 0.00 C ATOM 1025 NZ LYS A 64 10.389 -13.406 0.212 1.00 0.00 N ATOM 0 H LYS A 64 8.745 -14.468 -4.826 1.00 0.00 H new ATOM 0 HA LYS A 64 9.281 -16.959 -3.312 1.00 0.00 H new ATOM 0 HB2 LYS A 64 6.988 -15.002 -3.049 1.00 0.00 H new ATOM 0 HB3 LYS A 64 7.404 -16.316 -1.966 1.00 0.00 H new ATOM 0 HG2 LYS A 64 9.710 -15.144 -1.685 1.00 0.00 H new ATOM 0 HG3 LYS A 64 8.984 -13.759 -2.477 1.00 0.00 H new ATOM 0 HD2 LYS A 64 7.119 -13.868 -0.705 1.00 0.00 H new ATOM 0 HD3 LYS A 64 8.096 -15.053 0.139 1.00 0.00 H new ATOM 0 HE2 LYS A 64 8.841 -12.162 -0.484 1.00 0.00 H new ATOM 0 HE3 LYS A 64 8.560 -12.862 1.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 10.862 -12.714 0.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 10.494 -14.358 0.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 10.823 -13.381 -0.733 1.00 0.00 H new ATOM 1039 N ASP A 65 6.809 -16.424 -5.424 1.00 0.00 N ATOM 1040 CA ASP A 65 5.879 -16.938 -6.427 1.00 0.00 C ATOM 1041 C ASP A 65 4.800 -17.835 -5.823 1.00 0.00 C ATOM 1042 O ASP A 65 3.619 -17.505 -5.878 1.00 0.00 O ATOM 1043 CB ASP A 65 6.626 -17.628 -7.577 1.00 0.00 C ATOM 1044 CG ASP A 65 5.645 -18.137 -8.628 1.00 0.00 C ATOM 1045 OD1 ASP A 65 5.201 -19.296 -8.475 1.00 0.00 O ATOM 1046 OD2 ASP A 65 5.346 -17.357 -9.558 1.00 0.00 O ATOM 0 H ASP A 65 6.738 -15.410 -5.338 1.00 0.00 H new ATOM 0 HA ASP A 65 5.356 -16.078 -6.845 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.326 -16.929 -8.034 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.214 -18.459 -7.188 1.00 0.00 H new ATOM 1051 N GLN A 66 5.212 -18.972 -5.257 1.00 0.00 N ATOM 1052 CA GLN A 66 4.374 -19.989 -4.629 1.00 0.00 C ATOM 1053 C GLN A 66 3.361 -19.366 -3.669 1.00 0.00 C ATOM 1054 O GLN A 66 2.216 -19.809 -3.556 1.00 0.00 O ATOM 1055 CB GLN A 66 5.271 -20.989 -3.897 1.00 0.00 C ATOM 1056 CG GLN A 66 6.129 -21.793 -4.886 1.00 0.00 C ATOM 1057 CD GLN A 66 7.505 -22.094 -4.311 1.00 0.00 C ATOM 1058 OE1 GLN A 66 7.840 -23.239 -4.029 1.00 0.00 O ATOM 1059 NE2 GLN A 66 8.313 -21.054 -4.133 1.00 0.00 N ATOM 0 H GLN A 66 6.201 -19.220 -5.225 1.00 0.00 H new ATOM 0 HA GLN A 66 3.805 -20.504 -5.403 1.00 0.00 H new ATOM 0 HB2 GLN A 66 5.918 -20.458 -3.199 1.00 0.00 H new ATOM 0 HB3 GLN A 66 4.656 -21.670 -3.308 1.00 0.00 H new ATOM 0 HG2 GLN A 66 5.624 -22.727 -5.132 1.00 0.00 H new ATOM 0 HG3 GLN A 66 6.236 -21.234 -5.815 1.00 0.00 H new ATOM 0 HE21 GLN A 66 7.998 -20.116 -4.380 1.00 0.00 H new ATOM 0 HE22 GLN A 66 9.248 -21.194 -3.750 1.00 0.00 H new ATOM 1068 N GLU A 67 3.811 -18.326 -2.979 1.00 0.00 N ATOM 1069 CA GLU A 67 2.976 -17.454 -2.191 1.00 0.00 C ATOM 1070 C GLU A 67 3.516 -16.040 -2.336 1.00 0.00 C ATOM 1071 O GLU A 67 4.729 -15.851 -2.387 1.00 0.00 O ATOM 1072 CB GLU A 67 2.915 -17.938 -0.734 1.00 0.00 C ATOM 1073 CG GLU A 67 4.294 -18.017 -0.063 1.00 0.00 C ATOM 1074 CD GLU A 67 4.200 -18.666 1.314 1.00 0.00 C ATOM 1075 OE1 GLU A 67 3.595 -18.026 2.201 1.00 0.00 O ATOM 1076 OE2 GLU A 67 4.730 -19.789 1.455 1.00 0.00 O ATOM 0 H GLU A 67 4.797 -18.066 -2.957 1.00 0.00 H new ATOM 0 HA GLU A 67 1.945 -17.466 -2.544 1.00 0.00 H new ATOM 0 HB2 GLU A 67 2.278 -17.265 -0.161 1.00 0.00 H new ATOM 0 HB3 GLU A 67 2.447 -18.922 -0.704 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.975 -18.590 -0.692 1.00 0.00 H new ATOM 0 HG3 GLU A 67 4.713 -17.015 0.032 1.00 0.00 H new ATOM 1083 N VAL A 68 2.611 -15.068 -2.398 1.00 0.00 N ATOM 1084 CA VAL A 68 2.935 -13.657 -2.437 1.00 0.00 C ATOM 1085 C VAL A 68 2.892 -13.188 -0.990 1.00 0.00 C ATOM 1086 O VAL A 68 1.968 -13.537 -0.252 1.00 0.00 O ATOM 1087 CB VAL A 68 1.913 -12.903 -3.309 1.00 0.00 C ATOM 1088 CG1 VAL A 68 2.267 -11.412 -3.401 1.00 0.00 C ATOM 1089 CG2 VAL A 68 1.850 -13.486 -4.729 1.00 0.00 C ATOM 0 H VAL A 68 1.608 -15.251 -2.423 1.00 0.00 H new ATOM 0 HA VAL A 68 3.914 -13.468 -2.877 1.00 0.00 H new ATOM 0 HB VAL A 68 0.940 -13.020 -2.832 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.531 -10.901 -4.022 1.00 0.00 H new ATOM 0 HG12 VAL A 68 2.265 -10.975 -2.402 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.256 -11.300 -3.844 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.120 -12.931 -5.318 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.830 -13.407 -5.199 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.555 -14.534 -4.679 1.00 0.00 H new ATOM 1099 N ASN A 69 3.880 -12.397 -0.573 1.00 0.00 N ATOM 1100 CA ASN A 69 3.935 -11.910 0.794 1.00 0.00 C ATOM 1101 C ASN A 69 3.202 -10.576 0.839 1.00 0.00 C ATOM 1102 O ASN A 69 3.290 -9.777 -0.090 1.00 0.00 O ATOM 1103 CB ASN A 69 5.391 -11.764 1.247 1.00 0.00 C ATOM 1104 CG ASN A 69 5.481 -11.249 2.681 1.00 0.00 C ATOM 1105 OD1 ASN A 69 5.268 -10.068 2.936 1.00 0.00 O ATOM 1106 ND2 ASN A 69 5.793 -12.121 3.634 1.00 0.00 N ATOM 0 H ASN A 69 4.649 -12.083 -1.165 1.00 0.00 H new ATOM 0 HA ASN A 69 3.458 -12.614 1.476 1.00 0.00 H new ATOM 0 HB2 ASN A 69 5.895 -12.728 1.173 1.00 0.00 H new ATOM 0 HB3 ASN A 69 5.914 -11.079 0.580 1.00 0.00 H new ATOM 0 HD21 ASN A 69 5.860 -11.814 4.604 1.00 0.00 H new ATOM 0 HD22 ASN A 69 5.965 -13.098 3.395 1.00 0.00 H new ATOM 1113 N PHE A 70 2.458 -10.342 1.916 1.00 0.00 N ATOM 1114 CA PHE A 70 1.715 -9.114 2.146 1.00 0.00 C ATOM 1115 C PHE A 70 2.536 -7.863 1.799 1.00 0.00 C ATOM 1116 O PHE A 70 2.057 -6.970 1.103 1.00 0.00 O ATOM 1117 CB PHE A 70 1.242 -9.092 3.602 1.00 0.00 C ATOM 1118 CG PHE A 70 0.596 -7.786 3.995 1.00 0.00 C ATOM 1119 CD1 PHE A 70 -0.590 -7.377 3.360 1.00 0.00 C ATOM 1120 CD2 PHE A 70 1.273 -6.906 4.857 1.00 0.00 C ATOM 1121 CE1 PHE A 70 -1.146 -6.121 3.654 1.00 0.00 C ATOM 1122 CE2 PHE A 70 0.763 -5.622 5.082 1.00 0.00 C ATOM 1123 CZ PHE A 70 -0.459 -5.234 4.502 1.00 0.00 C ATOM 0 H PHE A 70 2.355 -11.021 2.670 1.00 0.00 H new ATOM 0 HA PHE A 70 0.851 -9.095 1.481 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.532 -9.904 3.759 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.092 -9.281 4.257 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -1.073 -8.028 2.647 1.00 0.00 H new ATOM 0 HD2 PHE A 70 2.184 -7.220 5.344 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.098 -5.837 3.230 1.00 0.00 H new ATOM 0 HE2 PHE A 70 1.309 -4.927 5.703 1.00 0.00 H new ATOM 0 HZ PHE A 70 -0.869 -4.256 4.708 1.00 0.00 H new ATOM 1133 N GLN A 71 3.795 -7.802 2.237 1.00 0.00 N ATOM 1134 CA GLN A 71 4.676 -6.687 1.925 1.00 0.00 C ATOM 1135 C GLN A 71 4.845 -6.518 0.409 1.00 0.00 C ATOM 1136 O GLN A 71 4.868 -5.393 -0.092 1.00 0.00 O ATOM 1137 CB GLN A 71 6.020 -6.895 2.637 1.00 0.00 C ATOM 1138 CG GLN A 71 6.909 -5.647 2.558 1.00 0.00 C ATOM 1139 CD GLN A 71 8.192 -5.830 3.359 1.00 0.00 C ATOM 1140 OE1 GLN A 71 9.277 -5.925 2.798 1.00 0.00 O ATOM 1141 NE2 GLN A 71 8.083 -5.886 4.684 1.00 0.00 N ATOM 0 H GLN A 71 4.226 -8.523 2.815 1.00 0.00 H new ATOM 0 HA GLN A 71 4.231 -5.760 2.287 1.00 0.00 H new ATOM 0 HB2 GLN A 71 5.842 -7.148 3.682 1.00 0.00 H new ATOM 0 HB3 GLN A 71 6.541 -7.741 2.189 1.00 0.00 H new ATOM 0 HG2 GLN A 71 7.154 -5.438 1.517 1.00 0.00 H new ATOM 0 HG3 GLN A 71 6.362 -4.783 2.936 1.00 0.00 H new ATOM 0 HE21 GLN A 71 7.167 -5.804 5.124 1.00 0.00 H new ATOM 0 HE22 GLN A 71 8.916 -6.011 5.259 1.00 0.00 H new ATOM 1150 N GLU A 72 4.948 -7.628 -0.330 1.00 0.00 N ATOM 1151 CA GLU A 72 5.029 -7.599 -1.783 1.00 0.00 C ATOM 1152 C GLU A 72 3.701 -7.126 -2.366 1.00 0.00 C ATOM 1153 O GLU A 72 3.706 -6.325 -3.291 1.00 0.00 O ATOM 1154 CB GLU A 72 5.399 -8.973 -2.356 1.00 0.00 C ATOM 1155 CG GLU A 72 6.762 -9.466 -1.855 1.00 0.00 C ATOM 1156 CD GLU A 72 7.043 -10.887 -2.334 1.00 0.00 C ATOM 1157 OE1 GLU A 72 6.153 -11.742 -2.123 1.00 0.00 O ATOM 1158 OE2 GLU A 72 8.144 -11.091 -2.890 1.00 0.00 O ATOM 0 H GLU A 72 4.977 -8.567 0.067 1.00 0.00 H new ATOM 0 HA GLU A 72 5.818 -6.901 -2.062 1.00 0.00 H new ATOM 0 HB2 GLU A 72 4.631 -9.697 -2.083 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.413 -8.918 -3.445 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.547 -8.798 -2.210 1.00 0.00 H new ATOM 0 HG3 GLU A 72 6.785 -9.435 -0.766 1.00 0.00 H new ATOM 1165 N TYR A 73 2.569 -7.603 -1.836 1.00 0.00 N ATOM 1166 CA TYR A 73 1.252 -7.142 -2.265 1.00 0.00 C ATOM 1167 C TYR A 73 1.159 -5.614 -2.129 1.00 0.00 C ATOM 1168 O TYR A 73 0.818 -4.916 -3.084 1.00 0.00 O ATOM 1169 CB TYR A 73 0.170 -7.894 -1.476 1.00 0.00 C ATOM 1170 CG TYR A 73 -1.228 -7.314 -1.538 1.00 0.00 C ATOM 1171 CD1 TYR A 73 -2.042 -7.550 -2.661 1.00 0.00 C ATOM 1172 CD2 TYR A 73 -1.761 -6.648 -0.416 1.00 0.00 C ATOM 1173 CE1 TYR A 73 -3.389 -7.148 -2.653 1.00 0.00 C ATOM 1174 CE2 TYR A 73 -3.107 -6.244 -0.411 1.00 0.00 C ATOM 1175 CZ TYR A 73 -3.924 -6.509 -1.522 1.00 0.00 C ATOM 1176 OH TYR A 73 -5.253 -6.214 -1.467 1.00 0.00 O ATOM 0 H TYR A 73 2.544 -8.313 -1.104 1.00 0.00 H new ATOM 0 HA TYR A 73 1.091 -7.364 -3.320 1.00 0.00 H new ATOM 0 HB2 TYR A 73 0.131 -8.921 -1.841 1.00 0.00 H new ATOM 0 HB3 TYR A 73 0.477 -7.938 -0.431 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -1.631 -8.041 -3.531 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -1.134 -6.448 0.441 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -4.012 -7.330 -3.516 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -3.513 -5.730 0.447 1.00 0.00 H new ATOM 0 HH TYR A 73 -5.757 -7.018 -1.220 1.00 0.00 H new ATOM 1186 N ILE A 74 1.508 -5.082 -0.957 1.00 0.00 N ATOM 1187 CA ILE A 74 1.511 -3.644 -0.728 1.00 0.00 C ATOM 1188 C ILE A 74 2.487 -2.930 -1.669 1.00 0.00 C ATOM 1189 O ILE A 74 2.109 -1.977 -2.351 1.00 0.00 O ATOM 1190 CB ILE A 74 1.798 -3.346 0.754 1.00 0.00 C ATOM 1191 CG1 ILE A 74 0.691 -3.857 1.690 1.00 0.00 C ATOM 1192 CG2 ILE A 74 1.980 -1.842 0.974 1.00 0.00 C ATOM 1193 CD1 ILE A 74 -0.732 -3.426 1.308 1.00 0.00 C ATOM 0 H ILE A 74 1.794 -5.634 -0.148 1.00 0.00 H new ATOM 0 HA ILE A 74 0.522 -3.249 -0.959 1.00 0.00 H new ATOM 0 HB ILE A 74 2.717 -3.878 1.000 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.730 -4.946 1.714 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.901 -3.508 2.701 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.182 -1.650 2.028 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.817 -1.485 0.373 1.00 0.00 H new ATOM 0 HG23 ILE A 74 1.071 -1.318 0.678 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.442 -3.835 2.027 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.796 -2.338 1.314 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.970 -3.798 0.312 1.00 0.00 H new ATOM 1205 N THR A 75 3.750 -3.356 -1.722 1.00 0.00 N ATOM 1206 CA THR A 75 4.719 -2.658 -2.561 1.00 0.00 C ATOM 1207 C THR A 75 4.312 -2.743 -4.037 1.00 0.00 C ATOM 1208 O THR A 75 4.519 -1.794 -4.786 1.00 0.00 O ATOM 1209 CB THR A 75 6.147 -3.158 -2.303 1.00 0.00 C ATOM 1210 OG1 THR A 75 6.385 -3.227 -0.911 1.00 0.00 O ATOM 1211 CG2 THR A 75 7.173 -2.187 -2.906 1.00 0.00 C ATOM 0 H THR A 75 4.117 -4.158 -1.209 1.00 0.00 H new ATOM 0 HA THR A 75 4.718 -1.602 -2.291 1.00 0.00 H new ATOM 0 HB THR A 75 6.249 -4.142 -2.762 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.944 -4.021 -0.543 1.00 0.00 H new ATOM 0 HG21 THR A 75 8.180 -2.557 -2.714 1.00 0.00 H new ATOM 0 HG22 THR A 75 7.013 -2.111 -3.982 1.00 0.00 H new ATOM 0 HG23 THR A 75 7.054 -1.204 -2.451 1.00 0.00 H new ATOM 1219 N PHE A 76 3.695 -3.855 -4.448 1.00 0.00 N ATOM 1220 CA PHE A 76 3.101 -4.010 -5.766 1.00 0.00 C ATOM 1221 C PHE A 76 1.990 -2.980 -5.979 1.00 0.00 C ATOM 1222 O PHE A 76 1.967 -2.340 -7.027 1.00 0.00 O ATOM 1223 CB PHE A 76 2.577 -5.437 -5.970 1.00 0.00 C ATOM 1224 CG PHE A 76 1.748 -5.597 -7.229 1.00 0.00 C ATOM 1225 CD1 PHE A 76 2.344 -5.404 -8.489 1.00 0.00 C ATOM 1226 CD2 PHE A 76 0.351 -5.736 -7.133 1.00 0.00 C ATOM 1227 CE1 PHE A 76 1.553 -5.379 -9.648 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -0.439 -5.722 -8.295 1.00 0.00 C ATOM 1229 CZ PHE A 76 0.162 -5.553 -9.554 1.00 0.00 C ATOM 0 H PHE A 76 3.596 -4.682 -3.860 1.00 0.00 H new ATOM 0 HA PHE A 76 3.876 -3.833 -6.512 1.00 0.00 H new ATOM 0 HB2 PHE A 76 3.422 -6.125 -6.010 1.00 0.00 H new ATOM 0 HB3 PHE A 76 1.974 -5.722 -5.108 1.00 0.00 H new ATOM 0 HD1 PHE A 76 3.414 -5.275 -8.564 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -0.114 -5.854 -6.166 1.00 0.00 H new ATOM 0 HE1 PHE A 76 2.014 -5.226 -10.613 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -1.510 -5.841 -8.220 1.00 0.00 H new ATOM 0 HZ PHE A 76 -0.444 -5.557 -10.448 1.00 0.00 H new ATOM 1239 N LEU A 77 1.095 -2.792 -4.997 1.00 0.00 N ATOM 1240 CA LEU A 77 0.093 -1.728 -5.067 1.00 0.00 C ATOM 1241 C LEU A 77 0.818 -0.417 -5.376 1.00 0.00 C ATOM 1242 O LEU A 77 0.477 0.279 -6.332 1.00 0.00 O ATOM 1243 CB LEU A 77 -0.710 -1.664 -3.755 1.00 0.00 C ATOM 1244 CG LEU A 77 -2.005 -0.835 -3.810 1.00 0.00 C ATOM 1245 CD1 LEU A 77 -2.731 -0.988 -2.470 1.00 0.00 C ATOM 1246 CD2 LEU A 77 -1.769 0.662 -4.053 1.00 0.00 C ATOM 0 H LEU A 77 1.048 -3.361 -4.152 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.630 -1.923 -5.859 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.963 -2.681 -3.454 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.068 -1.252 -2.976 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.588 -1.211 -4.651 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.653 -0.407 -2.487 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.967 -2.039 -2.302 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.090 -0.627 -1.666 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.727 1.182 -4.079 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.157 1.069 -3.248 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.255 0.800 -5.004 1.00 0.00 H new ATOM 1258 N GLY A 78 1.863 -0.131 -4.596 1.00 0.00 N ATOM 1259 CA GLY A 78 2.766 0.983 -4.834 1.00 0.00 C ATOM 1260 C GLY A 78 3.202 1.077 -6.298 1.00 0.00 C ATOM 1261 O GLY A 78 2.862 2.035 -6.989 1.00 0.00 O ATOM 0 H GLY A 78 2.104 -0.679 -3.770 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.277 1.913 -4.543 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.647 0.875 -4.201 1.00 0.00 H new ATOM 1265 N ALA A 79 3.950 0.081 -6.774 1.00 0.00 N ATOM 1266 CA ALA A 79 4.523 0.045 -8.114 1.00 0.00 C ATOM 1267 C ALA A 79 3.462 0.248 -9.197 1.00 0.00 C ATOM 1268 O ALA A 79 3.661 1.022 -10.130 1.00 0.00 O ATOM 1269 CB ALA A 79 5.257 -1.283 -8.314 1.00 0.00 C ATOM 0 H ALA A 79 4.179 -0.745 -6.220 1.00 0.00 H new ATOM 0 HA ALA A 79 5.229 0.871 -8.208 1.00 0.00 H new ATOM 0 HB1 ALA A 79 5.687 -1.314 -9.315 1.00 0.00 H new ATOM 0 HB2 ALA A 79 6.052 -1.374 -7.574 1.00 0.00 H new ATOM 0 HB3 ALA A 79 4.555 -2.108 -8.195 1.00 0.00 H new ATOM 1275 N LEU A 80 2.332 -0.453 -9.081 1.00 0.00 N ATOM 1276 CA LEU A 80 1.219 -0.320 -10.007 1.00 0.00 C ATOM 1277 C LEU A 80 0.731 1.130 -10.007 1.00 0.00 C ATOM 1278 O LEU A 80 0.686 1.788 -11.046 1.00 0.00 O ATOM 1279 CB LEU A 80 0.114 -1.307 -9.596 1.00 0.00 C ATOM 1280 CG LEU A 80 -1.141 -1.256 -10.484 1.00 0.00 C ATOM 1281 CD1 LEU A 80 -0.838 -1.677 -11.926 1.00 0.00 C ATOM 1282 CD2 LEU A 80 -2.201 -2.191 -9.894 1.00 0.00 C ATOM 0 H LEU A 80 2.168 -1.131 -8.336 1.00 0.00 H new ATOM 0 HA LEU A 80 1.525 -0.561 -11.025 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.520 -2.318 -9.618 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -0.176 -1.102 -8.565 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.501 -0.227 -10.508 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -1.751 -1.627 -12.519 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.092 -1.006 -12.352 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.456 -2.698 -11.934 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.096 -2.164 -10.515 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -1.812 -3.209 -9.863 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -2.450 -1.867 -8.884 1.00 0.00 H new ATOM 1294 N ALA A 81 0.378 1.642 -8.828 1.00 0.00 N ATOM 1295 CA ALA A 81 -0.114 2.999 -8.673 1.00 0.00 C ATOM 1296 C ALA A 81 0.873 4.031 -9.213 1.00 0.00 C ATOM 1297 O ALA A 81 0.445 5.005 -9.823 1.00 0.00 O ATOM 1298 CB ALA A 81 -0.432 3.251 -7.208 1.00 0.00 C ATOM 0 H ALA A 81 0.428 1.120 -7.953 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.024 3.108 -9.263 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -0.802 4.269 -7.086 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -1.193 2.546 -6.874 1.00 0.00 H new ATOM 0 HB3 ALA A 81 0.471 3.119 -6.612 1.00 0.00 H new ATOM 1304 N MET A 82 2.181 3.813 -9.028 1.00 0.00 N ATOM 1305 CA MET A 82 3.234 4.696 -9.518 1.00 0.00 C ATOM 1306 C MET A 82 3.192 4.929 -11.035 1.00 0.00 C ATOM 1307 O MET A 82 3.811 5.879 -11.509 1.00 0.00 O ATOM 1308 CB MET A 82 4.614 4.204 -9.062 1.00 0.00 C ATOM 1309 CG MET A 82 4.861 4.496 -7.576 1.00 0.00 C ATOM 1310 SD MET A 82 6.270 3.617 -6.849 1.00 0.00 S ATOM 1311 CE MET A 82 7.627 4.269 -7.846 1.00 0.00 C ATOM 0 H MET A 82 2.538 3.002 -8.524 1.00 0.00 H new ATOM 0 HA MET A 82 3.045 5.672 -9.071 1.00 0.00 H new ATOM 0 HB2 MET A 82 4.695 3.132 -9.240 1.00 0.00 H new ATOM 0 HB3 MET A 82 5.387 4.685 -9.660 1.00 0.00 H new ATOM 0 HG2 MET A 82 5.017 5.568 -7.452 1.00 0.00 H new ATOM 0 HG3 MET A 82 3.962 4.238 -7.016 1.00 0.00 H new ATOM 0 HE1 MET A 82 8.570 3.849 -7.496 1.00 0.00 H new ATOM 0 HE2 MET A 82 7.474 3.997 -8.890 1.00 0.00 H new ATOM 0 HE3 MET A 82 7.657 5.355 -7.754 1.00 0.00 H new ATOM 1321 N ILE A 83 2.457 4.119 -11.807 1.00 0.00 N ATOM 1322 CA ILE A 83 2.202 4.437 -13.212 1.00 0.00 C ATOM 1323 C ILE A 83 1.504 5.805 -13.330 1.00 0.00 C ATOM 1324 O ILE A 83 1.701 6.516 -14.313 1.00 0.00 O ATOM 1325 CB ILE A 83 1.389 3.303 -13.868 1.00 0.00 C ATOM 1326 CG1 ILE A 83 2.147 1.958 -13.865 1.00 0.00 C ATOM 1327 CG2 ILE A 83 0.948 3.660 -15.295 1.00 0.00 C ATOM 1328 CD1 ILE A 83 3.378 1.910 -14.777 1.00 0.00 C ATOM 0 H ILE A 83 2.034 3.249 -11.485 1.00 0.00 H new ATOM 0 HA ILE A 83 3.147 4.513 -13.749 1.00 0.00 H new ATOM 0 HB ILE A 83 0.496 3.185 -13.255 1.00 0.00 H new ATOM 0 HG12 ILE A 83 2.460 1.736 -12.845 1.00 0.00 H new ATOM 0 HG13 ILE A 83 1.458 1.169 -14.166 1.00 0.00 H new ATOM 0 HG21 ILE A 83 0.379 2.832 -15.718 1.00 0.00 H new ATOM 0 HG22 ILE A 83 0.325 4.554 -15.270 1.00 0.00 H new ATOM 0 HG23 ILE A 83 1.827 3.848 -15.911 1.00 0.00 H new ATOM 0 HD11 ILE A 83 3.844 0.927 -14.708 1.00 0.00 H new ATOM 0 HD12 ILE A 83 3.075 2.096 -15.807 1.00 0.00 H new ATOM 0 HD13 ILE A 83 4.092 2.672 -14.465 1.00 0.00 H new ATOM 1340 N TYR A 84 0.687 6.169 -12.334 1.00 0.00 N ATOM 1341 CA TYR A 84 0.012 7.455 -12.217 1.00 0.00 C ATOM 1342 C TYR A 84 -0.742 7.826 -13.496 1.00 0.00 C ATOM 1343 O TYR A 84 -0.622 8.938 -14.008 1.00 0.00 O ATOM 1344 CB TYR A 84 0.984 8.550 -11.739 1.00 0.00 C ATOM 1345 CG TYR A 84 1.656 8.308 -10.394 1.00 0.00 C ATOM 1346 CD1 TYR A 84 0.904 7.878 -9.284 1.00 0.00 C ATOM 1347 CD2 TYR A 84 3.021 8.611 -10.220 1.00 0.00 C ATOM 1348 CE1 TYR A 84 1.506 7.718 -8.027 1.00 0.00 C ATOM 1349 CE2 TYR A 84 3.620 8.482 -8.954 1.00 0.00 C ATOM 1350 CZ TYR A 84 2.858 8.051 -7.856 1.00 0.00 C ATOM 1351 OH TYR A 84 3.437 7.917 -6.631 1.00 0.00 O ATOM 0 H TYR A 84 0.473 5.544 -11.557 1.00 0.00 H new ATOM 0 HA TYR A 84 -0.754 7.365 -11.446 1.00 0.00 H new ATOM 0 HB2 TYR A 84 1.761 8.673 -12.494 1.00 0.00 H new ATOM 0 HB3 TYR A 84 0.440 9.493 -11.686 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -0.149 7.669 -9.402 1.00 0.00 H new ATOM 0 HD2 TYR A 84 3.610 8.944 -11.062 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.931 7.340 -7.195 1.00 0.00 H new ATOM 0 HE2 TYR A 84 4.667 8.715 -8.826 1.00 0.00 H new ATOM 0 HH TYR A 84 2.864 7.367 -6.057 1.00 0.00 H new ATOM 1361 N ASN A 85 -1.579 6.893 -13.962 1.00 0.00 N ATOM 1362 CA ASN A 85 -2.465 7.045 -15.112 1.00 0.00 C ATOM 1363 C ASN A 85 -3.135 8.423 -15.126 1.00 0.00 C ATOM 1364 O ASN A 85 -4.042 8.674 -14.330 1.00 0.00 O ATOM 1365 CB ASN A 85 -3.526 5.936 -15.079 1.00 0.00 C ATOM 1366 CG ASN A 85 -4.565 6.090 -16.190 1.00 0.00 C ATOM 1367 OD1 ASN A 85 -4.517 5.387 -17.192 1.00 0.00 O ATOM 1368 ND2 ASN A 85 -5.516 7.006 -16.023 1.00 0.00 N ATOM 0 H ASN A 85 -1.658 5.974 -13.527 1.00 0.00 H new ATOM 0 HA ASN A 85 -1.872 6.962 -16.023 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -3.037 4.966 -15.174 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -4.028 5.946 -14.112 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -6.230 7.137 -16.740 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -5.531 7.577 -15.178 1.00 0.00 H new ATOM 1375 N GLU A 86 -2.716 9.298 -16.043 1.00 0.00 N ATOM 1376 CA GLU A 86 -3.285 10.629 -16.208 1.00 0.00 C ATOM 1377 C GLU A 86 -3.151 11.437 -14.910 1.00 0.00 C ATOM 1378 O GLU A 86 -4.082 12.128 -14.505 1.00 0.00 O ATOM 1379 CB GLU A 86 -4.728 10.499 -16.730 1.00 0.00 C ATOM 1380 CG GLU A 86 -5.283 11.794 -17.346 1.00 0.00 C ATOM 1381 CD GLU A 86 -6.727 11.641 -17.823 1.00 0.00 C ATOM 1382 OE1 GLU A 86 -7.359 10.628 -17.450 1.00 0.00 O ATOM 1383 OE2 GLU A 86 -7.175 12.551 -18.553 1.00 0.00 O ATOM 0 H GLU A 86 -1.961 9.095 -16.699 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.732 11.197 -16.955 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.764 9.707 -17.478 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -5.375 10.192 -15.909 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.230 12.595 -16.609 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.655 12.091 -18.186 1.00 0.00 H new ATOM 1390 N ALA A 87 -1.999 11.318 -14.237 1.00 0.00 N ATOM 1391 CA ALA A 87 -1.786 11.868 -12.904 1.00 0.00 C ATOM 1392 C ALA A 87 -2.929 11.417 -11.997 1.00 0.00 C ATOM 1393 O ALA A 87 -3.644 12.236 -11.426 1.00 0.00 O ATOM 1394 CB ALA A 87 -1.629 13.393 -12.961 1.00 0.00 C ATOM 0 H ALA A 87 -1.185 10.831 -14.612 1.00 0.00 H new ATOM 0 HA ALA A 87 -0.854 11.490 -12.483 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -1.471 13.780 -11.954 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -0.773 13.648 -13.586 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -2.531 13.836 -13.383 1.00 0.00 H new ATOM 1400 N LEU A 88 -3.142 10.097 -11.948 1.00 0.00 N ATOM 1401 CA LEU A 88 -4.275 9.459 -11.283 1.00 0.00 C ATOM 1402 C LEU A 88 -5.583 10.177 -11.626 1.00 0.00 C ATOM 1403 O LEU A 88 -6.367 10.513 -10.741 1.00 0.00 O ATOM 1404 CB LEU A 88 -4.024 9.370 -9.770 1.00 0.00 C ATOM 1405 CG LEU A 88 -2.802 8.509 -9.413 1.00 0.00 C ATOM 1406 CD1 LEU A 88 -2.479 8.685 -7.925 1.00 0.00 C ATOM 1407 CD2 LEU A 88 -3.047 7.026 -9.725 1.00 0.00 C ATOM 0 H LEU A 88 -2.509 9.426 -12.384 1.00 0.00 H new ATOM 0 HA LEU A 88 -4.377 8.438 -11.651 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.883 10.375 -9.371 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -4.908 8.956 -9.285 1.00 0.00 H new ATOM 0 HG LEU A 88 -1.959 8.839 -10.020 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.613 8.076 -7.666 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -2.260 9.733 -7.722 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.335 8.371 -7.327 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.162 6.447 -9.460 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -3.900 6.669 -9.148 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.253 6.907 -10.789 1.00 0.00 H new ATOM 1479 N SER B 3 -14.363 -4.878 -9.414 1.00 0.00 N ATOM 1480 CA SER B 3 -13.938 -6.040 -8.643 1.00 0.00 C ATOM 1481 C SER B 3 -13.458 -5.530 -7.281 1.00 0.00 C ATOM 1482 O SER B 3 -13.003 -4.388 -7.223 1.00 0.00 O ATOM 1483 CB SER B 3 -12.812 -6.784 -9.376 1.00 0.00 C ATOM 1484 OG SER B 3 -13.340 -7.487 -10.479 1.00 0.00 O ATOM 0 HA SER B 3 -14.761 -6.744 -8.516 1.00 0.00 H new ATOM 0 HB2 SER B 3 -12.056 -6.075 -9.714 1.00 0.00 H new ATOM 0 HB3 SER B 3 -12.318 -7.477 -8.695 1.00 0.00 H new ATOM 0 HG SER B 3 -12.617 -7.958 -10.943 1.00 0.00 H new ATOM 1490 N PRO B 4 -13.530 -6.328 -6.200 1.00 0.00 N ATOM 1491 CA PRO B 4 -13.158 -5.901 -4.857 1.00 0.00 C ATOM 1492 C PRO B 4 -11.822 -5.154 -4.799 1.00 0.00 C ATOM 1493 O PRO B 4 -11.753 -4.035 -4.296 1.00 0.00 O ATOM 1494 CB PRO B 4 -13.151 -7.176 -4.011 1.00 0.00 C ATOM 1495 CG PRO B 4 -14.218 -8.032 -4.688 1.00 0.00 C ATOM 1496 CD PRO B 4 -14.054 -7.687 -6.168 1.00 0.00 C ATOM 0 HA PRO B 4 -13.871 -5.169 -4.478 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -12.176 -7.663 -4.020 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -13.396 -6.972 -2.969 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -14.060 -9.094 -4.502 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -15.217 -7.790 -4.326 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -13.372 -8.381 -6.659 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -15.007 -7.752 -6.693 1.00 0.00 H new ATOM 1504 N LEU B 5 -10.759 -5.759 -5.334 1.00 0.00 N ATOM 1505 CA LEU B 5 -9.440 -5.140 -5.369 1.00 0.00 C ATOM 1506 C LEU B 5 -9.476 -3.787 -6.081 1.00 0.00 C ATOM 1507 O LEU B 5 -8.920 -2.814 -5.578 1.00 0.00 O ATOM 1508 CB LEU B 5 -8.380 -6.081 -5.966 1.00 0.00 C ATOM 1509 CG LEU B 5 -8.817 -6.850 -7.229 1.00 0.00 C ATOM 1510 CD1 LEU B 5 -7.676 -6.884 -8.252 1.00 0.00 C ATOM 1511 CD2 LEU B 5 -9.193 -8.292 -6.864 1.00 0.00 C ATOM 0 H LEU B 5 -10.792 -6.688 -5.753 1.00 0.00 H new ATOM 0 HA LEU B 5 -9.142 -4.951 -4.338 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -7.492 -5.496 -6.206 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -8.089 -6.803 -5.204 1.00 0.00 H new ATOM 0 HG LEU B 5 -9.679 -6.340 -7.658 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -7.998 -7.430 -9.139 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -7.407 -5.865 -8.531 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -6.810 -7.381 -7.815 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -9.500 -8.827 -7.763 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -8.331 -8.792 -6.421 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -10.015 -8.284 -6.148 1.00 0.00 H new ATOM 1523 N ASP B 6 -10.152 -3.720 -7.231 1.00 0.00 N ATOM 1524 CA ASP B 6 -10.264 -2.502 -8.020 1.00 0.00 C ATOM 1525 C ASP B 6 -10.998 -1.416 -7.236 1.00 0.00 C ATOM 1526 O ASP B 6 -10.546 -0.275 -7.156 1.00 0.00 O ATOM 1527 CB ASP B 6 -10.937 -2.815 -9.362 1.00 0.00 C ATOM 1528 CG ASP B 6 -11.330 -1.546 -10.109 1.00 0.00 C ATOM 1529 OD1 ASP B 6 -10.416 -0.913 -10.678 1.00 0.00 O ATOM 1530 OD2 ASP B 6 -12.543 -1.240 -10.094 1.00 0.00 O ATOM 0 H ASP B 6 -10.639 -4.518 -7.639 1.00 0.00 H new ATOM 0 HA ASP B 6 -9.269 -2.112 -8.233 1.00 0.00 H new ATOM 0 HB2 ASP B 6 -10.259 -3.405 -9.979 1.00 0.00 H new ATOM 0 HB3 ASP B 6 -11.824 -3.425 -9.190 1.00 0.00 H new ATOM 1535 N GLN B 7 -12.123 -1.784 -6.627 1.00 0.00 N ATOM 1536 CA GLN B 7 -12.873 -0.897 -5.757 1.00 0.00 C ATOM 1537 C GLN B 7 -11.969 -0.408 -4.623 1.00 0.00 C ATOM 1538 O GLN B 7 -11.955 0.778 -4.310 1.00 0.00 O ATOM 1539 CB GLN B 7 -14.106 -1.636 -5.222 1.00 0.00 C ATOM 1540 CG GLN B 7 -15.090 -1.966 -6.354 1.00 0.00 C ATOM 1541 CD GLN B 7 -16.023 -3.112 -5.983 1.00 0.00 C ATOM 1542 OE1 GLN B 7 -16.070 -4.129 -6.668 1.00 0.00 O ATOM 1543 NE2 GLN B 7 -16.770 -2.968 -4.892 1.00 0.00 N ATOM 0 H GLN B 7 -12.537 -2.711 -6.727 1.00 0.00 H new ATOM 0 HA GLN B 7 -13.216 -0.023 -6.311 1.00 0.00 H new ATOM 0 HB2 GLN B 7 -13.795 -2.556 -4.727 1.00 0.00 H new ATOM 0 HB3 GLN B 7 -14.604 -1.022 -4.471 1.00 0.00 H new ATOM 0 HG2 GLN B 7 -15.680 -1.081 -6.591 1.00 0.00 H new ATOM 0 HG3 GLN B 7 -14.533 -2.229 -7.253 1.00 0.00 H new ATOM 0 HE21 GLN B 7 -16.710 -2.111 -4.342 1.00 0.00 H new ATOM 0 HE22 GLN B 7 -17.403 -3.715 -4.605 1.00 0.00 H new ATOM 1552 N ALA B 8 -11.205 -1.314 -4.011 1.00 0.00 N ATOM 1553 CA ALA B 8 -10.421 -0.999 -2.824 1.00 0.00 C ATOM 1554 C ALA B 8 -9.290 -0.030 -3.165 1.00 0.00 C ATOM 1555 O ALA B 8 -9.172 1.034 -2.551 1.00 0.00 O ATOM 1556 CB ALA B 8 -9.893 -2.285 -2.187 1.00 0.00 C ATOM 0 H ALA B 8 -11.115 -2.280 -4.325 1.00 0.00 H new ATOM 0 HA ALA B 8 -11.063 -0.503 -2.096 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -9.308 -2.039 -1.301 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -10.731 -2.921 -1.903 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -9.262 -2.813 -2.902 1.00 0.00 H new ATOM 1562 N ILE B 9 -8.465 -0.394 -4.152 1.00 0.00 N ATOM 1563 CA ILE B 9 -7.376 0.461 -4.605 1.00 0.00 C ATOM 1564 C ILE B 9 -7.949 1.801 -5.075 1.00 0.00 C ATOM 1565 O ILE B 9 -7.457 2.857 -4.676 1.00 0.00 O ATOM 1566 CB ILE B 9 -6.490 -0.260 -5.644 1.00 0.00 C ATOM 1567 CG1 ILE B 9 -5.166 0.493 -5.817 1.00 0.00 C ATOM 1568 CG2 ILE B 9 -7.174 -0.427 -7.004 1.00 0.00 C ATOM 1569 CD1 ILE B 9 -4.215 -0.187 -6.809 1.00 0.00 C ATOM 0 H ILE B 9 -8.536 -1.281 -4.651 1.00 0.00 H new ATOM 0 HA ILE B 9 -6.700 0.682 -3.779 1.00 0.00 H new ATOM 0 HB ILE B 9 -6.305 -1.262 -5.257 1.00 0.00 H new ATOM 0 HG12 ILE B 9 -5.373 1.507 -6.158 1.00 0.00 H new ATOM 0 HG13 ILE B 9 -4.673 0.577 -4.849 1.00 0.00 H new ATOM 0 HG21 ILE B 9 -6.500 -0.940 -7.690 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -8.085 -1.013 -6.884 1.00 0.00 H new ATOM 0 HG23 ILE B 9 -7.425 0.554 -7.408 1.00 0.00 H new ATOM 0 HD11 ILE B 9 -3.296 0.393 -6.888 1.00 0.00 H new ATOM 0 HD12 ILE B 9 -3.980 -1.192 -6.458 1.00 0.00 H new ATOM 0 HD13 ILE B 9 -4.692 -0.247 -7.787 1.00 0.00 H new ATOM 1581 N GLY B 10 -9.027 1.762 -5.869 1.00 0.00 N ATOM 1582 CA GLY B 10 -9.742 2.946 -6.313 1.00 0.00 C ATOM 1583 C GLY B 10 -10.081 3.853 -5.133 1.00 0.00 C ATOM 1584 O GLY B 10 -9.728 5.029 -5.138 1.00 0.00 O ATOM 0 H GLY B 10 -9.425 0.891 -6.221 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -9.135 3.493 -7.034 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -10.658 2.652 -6.825 1.00 0.00 H new ATOM 1588 N LEU B 11 -10.742 3.303 -4.109 1.00 0.00 N ATOM 1589 CA LEU B 11 -11.089 4.047 -2.910 1.00 0.00 C ATOM 1590 C LEU B 11 -9.840 4.648 -2.265 1.00 0.00 C ATOM 1591 O LEU B 11 -9.748 5.867 -2.165 1.00 0.00 O ATOM 1592 CB LEU B 11 -11.882 3.176 -1.915 1.00 0.00 C ATOM 1593 CG LEU B 11 -13.401 3.427 -1.903 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -13.742 4.811 -1.332 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -14.058 3.239 -3.276 1.00 0.00 C ATOM 0 H LEU B 11 -11.048 2.330 -4.095 1.00 0.00 H new ATOM 0 HA LEU B 11 -11.741 4.870 -3.202 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -11.703 2.127 -2.150 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -11.492 3.349 -0.912 1.00 0.00 H new ATOM 0 HG LEU B 11 -13.817 2.664 -1.245 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -14.823 4.952 -1.340 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -13.374 4.883 -0.309 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -13.271 5.582 -1.942 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -15.128 3.431 -3.197 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -13.616 3.935 -3.989 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -13.897 2.217 -3.619 1.00 0.00 H new ATOM 1607 N LEU B 12 -8.883 3.838 -1.802 1.00 0.00 N ATOM 1608 CA LEU B 12 -7.784 4.389 -1.005 1.00 0.00 C ATOM 1609 C LEU B 12 -6.948 5.401 -1.799 1.00 0.00 C ATOM 1610 O LEU B 12 -6.550 6.442 -1.258 1.00 0.00 O ATOM 1611 CB LEU B 12 -6.956 3.284 -0.330 1.00 0.00 C ATOM 1612 CG LEU B 12 -6.177 2.383 -1.296 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -4.717 2.835 -1.437 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -6.207 0.940 -0.783 1.00 0.00 C ATOM 0 H LEU B 12 -8.845 2.831 -1.958 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.222 4.961 -0.187 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -6.251 3.748 0.360 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -7.624 2.662 0.266 1.00 0.00 H new ATOM 0 HG LEU B 12 -6.652 2.450 -2.275 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -4.196 2.173 -2.129 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -4.687 3.855 -1.819 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -4.229 2.798 -0.463 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -5.654 0.298 -1.469 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -5.749 0.896 0.205 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -7.240 0.598 -0.720 1.00 0.00 H new ATOM 1626 N ILE B 13 -6.699 5.127 -3.085 1.00 0.00 N ATOM 1627 CA ILE B 13 -6.004 6.078 -3.937 1.00 0.00 C ATOM 1628 C ILE B 13 -6.860 7.330 -4.114 1.00 0.00 C ATOM 1629 O ILE B 13 -6.331 8.430 -4.012 1.00 0.00 O ATOM 1630 CB ILE B 13 -5.566 5.446 -5.271 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -4.529 4.342 -4.983 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -4.954 6.514 -6.191 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -3.896 3.762 -6.250 1.00 0.00 C ATOM 0 H ILE B 13 -6.969 4.259 -3.549 1.00 0.00 H new ATOM 0 HA ILE B 13 -5.077 6.379 -3.450 1.00 0.00 H new ATOM 0 HB ILE B 13 -6.433 5.017 -5.772 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -3.743 4.748 -4.346 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -5.009 3.539 -4.424 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -4.649 6.053 -7.130 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -5.694 7.289 -6.391 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -4.085 6.958 -5.705 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -3.176 2.991 -5.977 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -4.673 3.327 -6.878 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -3.388 4.555 -6.798 1.00 0.00 H new ATOM 1645 N GLY B 14 -8.167 7.199 -4.352 1.00 0.00 N ATOM 1646 CA GLY B 14 -9.063 8.342 -4.459 1.00 0.00 C ATOM 1647 C GLY B 14 -8.996 9.216 -3.205 1.00 0.00 C ATOM 1648 O GLY B 14 -8.749 10.417 -3.285 1.00 0.00 O ATOM 0 H GLY B 14 -8.629 6.298 -4.475 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -8.797 8.935 -5.334 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -10.085 7.994 -4.609 1.00 0.00 H new ATOM 1652 N ILE B 15 -9.198 8.604 -2.036 1.00 0.00 N ATOM 1653 CA ILE B 15 -9.143 9.271 -0.743 1.00 0.00 C ATOM 1654 C ILE B 15 -7.812 10.006 -0.566 1.00 0.00 C ATOM 1655 O ILE B 15 -7.796 11.106 -0.019 1.00 0.00 O ATOM 1656 CB ILE B 15 -9.424 8.255 0.382 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -10.872 7.721 0.350 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -9.105 8.826 1.770 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -11.968 8.791 0.400 1.00 0.00 C ATOM 0 H ILE B 15 -9.409 7.608 -1.966 1.00 0.00 H new ATOM 0 HA ILE B 15 -9.920 10.033 -0.692 1.00 0.00 H new ATOM 0 HB ILE B 15 -8.754 7.417 0.193 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -11.004 7.132 -0.557 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -11.010 7.044 1.193 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -9.319 8.075 2.530 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.051 9.101 1.817 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -9.718 9.709 1.950 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -12.946 8.311 0.372 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -11.872 9.367 1.320 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -11.866 9.457 -0.457 1.00 0.00 H new ATOM 1671 N PHE B 16 -6.703 9.429 -1.031 1.00 0.00 N ATOM 1672 CA PHE B 16 -5.432 10.145 -1.059 1.00 0.00 C ATOM 1673 C PHE B 16 -5.471 11.326 -2.037 1.00 0.00 C ATOM 1674 O PHE B 16 -5.335 12.491 -1.652 1.00 0.00 O ATOM 1675 CB PHE B 16 -4.319 9.138 -1.382 1.00 0.00 C ATOM 1676 CG PHE B 16 -2.919 9.700 -1.514 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -2.444 10.127 -2.768 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -2.052 9.695 -0.406 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -1.131 10.609 -2.899 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -0.726 10.136 -0.547 1.00 0.00 C ATOM 1681 CZ PHE B 16 -0.268 10.599 -1.790 1.00 0.00 C ATOM 0 H PHE B 16 -6.661 8.475 -1.390 1.00 0.00 H new ATOM 0 HA PHE B 16 -5.230 10.588 -0.084 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -4.309 8.377 -0.601 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -4.574 8.634 -2.314 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -3.091 10.084 -3.632 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -2.407 9.351 0.555 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -0.786 10.986 -3.850 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -0.058 10.119 0.302 1.00 0.00 H new ATOM 0 HZ PHE B 16 0.749 10.948 -1.894 1.00 0.00 H new ATOM 1691 N HIS B 17 -5.652 11.017 -3.320 1.00 0.00 N ATOM 1692 CA HIS B 17 -5.497 11.943 -4.426 1.00 0.00 C ATOM 1693 C HIS B 17 -6.503 13.093 -4.372 1.00 0.00 C ATOM 1694 O HIS B 17 -6.255 14.147 -4.957 1.00 0.00 O ATOM 1695 CB HIS B 17 -5.563 11.182 -5.760 1.00 0.00 C ATOM 1696 CG HIS B 17 -4.773 11.854 -6.854 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -5.266 12.557 -7.931 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -3.406 11.928 -6.909 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -4.214 13.057 -8.600 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -3.060 12.699 -8.018 1.00 0.00 N ATOM 0 H HIS B 17 -5.920 10.080 -3.622 1.00 0.00 H new ATOM 0 HA HIS B 17 -4.514 12.407 -4.341 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -5.186 10.170 -5.615 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -6.604 11.093 -6.071 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -6.249 12.676 -8.176 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -2.717 11.469 -6.215 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -4.288 13.666 -9.489 1.00 0.00 H new ATOM 1708 N LYS B 18 -7.631 12.919 -3.671 1.00 0.00 N ATOM 1709 CA LYS B 18 -8.573 14.020 -3.531 1.00 0.00 C ATOM 1710 C LYS B 18 -7.893 15.192 -2.822 1.00 0.00 C ATOM 1711 O LYS B 18 -8.142 16.341 -3.167 1.00 0.00 O ATOM 1712 CB LYS B 18 -9.917 13.607 -2.916 1.00 0.00 C ATOM 1713 CG LYS B 18 -9.903 13.464 -1.393 1.00 0.00 C ATOM 1714 CD LYS B 18 -11.314 13.122 -0.898 1.00 0.00 C ATOM 1715 CE LYS B 18 -11.381 13.170 0.630 1.00 0.00 C ATOM 1716 NZ LYS B 18 -10.504 12.158 1.237 1.00 0.00 N ATOM 0 H LYS B 18 -7.902 12.052 -3.207 1.00 0.00 H new ATOM 0 HA LYS B 18 -8.854 14.357 -4.529 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -10.670 14.345 -3.192 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -10.226 12.658 -3.354 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -9.203 12.683 -1.097 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -9.560 14.391 -0.933 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -12.032 13.825 -1.320 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -11.596 12.129 -1.248 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -11.090 14.161 0.978 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -12.408 13.006 0.956 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -11.062 11.550 1.870 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -10.074 11.578 0.489 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -9.755 12.630 1.783 1.00 0.00 H new ATOM 1730 N TYR B 19 -7.025 14.903 -1.843 1.00 0.00 N ATOM 1731 CA TYR B 19 -6.153 15.920 -1.281 1.00 0.00 C ATOM 1732 C TYR B 19 -4.953 16.065 -2.221 1.00 0.00 C ATOM 1733 O TYR B 19 -4.779 17.080 -2.901 1.00 0.00 O ATOM 1734 CB TYR B 19 -5.708 15.547 0.144 1.00 0.00 C ATOM 1735 CG TYR B 19 -6.801 15.070 1.076 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -7.718 15.984 1.627 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -6.825 13.723 1.483 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -8.668 15.545 2.566 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -7.749 13.294 2.447 1.00 0.00 C ATOM 1740 CZ TYR B 19 -8.678 14.202 2.979 1.00 0.00 C ATOM 1741 OH TYR B 19 -9.645 13.753 3.827 1.00 0.00 O ATOM 0 H TYR B 19 -6.915 13.976 -1.432 1.00 0.00 H new ATOM 0 HA TYR B 19 -6.682 16.869 -1.197 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -4.951 14.766 0.074 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -5.229 16.417 0.593 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -7.692 17.022 1.329 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -6.130 13.018 1.052 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -9.390 16.240 2.970 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -7.746 12.266 2.780 1.00 0.00 H new ATOM 0 HH TYR B 19 -9.602 12.776 3.884 1.00 0.00 H new ATOM 1751 N SER B 20 -4.142 15.005 -2.264 1.00 0.00 N ATOM 1752 CA SER B 20 -2.829 14.939 -2.878 1.00 0.00 C ATOM 1753 C SER B 20 -2.918 14.812 -4.396 1.00 0.00 C ATOM 1754 O SER B 20 -2.439 13.835 -4.966 1.00 0.00 O ATOM 1755 CB SER B 20 -2.131 13.725 -2.261 1.00 0.00 C ATOM 1756 OG SER B 20 -2.071 13.887 -0.861 1.00 0.00 O ATOM 0 H SER B 20 -4.410 14.116 -1.841 1.00 0.00 H new ATOM 0 HA SER B 20 -2.270 15.856 -2.692 1.00 0.00 H new ATOM 0 HB2 SER B 20 -2.673 12.813 -2.511 1.00 0.00 H new ATOM 0 HB3 SER B 20 -1.126 13.621 -2.671 1.00 0.00 H new ATOM 0 HG SER B 20 -1.331 14.487 -0.633 1.00 0.00 H new ATOM 1762 N GLY B 21 -3.558 15.791 -5.030 1.00 0.00 N ATOM 1763 CA GLY B 21 -3.880 15.785 -6.443 1.00 0.00 C ATOM 1764 C GLY B 21 -4.562 17.100 -6.780 1.00 0.00 C ATOM 1765 O GLY B 21 -4.016 17.930 -7.505 1.00 0.00 O ATOM 0 H GLY B 21 -3.875 16.635 -4.553 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -2.975 15.662 -7.039 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -4.534 14.946 -6.680 1.00 0.00 H new ATOM 1769 N LYS B 22 -5.750 17.314 -6.213 1.00 0.00 N ATOM 1770 CA LYS B 22 -6.471 18.565 -6.398 1.00 0.00 C ATOM 1771 C LYS B 22 -5.678 19.710 -5.765 1.00 0.00 C ATOM 1772 O LYS B 22 -5.612 20.797 -6.338 1.00 0.00 O ATOM 1773 CB LYS B 22 -7.890 18.490 -5.823 1.00 0.00 C ATOM 1774 CG LYS B 22 -8.870 17.652 -6.662 1.00 0.00 C ATOM 1775 CD LYS B 22 -8.415 16.203 -6.875 1.00 0.00 C ATOM 1776 CE LYS B 22 -9.577 15.320 -7.337 1.00 0.00 C ATOM 1777 NZ LYS B 22 -9.153 13.919 -7.497 1.00 0.00 N ATOM 0 H LYS B 22 -6.230 16.635 -5.623 1.00 0.00 H new ATOM 0 HA LYS B 22 -6.574 18.752 -7.467 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -7.840 18.071 -4.818 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -8.285 19.502 -5.728 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -9.844 17.650 -6.172 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -9.003 18.129 -7.633 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -7.617 16.175 -7.616 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -8.002 15.809 -5.947 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -10.389 15.376 -6.613 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -9.967 15.694 -8.283 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -9.962 13.345 -7.811 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -8.394 13.865 -8.206 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -8.803 13.556 -6.587 1.00 0.00 H new ATOM 1791 N GLU B 23 -5.039 19.474 -4.611 1.00 0.00 N ATOM 1792 CA GLU B 23 -4.157 20.460 -4.000 1.00 0.00 C ATOM 1793 C GLU B 23 -2.832 20.535 -4.776 1.00 0.00 C ATOM 1794 O GLU B 23 -1.776 20.185 -4.258 1.00 0.00 O ATOM 1795 CB GLU B 23 -3.962 20.155 -2.506 1.00 0.00 C ATOM 1796 CG GLU B 23 -5.306 20.186 -1.759 1.00 0.00 C ATOM 1797 CD GLU B 23 -5.149 19.950 -0.258 1.00 0.00 C ATOM 1798 OE1 GLU B 23 -4.356 20.693 0.358 1.00 0.00 O ATOM 1799 OE2 GLU B 23 -5.836 19.038 0.253 1.00 0.00 O ATOM 0 H GLU B 23 -5.121 18.604 -4.086 1.00 0.00 H new ATOM 0 HA GLU B 23 -4.615 21.447 -4.057 1.00 0.00 H new ATOM 0 HB2 GLU B 23 -3.499 19.175 -2.388 1.00 0.00 H new ATOM 0 HB3 GLU B 23 -3.281 20.885 -2.068 1.00 0.00 H new ATOM 0 HG2 GLU B 23 -5.787 21.150 -1.923 1.00 0.00 H new ATOM 0 HG3 GLU B 23 -5.967 19.426 -2.176 1.00 0.00 H new ATOM 1806 N GLY B 24 -2.894 21.019 -6.018 1.00 0.00 N ATOM 1807 CA GLY B 24 -1.738 21.347 -6.838 1.00 0.00 C ATOM 1808 C GLY B 24 -0.872 20.133 -7.176 1.00 0.00 C ATOM 1809 O GLY B 24 0.349 20.200 -7.044 1.00 0.00 O ATOM 0 H GLY B 24 -3.780 21.197 -6.491 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -2.078 21.811 -7.764 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -1.129 22.085 -6.316 1.00 0.00 H new ATOM 1813 N ASP B 25 -1.488 19.042 -7.642 1.00 0.00 N ATOM 1814 CA ASP B 25 -0.847 17.814 -8.116 1.00 0.00 C ATOM 1815 C ASP B 25 -0.235 16.981 -6.989 1.00 0.00 C ATOM 1816 O ASP B 25 -0.546 15.799 -6.894 1.00 0.00 O ATOM 1817 CB ASP B 25 0.164 18.066 -9.242 1.00 0.00 C ATOM 1818 CG ASP B 25 0.724 16.740 -9.752 1.00 0.00 C ATOM 1819 OD1 ASP B 25 0.075 16.155 -10.646 1.00 0.00 O ATOM 1820 OD2 ASP B 25 1.780 16.329 -9.224 1.00 0.00 O ATOM 0 H ASP B 25 -2.505 18.991 -7.701 1.00 0.00 H new ATOM 0 HA ASP B 25 -1.655 17.218 -8.541 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -0.317 18.605 -10.059 1.00 0.00 H new ATOM 0 HB3 ASP B 25 0.975 18.696 -8.878 1.00 0.00 H new ATOM 1825 N LYS B 26 0.648 17.588 -6.187 1.00 0.00 N ATOM 1826 CA LYS B 26 1.339 17.036 -5.023 1.00 0.00 C ATOM 1827 C LYS B 26 0.906 15.611 -4.662 1.00 0.00 C ATOM 1828 O LYS B 26 -0.002 15.441 -3.853 1.00 0.00 O ATOM 1829 CB LYS B 26 1.092 17.948 -3.810 1.00 0.00 C ATOM 1830 CG LYS B 26 1.786 19.314 -3.895 1.00 0.00 C ATOM 1831 CD LYS B 26 1.333 20.235 -2.752 1.00 0.00 C ATOM 1832 CE LYS B 26 1.716 19.712 -1.362 1.00 0.00 C ATOM 1833 NZ LYS B 26 1.226 20.613 -0.306 1.00 0.00 N ATOM 0 H LYS B 26 0.917 18.558 -6.352 1.00 0.00 H new ATOM 0 HA LYS B 26 2.396 16.989 -5.286 1.00 0.00 H new ATOM 0 HB2 LYS B 26 0.019 18.105 -3.701 1.00 0.00 H new ATOM 0 HB3 LYS B 26 1.432 17.436 -2.910 1.00 0.00 H new ATOM 0 HG2 LYS B 26 2.867 19.180 -3.852 1.00 0.00 H new ATOM 0 HG3 LYS B 26 1.561 19.781 -4.854 1.00 0.00 H new ATOM 0 HD2 LYS B 26 1.772 21.222 -2.895 1.00 0.00 H new ATOM 0 HD3 LYS B 26 0.251 20.358 -2.801 1.00 0.00 H new ATOM 0 HE2 LYS B 26 1.299 18.715 -1.217 1.00 0.00 H new ATOM 0 HE3 LYS B 26 2.800 19.618 -1.291 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 1.795 20.481 0.554 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 1.306 21.599 -0.626 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 0.230 20.396 -0.099 1.00 0.00 H new ATOM 1847 N HIS B 27 1.579 14.581 -5.189 1.00 0.00 N ATOM 1848 CA HIS B 27 1.314 13.191 -4.814 1.00 0.00 C ATOM 1849 C HIS B 27 1.928 12.885 -3.435 1.00 0.00 C ATOM 1850 O HIS B 27 2.663 11.910 -3.255 1.00 0.00 O ATOM 1851 CB HIS B 27 1.834 12.241 -5.904 1.00 0.00 C ATOM 1852 CG HIS B 27 1.163 12.374 -7.252 1.00 0.00 C ATOM 1853 ND1 HIS B 27 0.166 13.256 -7.609 1.00 0.00 N ATOM 1854 CD2 HIS B 27 1.451 11.621 -8.359 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -0.124 13.040 -8.904 1.00 0.00 C ATOM 1856 NE2 HIS B 27 0.629 12.047 -9.405 1.00 0.00 N ATOM 0 H HIS B 27 2.318 14.689 -5.883 1.00 0.00 H new ATOM 0 HA HIS B 27 0.238 13.036 -4.732 1.00 0.00 H new ATOM 0 HB2 HIS B 27 2.903 12.411 -6.031 1.00 0.00 H new ATOM 0 HB3 HIS B 27 1.713 11.215 -5.556 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -0.273 13.948 -7.001 1.00 0.00 H new ATOM 0 HD2 HIS B 27 2.187 10.833 -8.414 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -0.863 13.591 -9.466 1.00 0.00 H new ATOM 1864 N THR B 28 1.641 13.744 -2.456 1.00 0.00 N ATOM 1865 CA THR B 28 2.094 13.662 -1.088 1.00 0.00 C ATOM 1866 C THR B 28 1.000 14.253 -0.194 1.00 0.00 C ATOM 1867 O THR B 28 0.309 15.190 -0.596 1.00 0.00 O ATOM 1868 CB THR B 28 3.453 14.377 -0.962 1.00 0.00 C ATOM 1869 OG1 THR B 28 3.898 14.392 0.374 1.00 0.00 O ATOM 1870 CG2 THR B 28 3.440 15.821 -1.474 1.00 0.00 C ATOM 0 H THR B 28 1.051 14.560 -2.618 1.00 0.00 H new ATOM 0 HA THR B 28 2.260 12.633 -0.768 1.00 0.00 H new ATOM 0 HB THR B 28 4.131 13.800 -1.591 1.00 0.00 H new ATOM 0 HG1 THR B 28 3.474 13.660 0.868 1.00 0.00 H new ATOM 0 HG21 THR B 28 4.431 16.259 -1.353 1.00 0.00 H new ATOM 0 HG22 THR B 28 3.166 15.831 -2.529 1.00 0.00 H new ATOM 0 HG23 THR B 28 2.714 16.402 -0.905 1.00 0.00 H new ATOM 1878 N LEU B 29 0.837 13.702 1.007 1.00 0.00 N ATOM 1879 CA LEU B 29 0.020 14.272 2.061 1.00 0.00 C ATOM 1880 C LEU B 29 0.977 15.112 2.904 1.00 0.00 C ATOM 1881 O LEU B 29 1.684 14.583 3.762 1.00 0.00 O ATOM 1882 CB LEU B 29 -0.616 13.163 2.916 1.00 0.00 C ATOM 1883 CG LEU B 29 -1.743 12.384 2.223 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -2.018 11.095 3.007 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -3.039 13.198 2.152 1.00 0.00 C ATOM 0 H LEU B 29 1.283 12.825 1.275 1.00 0.00 H new ATOM 0 HA LEU B 29 -0.800 14.867 1.659 1.00 0.00 H new ATOM 0 HB2 LEU B 29 0.163 12.461 3.213 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -1.009 13.608 3.830 1.00 0.00 H new ATOM 0 HG LEU B 29 -1.420 12.164 1.206 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -2.818 10.537 2.520 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -1.115 10.486 3.034 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -2.318 11.345 4.025 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -3.811 12.611 1.655 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -3.367 13.448 3.161 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -2.862 14.115 1.590 1.00 0.00 H new ATOM 1897 N SER B 30 1.017 16.418 2.648 1.00 0.00 N ATOM 1898 CA SER B 30 1.822 17.351 3.411 1.00 0.00 C ATOM 1899 C SER B 30 0.969 17.926 4.535 1.00 0.00 C ATOM 1900 O SER B 30 -0.239 17.704 4.583 1.00 0.00 O ATOM 1901 CB SER B 30 2.351 18.471 2.505 1.00 0.00 C ATOM 1902 OG SER B 30 2.663 17.965 1.224 1.00 0.00 O ATOM 0 H SER B 30 0.484 16.856 1.897 1.00 0.00 H new ATOM 0 HA SER B 30 2.683 16.833 3.834 1.00 0.00 H new ATOM 0 HB2 SER B 30 1.604 19.260 2.419 1.00 0.00 H new ATOM 0 HB3 SER B 30 3.239 18.919 2.951 1.00 0.00 H new ATOM 0 HG SER B 30 3.383 18.499 0.828 1.00 0.00 H new ATOM 1908 N LYS B 31 1.606 18.676 5.436 1.00 0.00 N ATOM 1909 CA LYS B 31 0.957 19.327 6.566 1.00 0.00 C ATOM 1910 C LYS B 31 -0.365 19.994 6.155 1.00 0.00 C ATOM 1911 O LYS B 31 -1.364 19.853 6.852 1.00 0.00 O ATOM 1912 CB LYS B 31 1.935 20.322 7.211 1.00 0.00 C ATOM 1913 CG LYS B 31 3.204 19.613 7.714 1.00 0.00 C ATOM 1914 CD LYS B 31 4.138 20.595 8.430 1.00 0.00 C ATOM 1915 CE LYS B 31 5.540 19.996 8.613 1.00 0.00 C ATOM 1916 NZ LYS B 31 5.521 18.733 9.374 1.00 0.00 N ATOM 0 H LYS B 31 2.610 18.849 5.396 1.00 0.00 H new ATOM 0 HA LYS B 31 0.694 18.573 7.307 1.00 0.00 H new ATOM 0 HB2 LYS B 31 2.208 21.089 6.486 1.00 0.00 H new ATOM 0 HB3 LYS B 31 1.445 20.829 8.042 1.00 0.00 H new ATOM 0 HG2 LYS B 31 2.929 18.807 8.394 1.00 0.00 H new ATOM 0 HG3 LYS B 31 3.727 19.156 6.873 1.00 0.00 H new ATOM 0 HD2 LYS B 31 4.207 21.519 7.856 1.00 0.00 H new ATOM 0 HD3 LYS B 31 3.721 20.854 9.403 1.00 0.00 H new ATOM 0 HE2 LYS B 31 5.987 19.820 7.634 1.00 0.00 H new ATOM 0 HE3 LYS B 31 6.175 20.717 9.128 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 6.496 18.406 9.528 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 5.059 18.888 10.293 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 4.995 18.013 8.839 1.00 0.00 H new ATOM 1930 N LYS B 32 -0.388 20.671 5.002 1.00 0.00 N ATOM 1931 CA LYS B 32 -1.599 21.238 4.417 1.00 0.00 C ATOM 1932 C LYS B 32 -2.700 20.176 4.265 1.00 0.00 C ATOM 1933 O LYS B 32 -3.790 20.314 4.817 1.00 0.00 O ATOM 1934 CB LYS B 32 -1.243 21.881 3.067 1.00 0.00 C ATOM 1935 CG LYS B 32 -2.431 22.623 2.439 1.00 0.00 C ATOM 1936 CD LYS B 32 -2.149 23.034 0.986 1.00 0.00 C ATOM 1937 CE LYS B 32 -0.936 23.959 0.820 1.00 0.00 C ATOM 1938 NZ LYS B 32 -1.068 25.189 1.621 1.00 0.00 N ATOM 0 H LYS B 32 0.449 20.841 4.444 1.00 0.00 H new ATOM 0 HA LYS B 32 -1.998 22.002 5.084 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -0.416 22.577 3.207 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -0.897 21.109 2.380 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -3.314 21.985 2.471 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -2.657 23.511 3.030 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -1.991 22.135 0.390 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -3.031 23.533 0.583 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -0.032 23.428 1.117 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -0.821 24.221 -0.232 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -0.270 25.824 1.416 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -1.960 25.666 1.381 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -1.067 24.946 2.632 1.00 0.00 H new ATOM 1952 N GLU B 33 -2.430 19.115 3.501 1.00 0.00 N ATOM 1953 CA GLU B 33 -3.399 18.059 3.247 1.00 0.00 C ATOM 1954 C GLU B 33 -3.845 17.434 4.572 1.00 0.00 C ATOM 1955 O GLU B 33 -5.031 17.185 4.774 1.00 0.00 O ATOM 1956 CB GLU B 33 -2.807 16.990 2.318 1.00 0.00 C ATOM 1957 CG GLU B 33 -2.567 17.453 0.867 1.00 0.00 C ATOM 1958 CD GLU B 33 -1.475 18.505 0.708 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -0.544 18.482 1.540 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -1.585 19.322 -0.232 1.00 0.00 O ATOM 0 H GLU B 33 -1.531 18.968 3.043 1.00 0.00 H new ATOM 0 HA GLU B 33 -4.267 18.492 2.751 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -1.860 16.649 2.737 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -3.477 16.130 2.304 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -2.308 16.585 0.261 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -3.499 17.853 0.468 1.00 0.00 H new ATOM 1967 N LEU B 34 -2.896 17.191 5.482 1.00 0.00 N ATOM 1968 CA LEU B 34 -3.209 16.691 6.815 1.00 0.00 C ATOM 1969 C LEU B 34 -4.157 17.647 7.545 1.00 0.00 C ATOM 1970 O LEU B 34 -5.116 17.192 8.165 1.00 0.00 O ATOM 1971 CB LEU B 34 -1.937 16.447 7.636 1.00 0.00 C ATOM 1972 CG LEU B 34 -0.989 15.386 7.049 1.00 0.00 C ATOM 1973 CD1 LEU B 34 0.183 15.203 8.018 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -1.680 14.033 6.846 1.00 0.00 C ATOM 0 H LEU B 34 -1.900 17.335 5.313 1.00 0.00 H new ATOM 0 HA LEU B 34 -3.714 15.732 6.699 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -1.395 17.388 7.729 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -2.223 16.143 8.643 1.00 0.00 H new ATOM 0 HG LEU B 34 -0.655 15.733 6.071 1.00 0.00 H new ATOM 0 HD11 LEU B 34 0.869 14.454 7.622 1.00 0.00 H new ATOM 0 HD12 LEU B 34 0.709 16.150 8.136 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -0.194 14.874 8.986 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -0.968 13.320 6.430 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -2.046 13.664 7.804 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -2.518 14.152 6.159 1.00 0.00 H new ATOM 1986 N LYS B 35 -3.915 18.960 7.463 1.00 0.00 N ATOM 1987 CA LYS B 35 -4.811 19.968 8.011 1.00 0.00 C ATOM 1988 C LYS B 35 -6.213 19.731 7.447 1.00 0.00 C ATOM 1989 O LYS B 35 -7.157 19.554 8.211 1.00 0.00 O ATOM 1990 CB LYS B 35 -4.289 21.387 7.714 1.00 0.00 C ATOM 1991 CG LYS B 35 -4.779 22.470 8.687 1.00 0.00 C ATOM 1992 CD LYS B 35 -6.304 22.633 8.699 1.00 0.00 C ATOM 1993 CE LYS B 35 -6.703 23.937 9.398 1.00 0.00 C ATOM 1994 NZ LYS B 35 -8.166 24.053 9.525 1.00 0.00 N ATOM 0 H LYS B 35 -3.087 19.348 7.012 1.00 0.00 H new ATOM 0 HA LYS B 35 -4.855 19.883 9.097 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -3.199 21.369 7.731 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -4.587 21.665 6.703 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -4.439 22.225 9.693 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -4.321 23.422 8.419 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -6.683 22.631 7.677 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -6.761 21.786 9.210 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -6.246 23.976 10.387 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -6.317 24.786 8.835 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -8.413 25.017 9.828 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -8.611 23.854 8.606 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -8.508 23.370 10.230 1.00 0.00 H new ATOM 2008 N GLU B 36 -6.353 19.688 6.118 1.00 0.00 N ATOM 2009 CA GLU B 36 -7.656 19.468 5.496 1.00 0.00 C ATOM 2010 C GLU B 36 -8.311 18.169 5.989 1.00 0.00 C ATOM 2011 O GLU B 36 -9.499 18.160 6.316 1.00 0.00 O ATOM 2012 CB GLU B 36 -7.560 19.510 3.964 1.00 0.00 C ATOM 2013 CG GLU B 36 -6.955 20.816 3.423 1.00 0.00 C ATOM 2014 CD GLU B 36 -7.567 22.066 4.054 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -8.783 22.275 3.847 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -6.814 22.780 4.750 1.00 0.00 O ATOM 0 H GLU B 36 -5.583 19.802 5.459 1.00 0.00 H new ATOM 0 HA GLU B 36 -8.305 20.288 5.804 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -6.955 18.670 3.623 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -8.556 19.378 3.542 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -5.880 20.814 3.604 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -7.096 20.855 2.343 1.00 0.00 H new ATOM 2023 N LEU B 37 -7.543 17.080 6.061 1.00 0.00 N ATOM 2024 CA LEU B 37 -8.029 15.816 6.596 1.00 0.00 C ATOM 2025 C LEU B 37 -8.564 16.006 8.017 1.00 0.00 C ATOM 2026 O LEU B 37 -9.748 15.774 8.254 1.00 0.00 O ATOM 2027 CB LEU B 37 -6.928 14.745 6.535 1.00 0.00 C ATOM 2028 CG LEU B 37 -7.302 13.442 7.267 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -8.429 12.674 6.572 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -6.068 12.541 7.362 1.00 0.00 C ATOM 0 H LEU B 37 -6.572 17.054 5.750 1.00 0.00 H new ATOM 0 HA LEU B 37 -8.857 15.467 5.979 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -6.710 14.517 5.492 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -6.014 15.149 6.971 1.00 0.00 H new ATOM 0 HG LEU B 37 -7.659 13.721 8.258 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -8.650 11.765 7.132 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -9.321 13.298 6.527 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -8.120 12.410 5.561 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -6.330 11.618 7.880 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -5.711 12.306 6.359 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -5.283 13.057 7.915 1.00 0.00 H new ATOM 2042 N ILE B 38 -7.712 16.384 8.976 1.00 0.00 N ATOM 2043 CA ILE B 38 -8.132 16.430 10.376 1.00 0.00 C ATOM 2044 C ILE B 38 -9.262 17.444 10.576 1.00 0.00 C ATOM 2045 O ILE B 38 -10.209 17.176 11.313 1.00 0.00 O ATOM 2046 CB ILE B 38 -6.943 16.602 11.344 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -6.214 17.954 11.236 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -5.943 15.457 11.135 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -6.750 18.998 12.221 1.00 0.00 C ATOM 0 H ILE B 38 -6.743 16.658 8.811 1.00 0.00 H new ATOM 0 HA ILE B 38 -8.551 15.458 10.637 1.00 0.00 H new ATOM 0 HB ILE B 38 -7.369 16.577 12.347 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -5.150 17.803 11.417 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -6.314 18.335 10.220 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -5.103 15.578 11.819 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -6.435 14.504 11.330 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -5.580 15.474 10.107 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -6.198 19.930 12.099 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -7.808 19.174 12.025 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -6.626 18.634 13.241 1.00 0.00 H new ATOM 2061 N GLN B 39 -9.196 18.577 9.872 1.00 0.00 N ATOM 2062 CA GLN B 39 -10.270 19.557 9.793 1.00 0.00 C ATOM 2063 C GLN B 39 -11.583 18.865 9.431 1.00 0.00 C ATOM 2064 O GLN B 39 -12.593 19.090 10.089 1.00 0.00 O ATOM 2065 CB GLN B 39 -9.881 20.614 8.752 1.00 0.00 C ATOM 2066 CG GLN B 39 -10.940 21.674 8.430 1.00 0.00 C ATOM 2067 CD GLN B 39 -10.460 22.510 7.246 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -10.058 23.657 7.407 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -10.457 21.916 6.055 1.00 0.00 N ATOM 0 H GLN B 39 -8.373 18.840 9.330 1.00 0.00 H new ATOM 0 HA GLN B 39 -10.417 20.045 10.756 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -8.983 21.123 9.101 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -9.618 20.102 7.827 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -11.891 21.197 8.193 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -11.110 22.312 9.297 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -10.800 20.960 5.961 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -10.112 22.417 5.236 1.00 0.00 H new ATOM 2078 N LYS B 40 -11.584 18.037 8.384 1.00 0.00 N ATOM 2079 CA LYS B 40 -12.788 17.339 7.966 1.00 0.00 C ATOM 2080 C LYS B 40 -13.206 16.268 8.979 1.00 0.00 C ATOM 2081 O LYS B 40 -14.392 16.143 9.273 1.00 0.00 O ATOM 2082 CB LYS B 40 -12.585 16.785 6.551 1.00 0.00 C ATOM 2083 CG LYS B 40 -13.866 16.152 5.991 1.00 0.00 C ATOM 2084 CD LYS B 40 -13.788 15.974 4.467 1.00 0.00 C ATOM 2085 CE LYS B 40 -12.512 15.258 4.010 1.00 0.00 C ATOM 2086 NZ LYS B 40 -12.362 13.938 4.642 1.00 0.00 N ATOM 0 H LYS B 40 -10.762 17.838 7.814 1.00 0.00 H new ATOM 0 HA LYS B 40 -13.621 18.041 7.935 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -12.259 17.589 5.891 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -11.789 16.041 6.564 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -14.031 15.184 6.463 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -14.722 16.779 6.242 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -14.656 15.408 4.128 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -13.839 16.953 3.990 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -12.531 15.141 2.926 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -11.645 15.875 4.249 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -11.439 13.533 4.385 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -12.420 14.039 5.675 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -13.121 13.307 4.313 1.00 0.00 H new ATOM 2337 N LEU B 56 -0.485 8.537 14.535 1.00 0.00 N ATOM 2338 CA LEU B 56 0.687 7.931 13.919 1.00 0.00 C ATOM 2339 C LEU B 56 1.112 8.724 12.688 1.00 0.00 C ATOM 2340 O LEU B 56 2.259 9.158 12.603 1.00 0.00 O ATOM 2341 CB LEU B 56 0.412 6.463 13.572 1.00 0.00 C ATOM 2342 CG LEU B 56 0.317 5.578 14.825 1.00 0.00 C ATOM 2343 CD1 LEU B 56 -0.381 4.259 14.469 1.00 0.00 C ATOM 2344 CD2 LEU B 56 1.701 5.266 15.409 1.00 0.00 C ATOM 0 HA LEU B 56 1.511 7.956 14.632 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -0.518 6.393 13.008 1.00 0.00 H new ATOM 0 HB3 LEU B 56 1.206 6.090 12.925 1.00 0.00 H new ATOM 0 HG LEU B 56 -0.255 6.126 15.574 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -0.448 3.632 15.358 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -1.383 4.467 14.095 1.00 0.00 H new ATOM 0 HD13 LEU B 56 0.192 3.740 13.701 1.00 0.00 H new ATOM 0 HD21 LEU B 56 1.590 4.638 16.293 1.00 0.00 H new ATOM 0 HD22 LEU B 56 2.300 4.741 14.665 1.00 0.00 H new ATOM 0 HD23 LEU B 56 2.198 6.196 15.685 1.00 0.00 H new ATOM 2356 N MET B 57 0.198 8.925 11.735 1.00 0.00 N ATOM 2357 CA MET B 57 0.515 9.655 10.515 1.00 0.00 C ATOM 2358 C MET B 57 1.017 11.066 10.846 1.00 0.00 C ATOM 2359 O MET B 57 2.024 11.528 10.305 1.00 0.00 O ATOM 2360 CB MET B 57 -0.723 9.671 9.612 1.00 0.00 C ATOM 2361 CG MET B 57 -0.426 10.313 8.252 1.00 0.00 C ATOM 2362 SD MET B 57 -1.694 10.056 6.985 1.00 0.00 S ATOM 2363 CE MET B 57 -3.157 10.648 7.861 1.00 0.00 C ATOM 0 H MET B 57 -0.764 8.591 11.789 1.00 0.00 H new ATOM 0 HA MET B 57 1.323 9.158 9.978 1.00 0.00 H new ATOM 0 HB2 MET B 57 -1.078 8.651 9.463 1.00 0.00 H new ATOM 0 HB3 MET B 57 -1.526 10.219 10.105 1.00 0.00 H new ATOM 0 HG2 MET B 57 -0.291 11.385 8.396 1.00 0.00 H new ATOM 0 HG3 MET B 57 0.520 9.919 7.881 1.00 0.00 H new ATOM 0 HE1 MET B 57 -3.996 10.708 7.168 1.00 0.00 H new ATOM 0 HE2 MET B 57 -3.401 9.958 8.669 1.00 0.00 H new ATOM 0 HE3 MET B 57 -2.958 11.636 8.276 1.00 0.00 H new ATOM 2373 N ASP B 58 0.311 11.748 11.751 1.00 0.00 N ATOM 2374 CA ASP B 58 0.668 13.079 12.204 1.00 0.00 C ATOM 2375 C ASP B 58 2.084 13.088 12.764 1.00 0.00 C ATOM 2376 O ASP B 58 2.904 13.858 12.280 1.00 0.00 O ATOM 2377 CB ASP B 58 -0.336 13.605 13.236 1.00 0.00 C ATOM 2378 CG ASP B 58 0.077 14.988 13.728 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -0.230 15.962 13.007 1.00 0.00 O ATOM 2380 OD2 ASP B 58 0.704 15.046 14.807 1.00 0.00 O ATOM 0 H ASP B 58 -0.533 11.380 12.190 1.00 0.00 H new ATOM 0 HA ASP B 58 0.634 13.749 11.345 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -1.331 13.653 12.793 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -0.395 12.916 14.078 1.00 0.00 H new ATOM 2385 N ASP B 59 2.389 12.259 13.769 1.00 0.00 N ATOM 2386 CA ASP B 59 3.715 12.268 14.375 1.00 0.00 C ATOM 2387 C ASP B 59 4.785 11.874 13.354 1.00 0.00 C ATOM 2388 O ASP B 59 5.824 12.527 13.279 1.00 0.00 O ATOM 2389 CB ASP B 59 3.771 11.489 15.701 1.00 0.00 C ATOM 2390 CG ASP B 59 3.580 9.975 15.612 1.00 0.00 C ATOM 2391 OD1 ASP B 59 4.380 9.326 14.905 1.00 0.00 O ATOM 2392 OD2 ASP B 59 2.675 9.479 16.317 1.00 0.00 O ATOM 0 H ASP B 59 1.741 11.583 14.172 1.00 0.00 H new ATOM 0 HA ASP B 59 3.946 13.292 14.669 1.00 0.00 H new ATOM 0 HB2 ASP B 59 4.735 11.684 16.171 1.00 0.00 H new ATOM 0 HB3 ASP B 59 3.006 11.891 16.365 1.00 0.00 H new ATOM 2397 N LEU B 60 4.510 10.856 12.531 1.00 0.00 N ATOM 2398 CA LEU B 60 5.405 10.399 11.476 1.00 0.00 C ATOM 2399 C LEU B 60 5.834 11.575 10.600 1.00 0.00 C ATOM 2400 O LEU B 60 7.018 11.716 10.298 1.00 0.00 O ATOM 2401 CB LEU B 60 4.712 9.296 10.658 1.00 0.00 C ATOM 2402 CG LEU B 60 5.515 8.791 9.447 1.00 0.00 C ATOM 2403 CD1 LEU B 60 6.848 8.161 9.865 1.00 0.00 C ATOM 2404 CD2 LEU B 60 4.675 7.755 8.691 1.00 0.00 C ATOM 0 H LEU B 60 3.643 10.321 12.585 1.00 0.00 H new ATOM 0 HA LEU B 60 6.309 9.977 11.915 1.00 0.00 H new ATOM 0 HB2 LEU B 60 4.503 8.452 11.316 1.00 0.00 H new ATOM 0 HB3 LEU B 60 3.751 9.672 10.308 1.00 0.00 H new ATOM 0 HG LEU B 60 5.740 9.645 8.809 1.00 0.00 H new ATOM 0 HD11 LEU B 60 7.382 7.818 8.979 1.00 0.00 H new ATOM 0 HD12 LEU B 60 7.452 8.902 10.389 1.00 0.00 H new ATOM 0 HD13 LEU B 60 6.659 7.314 10.525 1.00 0.00 H new ATOM 0 HD21 LEU B 60 5.235 7.390 7.830 1.00 0.00 H new ATOM 0 HD22 LEU B 60 4.444 6.921 9.353 1.00 0.00 H new ATOM 0 HD23 LEU B 60 3.748 8.216 8.351 1.00 0.00 H new ATOM 2416 N ASP B 61 4.879 12.420 10.198 1.00 0.00 N ATOM 2417 CA ASP B 61 5.179 13.619 9.429 1.00 0.00 C ATOM 2418 C ASP B 61 5.856 14.681 10.301 1.00 0.00 C ATOM 2419 O ASP B 61 6.993 15.080 10.053 1.00 0.00 O ATOM 2420 CB ASP B 61 3.893 14.161 8.798 1.00 0.00 C ATOM 2421 CG ASP B 61 4.210 15.325 7.868 1.00 0.00 C ATOM 2422 OD1 ASP B 61 4.667 15.037 6.742 1.00 0.00 O ATOM 2423 OD2 ASP B 61 4.005 16.478 8.305 1.00 0.00 O ATOM 0 H ASP B 61 3.887 12.289 10.397 1.00 0.00 H new ATOM 0 HA ASP B 61 5.879 13.360 8.634 1.00 0.00 H new ATOM 0 HB2 ASP B 61 3.391 13.369 8.242 1.00 0.00 H new ATOM 0 HB3 ASP B 61 3.206 14.487 9.579 1.00 0.00 H new ATOM 2428 N ARG B 62 5.129 15.144 11.320 1.00 0.00 N ATOM 2429 CA ARG B 62 5.474 16.260 12.190 1.00 0.00 C ATOM 2430 C ARG B 62 6.857 16.105 12.821 1.00 0.00 C ATOM 2431 O ARG B 62 7.461 17.108 13.204 1.00 0.00 O ATOM 2432 CB ARG B 62 4.369 16.449 13.244 1.00 0.00 C ATOM 2433 CG ARG B 62 4.621 17.590 14.242 1.00 0.00 C ATOM 2434 CD ARG B 62 4.809 18.954 13.564 1.00 0.00 C ATOM 2435 NE ARG B 62 5.146 19.991 14.546 1.00 0.00 N ATOM 2436 CZ ARG B 62 6.369 20.192 15.062 1.00 0.00 C ATOM 2437 NH1 ARG B 62 7.396 19.397 14.736 1.00 0.00 N ATOM 2438 NH2 ARG B 62 6.560 21.202 15.916 1.00 0.00 N ATOM 0 H ARG B 62 4.234 14.723 11.571 1.00 0.00 H new ATOM 0 HA ARG B 62 5.535 17.163 11.583 1.00 0.00 H new ATOM 0 HB2 ARG B 62 3.425 16.635 12.732 1.00 0.00 H new ATOM 0 HB3 ARG B 62 4.252 15.518 13.799 1.00 0.00 H new ATOM 0 HG2 ARG B 62 3.783 17.649 14.936 1.00 0.00 H new ATOM 0 HG3 ARG B 62 5.508 17.359 14.832 1.00 0.00 H new ATOM 0 HD2 ARG B 62 5.600 18.886 12.817 1.00 0.00 H new ATOM 0 HD3 ARG B 62 3.896 19.231 13.037 1.00 0.00 H new ATOM 0 HE ARG B 62 4.395 20.605 14.860 1.00 0.00 H new ATOM 0 HH11 ARG B 62 7.256 18.624 14.086 1.00 0.00 H new ATOM 0 HH12 ARG B 62 8.318 19.565 15.138 1.00 0.00 H new ATOM 0 HH21 ARG B 62 5.781 21.810 16.169 1.00 0.00 H new ATOM 0 HH22 ARG B 62 7.485 21.365 16.315 1.00 0.00 H new ATOM 2452 N ASN B 63 7.352 14.866 12.922 1.00 0.00 N ATOM 2453 CA ASN B 63 8.725 14.527 13.272 1.00 0.00 C ATOM 2454 C ASN B 63 9.728 15.577 12.775 1.00 0.00 C ATOM 2455 O ASN B 63 10.597 15.987 13.542 1.00 0.00 O ATOM 2456 CB ASN B 63 9.040 13.140 12.702 1.00 0.00 C ATOM 2457 CG ASN B 63 10.489 12.736 12.942 1.00 0.00 C ATOM 2458 OD1 ASN B 63 10.897 12.502 14.074 1.00 0.00 O ATOM 2459 ND2 ASN B 63 11.278 12.627 11.879 1.00 0.00 N ATOM 0 H ASN B 63 6.777 14.041 12.754 1.00 0.00 H new ATOM 0 HA ASN B 63 8.822 14.513 14.358 1.00 0.00 H new ATOM 0 HB2 ASN B 63 8.379 12.403 13.157 1.00 0.00 H new ATOM 0 HB3 ASN B 63 8.835 13.134 11.631 1.00 0.00 H new ATOM 0 HD21 ASN B 63 12.251 12.342 11.993 1.00 0.00 H new ATOM 0 HD22 ASN B 63 10.911 12.828 10.949 1.00 0.00 H new ATOM 2466 N LYS B 64 9.605 16.030 11.520 1.00 0.00 N ATOM 2467 CA LYS B 64 10.333 17.185 11.012 1.00 0.00 C ATOM 2468 C LYS B 64 9.418 17.936 10.033 1.00 0.00 C ATOM 2469 O LYS B 64 8.220 17.664 9.940 1.00 0.00 O ATOM 2470 CB LYS B 64 11.668 16.769 10.358 1.00 0.00 C ATOM 2471 CG LYS B 64 12.602 15.995 11.292 1.00 0.00 C ATOM 2472 CD LYS B 64 13.980 15.744 10.660 1.00 0.00 C ATOM 2473 CE LYS B 64 13.924 15.025 9.304 1.00 0.00 C ATOM 2474 NZ LYS B 64 13.146 13.775 9.364 1.00 0.00 N ATOM 0 H LYS B 64 8.992 15.597 10.829 1.00 0.00 H new ATOM 0 HA LYS B 64 10.600 17.848 11.835 1.00 0.00 H new ATOM 0 HB2 LYS B 64 11.457 16.156 9.482 1.00 0.00 H new ATOM 0 HB3 LYS B 64 12.182 17.663 10.005 1.00 0.00 H new ATOM 0 HG2 LYS B 64 12.726 16.551 12.221 1.00 0.00 H new ATOM 0 HG3 LYS B 64 12.144 15.040 11.551 1.00 0.00 H new ATOM 0 HD2 LYS B 64 14.489 16.699 10.532 1.00 0.00 H new ATOM 0 HD3 LYS B 64 14.582 15.152 11.349 1.00 0.00 H new ATOM 0 HE2 LYS B 64 13.483 15.689 8.561 1.00 0.00 H new ATOM 0 HE3 LYS B 64 14.938 14.803 8.971 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 13.355 13.196 8.526 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 13.403 13.247 10.223 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 12.131 13.999 9.386 1.00 0.00 H new ATOM 2488 N ASP B 65 9.985 18.864 9.262 1.00 0.00 N ATOM 2489 CA ASP B 65 9.308 19.593 8.196 1.00 0.00 C ATOM 2490 C ASP B 65 9.117 18.690 6.972 1.00 0.00 C ATOM 2491 O ASP B 65 9.611 18.982 5.887 1.00 0.00 O ATOM 2492 CB ASP B 65 10.090 20.878 7.864 1.00 0.00 C ATOM 2493 CG ASP B 65 11.511 20.623 7.359 1.00 0.00 C ATOM 2494 OD1 ASP B 65 12.224 19.843 8.030 1.00 0.00 O ATOM 2495 OD2 ASP B 65 11.871 21.235 6.331 1.00 0.00 O ATOM 0 H ASP B 65 10.962 19.136 9.368 1.00 0.00 H new ATOM 0 HA ASP B 65 8.314 19.892 8.528 1.00 0.00 H new ATOM 0 HB2 ASP B 65 9.542 21.441 7.109 1.00 0.00 H new ATOM 0 HB3 ASP B 65 10.138 21.503 8.755 1.00 0.00 H new ATOM 2500 N GLN B 66 8.416 17.572 7.157 1.00 0.00 N ATOM 2501 CA GLN B 66 8.231 16.546 6.159 1.00 0.00 C ATOM 2502 C GLN B 66 6.920 16.765 5.413 1.00 0.00 C ATOM 2503 O GLN B 66 6.130 17.666 5.701 1.00 0.00 O ATOM 2504 CB GLN B 66 8.222 15.181 6.854 1.00 0.00 C ATOM 2505 CG GLN B 66 9.570 14.869 7.517 1.00 0.00 C ATOM 2506 CD GLN B 66 9.469 13.720 8.513 1.00 0.00 C ATOM 2507 OE1 GLN B 66 10.217 13.663 9.486 1.00 0.00 O ATOM 2508 NE2 GLN B 66 8.537 12.805 8.279 1.00 0.00 N ATOM 0 H GLN B 66 7.950 17.359 8.039 1.00 0.00 H new ATOM 0 HA GLN B 66 9.045 16.586 5.435 1.00 0.00 H new ATOM 0 HB2 GLN B 66 7.434 15.162 7.607 1.00 0.00 H new ATOM 0 HB3 GLN B 66 7.987 14.404 6.126 1.00 0.00 H new ATOM 0 HG2 GLN B 66 10.302 14.618 6.749 1.00 0.00 H new ATOM 0 HG3 GLN B 66 9.937 15.759 8.028 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.935 12.888 7.460 1.00 0.00 H new ATOM 0 HE22 GLN B 66 8.422 12.019 8.919 1.00 0.00 H new ATOM 2517 N GLU B 67 6.723 15.870 4.456 1.00 0.00 N ATOM 2518 CA GLU B 67 5.512 15.614 3.709 1.00 0.00 C ATOM 2519 C GLU B 67 5.471 14.090 3.592 1.00 0.00 C ATOM 2520 O GLU B 67 6.536 13.486 3.460 1.00 0.00 O ATOM 2521 CB GLU B 67 5.578 16.276 2.324 1.00 0.00 C ATOM 2522 CG GLU B 67 6.080 17.726 2.353 1.00 0.00 C ATOM 2523 CD GLU B 67 5.977 18.368 0.973 1.00 0.00 C ATOM 2524 OE1 GLU B 67 6.828 18.032 0.123 1.00 0.00 O ATOM 2525 OE2 GLU B 67 5.034 19.170 0.785 1.00 0.00 O ATOM 0 H GLU B 67 7.478 15.252 4.160 1.00 0.00 H new ATOM 0 HA GLU B 67 4.622 16.019 4.190 1.00 0.00 H new ATOM 0 HB2 GLU B 67 6.233 15.688 1.681 1.00 0.00 H new ATOM 0 HB3 GLU B 67 4.586 16.254 1.874 1.00 0.00 H new ATOM 0 HG2 GLU B 67 5.496 18.302 3.071 1.00 0.00 H new ATOM 0 HG3 GLU B 67 7.116 17.749 2.693 1.00 0.00 H new ATOM 2532 N VAL B 68 4.299 13.455 3.656 1.00 0.00 N ATOM 2533 CA VAL B 68 4.211 12.002 3.578 1.00 0.00 C ATOM 2534 C VAL B 68 3.983 11.663 2.111 1.00 0.00 C ATOM 2535 O VAL B 68 2.974 12.067 1.540 1.00 0.00 O ATOM 2536 CB VAL B 68 3.059 11.482 4.458 1.00 0.00 C ATOM 2537 CG1 VAL B 68 3.005 9.949 4.451 1.00 0.00 C ATOM 2538 CG2 VAL B 68 3.201 11.971 5.903 1.00 0.00 C ATOM 0 H VAL B 68 3.401 13.927 3.762 1.00 0.00 H new ATOM 0 HA VAL B 68 5.121 11.528 3.946 1.00 0.00 H new ATOM 0 HB VAL B 68 2.134 11.875 4.036 1.00 0.00 H new ATOM 0 HG11 VAL B 68 2.182 9.611 5.081 1.00 0.00 H new ATOM 0 HG12 VAL B 68 2.851 9.595 3.432 1.00 0.00 H new ATOM 0 HG13 VAL B 68 3.944 9.550 4.836 1.00 0.00 H new ATOM 0 HG21 VAL B 68 2.373 11.588 6.500 1.00 0.00 H new ATOM 0 HG22 VAL B 68 4.143 11.613 6.317 1.00 0.00 H new ATOM 0 HG23 VAL B 68 3.187 13.061 5.921 1.00 0.00 H new ATOM 2548 N ASN B 69 4.894 10.941 1.465 1.00 0.00 N ATOM 2549 CA ASN B 69 4.833 10.752 0.020 1.00 0.00 C ATOM 2550 C ASN B 69 3.960 9.534 -0.267 1.00 0.00 C ATOM 2551 O ASN B 69 3.785 8.681 0.597 1.00 0.00 O ATOM 2552 CB ASN B 69 6.251 10.512 -0.518 1.00 0.00 C ATOM 2553 CG ASN B 69 6.232 10.042 -1.971 1.00 0.00 C ATOM 2554 OD1 ASN B 69 6.242 8.844 -2.242 1.00 0.00 O ATOM 2555 ND2 ASN B 69 6.143 10.972 -2.916 1.00 0.00 N ATOM 0 H ASN B 69 5.682 10.478 1.919 1.00 0.00 H new ATOM 0 HA ASN B 69 4.413 11.634 -0.463 1.00 0.00 H new ATOM 0 HB2 ASN B 69 6.830 11.432 -0.441 1.00 0.00 H new ATOM 0 HB3 ASN B 69 6.753 9.767 0.099 1.00 0.00 H new ATOM 0 HD21 ASN B 69 6.081 10.698 -3.897 1.00 0.00 H new ATOM 0 HD22 ASN B 69 6.137 11.960 -2.661 1.00 0.00 H new ATOM 2562 N PHE B 70 3.395 9.445 -1.472 1.00 0.00 N ATOM 2563 CA PHE B 70 2.608 8.295 -1.891 1.00 0.00 C ATOM 2564 C PHE B 70 3.194 6.944 -1.440 1.00 0.00 C ATOM 2565 O PHE B 70 2.496 6.141 -0.822 1.00 0.00 O ATOM 2566 CB PHE B 70 2.431 8.337 -3.406 1.00 0.00 C ATOM 2567 CG PHE B 70 1.570 7.200 -3.899 1.00 0.00 C ATOM 2568 CD1 PHE B 70 0.192 7.214 -3.622 1.00 0.00 C ATOM 2569 CD2 PHE B 70 2.174 6.024 -4.378 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -0.604 6.107 -3.954 1.00 0.00 C ATOM 2571 CE2 PHE B 70 1.382 4.916 -4.704 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.008 4.954 -4.490 1.00 0.00 C ATOM 0 H PHE B 70 3.473 10.172 -2.183 1.00 0.00 H new ATOM 0 HA PHE B 70 1.640 8.366 -1.396 1.00 0.00 H new ATOM 0 HB2 PHE B 70 1.979 9.287 -3.693 1.00 0.00 H new ATOM 0 HB3 PHE B 70 3.408 8.290 -3.888 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -0.255 8.078 -3.153 1.00 0.00 H new ATOM 0 HD2 PHE B 70 3.247 5.975 -4.494 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -1.672 6.142 -3.798 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.839 4.031 -5.121 1.00 0.00 H new ATOM 0 HZ PHE B 70 -0.616 4.097 -4.738 1.00 0.00 H new ATOM 2582 N GLN B 71 4.478 6.677 -1.706 1.00 0.00 N ATOM 2583 CA GLN B 71 5.066 5.414 -1.272 1.00 0.00 C ATOM 2584 C GLN B 71 5.124 5.303 0.255 1.00 0.00 C ATOM 2585 O GLN B 71 5.049 4.195 0.784 1.00 0.00 O ATOM 2586 CB GLN B 71 6.440 5.169 -1.915 1.00 0.00 C ATOM 2587 CG GLN B 71 6.333 4.713 -3.379 1.00 0.00 C ATOM 2588 CD GLN B 71 5.509 3.438 -3.542 1.00 0.00 C ATOM 2589 OE1 GLN B 71 4.416 3.462 -4.098 1.00 0.00 O ATOM 2590 NE2 GLN B 71 6.016 2.314 -3.042 1.00 0.00 N ATOM 0 H GLN B 71 5.111 7.302 -2.206 1.00 0.00 H new ATOM 0 HA GLN B 71 4.405 4.622 -1.623 1.00 0.00 H new ATOM 0 HB2 GLN B 71 7.029 6.085 -1.865 1.00 0.00 H new ATOM 0 HB3 GLN B 71 6.976 4.413 -1.341 1.00 0.00 H new ATOM 0 HG2 GLN B 71 5.883 5.510 -3.971 1.00 0.00 H new ATOM 0 HG3 GLN B 71 7.334 4.547 -3.777 1.00 0.00 H new ATOM 0 HE21 GLN B 71 6.928 2.325 -2.585 1.00 0.00 H new ATOM 0 HE22 GLN B 71 5.493 1.441 -3.116 1.00 0.00 H new ATOM 2599 N GLU B 72 5.221 6.420 0.978 1.00 0.00 N ATOM 2600 CA GLU B 72 5.096 6.410 2.428 1.00 0.00 C ATOM 2601 C GLU B 72 3.652 6.101 2.832 1.00 0.00 C ATOM 2602 O GLU B 72 3.448 5.360 3.784 1.00 0.00 O ATOM 2603 CB GLU B 72 5.602 7.713 3.053 1.00 0.00 C ATOM 2604 CG GLU B 72 7.088 7.939 2.750 1.00 0.00 C ATOM 2605 CD GLU B 72 7.577 9.242 3.369 1.00 0.00 C ATOM 2606 OE1 GLU B 72 7.279 10.292 2.761 1.00 0.00 O ATOM 2607 OE2 GLU B 72 8.216 9.167 4.439 1.00 0.00 O ATOM 0 H GLU B 72 5.386 7.343 0.577 1.00 0.00 H new ATOM 0 HA GLU B 72 5.733 5.617 2.820 1.00 0.00 H new ATOM 0 HB2 GLU B 72 5.020 8.552 2.671 1.00 0.00 H new ATOM 0 HB3 GLU B 72 5.449 7.684 4.132 1.00 0.00 H new ATOM 0 HG2 GLU B 72 7.673 7.105 3.138 1.00 0.00 H new ATOM 0 HG3 GLU B 72 7.244 7.963 1.671 1.00 0.00 H new ATOM 2614 N TYR B 73 2.646 6.622 2.119 1.00 0.00 N ATOM 2615 CA TYR B 73 1.251 6.262 2.376 1.00 0.00 C ATOM 2616 C TYR B 73 1.074 4.748 2.202 1.00 0.00 C ATOM 2617 O TYR B 73 0.538 4.066 3.076 1.00 0.00 O ATOM 2618 CB TYR B 73 0.321 7.092 1.474 1.00 0.00 C ATOM 2619 CG TYR B 73 -1.148 6.698 1.465 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -1.937 6.884 2.615 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -1.762 6.308 0.258 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -3.332 6.710 2.549 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -3.155 6.125 0.196 1.00 0.00 C ATOM 2624 CZ TYR B 73 -3.945 6.351 1.336 1.00 0.00 C ATOM 2625 OH TYR B 73 -5.305 6.339 1.243 1.00 0.00 O ATOM 0 H TYR B 73 2.774 7.293 1.361 1.00 0.00 H new ATOM 0 HA TYR B 73 0.977 6.499 3.404 1.00 0.00 H new ATOM 0 HB2 TYR B 73 0.392 8.136 1.780 1.00 0.00 H new ATOM 0 HB3 TYR B 73 0.696 7.033 0.452 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -1.472 7.161 3.549 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -1.160 6.149 -0.624 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -3.934 6.853 3.434 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -3.618 5.811 -0.728 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.569 6.381 0.300 1.00 0.00 H new ATOM 2635 N ILE B 74 1.572 4.204 1.093 1.00 0.00 N ATOM 2636 CA ILE B 74 1.515 2.772 0.825 1.00 0.00 C ATOM 2637 C ILE B 74 2.267 1.966 1.894 1.00 0.00 C ATOM 2638 O ILE B 74 1.700 1.058 2.500 1.00 0.00 O ATOM 2639 CB ILE B 74 1.958 2.509 -0.629 1.00 0.00 C ATOM 2640 CG1 ILE B 74 0.737 2.456 -1.564 1.00 0.00 C ATOM 2641 CG2 ILE B 74 2.705 1.186 -0.794 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -0.155 3.695 -1.481 1.00 0.00 C ATOM 0 H ILE B 74 2.026 4.745 0.357 1.00 0.00 H new ATOM 0 HA ILE B 74 0.489 2.412 0.904 1.00 0.00 H new ATOM 0 HB ILE B 74 2.625 3.332 -0.885 1.00 0.00 H new ATOM 0 HG12 ILE B 74 1.082 2.336 -2.591 1.00 0.00 H new ATOM 0 HG13 ILE B 74 0.143 1.575 -1.322 1.00 0.00 H new ATOM 0 HG21 ILE B 74 2.991 1.057 -1.838 1.00 0.00 H new ATOM 0 HG22 ILE B 74 3.600 1.193 -0.171 1.00 0.00 H new ATOM 0 HG23 ILE B 74 2.058 0.363 -0.491 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -0.994 3.586 -2.168 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -0.530 3.806 -0.464 1.00 0.00 H new ATOM 0 HD13 ILE B 74 0.423 4.578 -1.753 1.00 0.00 H new ATOM 2654 N THR B 75 3.537 2.265 2.165 1.00 0.00 N ATOM 2655 CA THR B 75 4.272 1.494 3.163 1.00 0.00 C ATOM 2656 C THR B 75 3.672 1.694 4.560 1.00 0.00 C ATOM 2657 O THR B 75 3.696 0.766 5.364 1.00 0.00 O ATOM 2658 CB THR B 75 5.775 1.790 3.113 1.00 0.00 C ATOM 2659 OG1 THR B 75 6.015 3.177 3.165 1.00 0.00 O ATOM 2660 CG2 THR B 75 6.406 1.227 1.835 1.00 0.00 C ATOM 0 H THR B 75 4.066 3.015 1.720 1.00 0.00 H new ATOM 0 HA THR B 75 4.165 0.436 2.921 1.00 0.00 H new ATOM 0 HB THR B 75 6.227 1.309 3.980 1.00 0.00 H new ATOM 0 HG1 THR B 75 5.826 3.575 2.289 1.00 0.00 H new ATOM 0 HG21 THR B 75 7.473 1.452 1.826 1.00 0.00 H new ATOM 0 HG22 THR B 75 6.262 0.147 1.804 1.00 0.00 H new ATOM 0 HG23 THR B 75 5.932 1.681 0.965 1.00 0.00 H new ATOM 2668 N PHE B 76 3.080 2.858 4.843 1.00 0.00 N ATOM 2669 CA PHE B 76 2.292 3.081 6.049 1.00 0.00 C ATOM 2670 C PHE B 76 1.087 2.139 6.075 1.00 0.00 C ATOM 2671 O PHE B 76 0.785 1.575 7.124 1.00 0.00 O ATOM 2672 CB PHE B 76 1.876 4.555 6.168 1.00 0.00 C ATOM 2673 CG PHE B 76 1.001 4.897 7.362 1.00 0.00 C ATOM 2674 CD1 PHE B 76 1.487 4.712 8.670 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -0.265 5.483 7.166 1.00 0.00 C ATOM 2676 CE1 PHE B 76 0.713 5.110 9.774 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -1.027 5.905 8.270 1.00 0.00 C ATOM 2678 CZ PHE B 76 -0.537 5.721 9.575 1.00 0.00 C ATOM 0 H PHE B 76 3.137 3.675 4.235 1.00 0.00 H new ATOM 0 HA PHE B 76 2.907 2.854 6.920 1.00 0.00 H new ATOM 0 HB2 PHE B 76 2.778 5.166 6.215 1.00 0.00 H new ATOM 0 HB3 PHE B 76 1.346 4.839 5.259 1.00 0.00 H new ATOM 0 HD1 PHE B 76 2.457 4.263 8.826 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -0.651 5.608 6.165 1.00 0.00 H new ATOM 0 HE1 PHE B 76 1.079 4.946 10.777 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -1.989 6.371 8.115 1.00 0.00 H new ATOM 0 HZ PHE B 76 -1.120 6.049 10.423 1.00 0.00 H new ATOM 2688 N LEU B 77 0.428 1.902 4.933 1.00 0.00 N ATOM 2689 CA LEU B 77 -0.612 0.878 4.848 1.00 0.00 C ATOM 2690 C LEU B 77 -0.024 -0.451 5.333 1.00 0.00 C ATOM 2691 O LEU B 77 -0.566 -1.107 6.227 1.00 0.00 O ATOM 2692 CB LEU B 77 -1.140 0.785 3.405 1.00 0.00 C ATOM 2693 CG LEU B 77 -2.555 0.210 3.299 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -3.037 0.322 1.848 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -2.643 -1.249 3.755 1.00 0.00 C ATOM 0 H LEU B 77 0.598 2.404 4.062 1.00 0.00 H new ATOM 0 HA LEU B 77 -1.460 1.135 5.483 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -1.128 1.780 2.959 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -0.461 0.165 2.819 1.00 0.00 H new ATOM 0 HG LEU B 77 -3.191 0.791 3.967 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -4.044 -0.086 1.767 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.044 1.370 1.547 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -2.365 -0.238 1.197 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -3.670 -1.600 3.656 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -1.989 -1.864 3.137 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -2.333 -1.324 4.797 1.00 0.00 H new ATOM 2707 N GLY B 78 1.136 -0.804 4.774 1.00 0.00 N ATOM 2708 CA GLY B 78 1.937 -1.924 5.238 1.00 0.00 C ATOM 2709 C GLY B 78 2.085 -1.921 6.762 1.00 0.00 C ATOM 2710 O GLY B 78 1.760 -2.905 7.425 1.00 0.00 O ATOM 0 H GLY B 78 1.544 -0.311 3.979 1.00 0.00 H new ATOM 0 HA2 GLY B 78 1.475 -2.858 4.919 1.00 0.00 H new ATOM 0 HA3 GLY B 78 2.924 -1.882 4.776 1.00 0.00 H new ATOM 2714 N ALA B 79 2.569 -0.809 7.318 1.00 0.00 N ATOM 2715 CA ALA B 79 2.809 -0.643 8.741 1.00 0.00 C ATOM 2716 C ALA B 79 1.547 -0.920 9.555 1.00 0.00 C ATOM 2717 O ALA B 79 1.607 -1.676 10.517 1.00 0.00 O ATOM 2718 CB ALA B 79 3.368 0.752 9.039 1.00 0.00 C ATOM 0 H ALA B 79 2.809 0.018 6.772 1.00 0.00 H new ATOM 0 HA ALA B 79 3.557 -1.377 9.042 1.00 0.00 H new ATOM 0 HB1 ALA B 79 3.540 0.854 10.111 1.00 0.00 H new ATOM 0 HB2 ALA B 79 4.309 0.888 8.506 1.00 0.00 H new ATOM 0 HB3 ALA B 79 2.653 1.508 8.713 1.00 0.00 H new ATOM 2724 N LEU B 80 0.407 -0.331 9.184 1.00 0.00 N ATOM 2725 CA LEU B 80 -0.850 -0.507 9.908 1.00 0.00 C ATOM 2726 C LEU B 80 -1.210 -1.989 10.059 1.00 0.00 C ATOM 2727 O LEU B 80 -1.582 -2.442 11.144 1.00 0.00 O ATOM 2728 CB LEU B 80 -1.977 0.275 9.220 1.00 0.00 C ATOM 2729 CG LEU B 80 -1.807 1.803 9.308 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -2.914 2.466 8.483 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -1.849 2.303 10.757 1.00 0.00 C ATOM 0 H LEU B 80 0.332 0.282 8.372 1.00 0.00 H new ATOM 0 HA LEU B 80 -0.720 -0.106 10.913 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -2.024 -0.018 8.171 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -2.929 -0.003 9.671 1.00 0.00 H new ATOM 0 HG LEU B 80 -0.827 2.069 8.911 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -2.807 3.550 8.535 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -2.837 2.143 7.445 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -3.887 2.178 8.881 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -1.725 3.386 10.772 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -2.808 2.041 11.205 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -1.044 1.838 11.326 1.00 0.00 H new ATOM 2743 N ALA B 81 -1.089 -2.761 8.977 1.00 0.00 N ATOM 2744 CA ALA B 81 -1.233 -4.211 9.049 1.00 0.00 C ATOM 2745 C ALA B 81 -0.139 -4.836 9.913 1.00 0.00 C ATOM 2746 O ALA B 81 -0.445 -5.649 10.778 1.00 0.00 O ATOM 2747 CB ALA B 81 -1.233 -4.784 7.638 1.00 0.00 C ATOM 0 H ALA B 81 -0.892 -2.404 8.042 1.00 0.00 H new ATOM 0 HA ALA B 81 -2.182 -4.454 9.527 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -1.340 -5.868 7.685 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -2.064 -4.361 7.074 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -0.294 -4.534 7.144 1.00 0.00 H new ATOM 2753 N MET B 82 1.128 -4.468 9.712 1.00 0.00 N ATOM 2754 CA MET B 82 2.234 -5.063 10.456 1.00 0.00 C ATOM 2755 C MET B 82 2.081 -4.872 11.974 1.00 0.00 C ATOM 2756 O MET B 82 2.358 -5.796 12.731 1.00 0.00 O ATOM 2757 CB MET B 82 3.578 -4.519 9.953 1.00 0.00 C ATOM 2758 CG MET B 82 3.881 -4.930 8.503 1.00 0.00 C ATOM 2759 SD MET B 82 5.024 -6.320 8.264 1.00 0.00 S ATOM 2760 CE MET B 82 4.159 -7.662 9.108 1.00 0.00 C ATOM 0 H MET B 82 1.412 -3.758 9.037 1.00 0.00 H new ATOM 0 HA MET B 82 2.211 -6.138 10.274 1.00 0.00 H new ATOM 0 HB2 MET B 82 3.574 -3.431 10.024 1.00 0.00 H new ATOM 0 HB3 MET B 82 4.376 -4.878 10.602 1.00 0.00 H new ATOM 0 HG2 MET B 82 2.938 -5.179 8.017 1.00 0.00 H new ATOM 0 HG3 MET B 82 4.288 -4.063 7.983 1.00 0.00 H new ATOM 0 HE1 MET B 82 4.675 -8.603 8.919 1.00 0.00 H new ATOM 0 HE2 MET B 82 4.142 -7.466 10.180 1.00 0.00 H new ATOM 0 HE3 MET B 82 3.137 -7.728 8.735 1.00 0.00 H new ATOM 2770 N ILE B 83 1.632 -3.696 12.431 1.00 0.00 N ATOM 2771 CA ILE B 83 1.339 -3.442 13.844 1.00 0.00 C ATOM 2772 C ILE B 83 -0.034 -3.985 14.265 1.00 0.00 C ATOM 2773 O ILE B 83 -0.431 -3.819 15.416 1.00 0.00 O ATOM 2774 CB ILE B 83 1.513 -1.953 14.210 1.00 0.00 C ATOM 2775 CG1 ILE B 83 0.382 -1.079 13.642 1.00 0.00 C ATOM 2776 CG2 ILE B 83 2.906 -1.463 13.787 1.00 0.00 C ATOM 2777 CD1 ILE B 83 0.554 0.410 13.955 1.00 0.00 C ATOM 0 H ILE B 83 1.462 -2.892 11.827 1.00 0.00 H new ATOM 0 HA ILE B 83 2.078 -3.999 14.420 1.00 0.00 H new ATOM 0 HB ILE B 83 1.441 -1.858 15.293 1.00 0.00 H new ATOM 0 HG12 ILE B 83 0.336 -1.213 12.561 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -0.571 -1.421 14.047 1.00 0.00 H new ATOM 0 HG21 ILE B 83 3.017 -0.411 14.050 1.00 0.00 H new ATOM 0 HG22 ILE B 83 3.669 -2.048 14.300 1.00 0.00 H new ATOM 0 HG23 ILE B 83 3.022 -1.581 12.710 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -0.277 0.970 13.526 1.00 0.00 H new ATOM 0 HD12 ILE B 83 0.571 0.555 15.035 1.00 0.00 H new ATOM 0 HD13 ILE B 83 1.491 0.766 13.527 1.00 0.00 H new ATOM 2789 N TYR B 84 -0.769 -4.617 13.344 1.00 0.00 N ATOM 2790 CA TYR B 84 -2.001 -5.338 13.610 1.00 0.00 C ATOM 2791 C TYR B 84 -3.168 -4.425 13.968 1.00 0.00 C ATOM 2792 O TYR B 84 -3.887 -4.678 14.934 1.00 0.00 O ATOM 2793 CB TYR B 84 -1.752 -6.495 14.596 1.00 0.00 C ATOM 2794 CG TYR B 84 -0.691 -7.457 14.096 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -0.824 -7.999 12.806 1.00 0.00 C ATOM 2796 CD2 TYR B 84 0.520 -7.620 14.793 1.00 0.00 C ATOM 2797 CE1 TYR B 84 0.282 -8.557 12.151 1.00 0.00 C ATOM 2798 CE2 TYR B 84 1.585 -8.316 14.193 1.00 0.00 C ATOM 2799 CZ TYR B 84 1.481 -8.751 12.860 1.00 0.00 C ATOM 2800 OH TYR B 84 2.530 -9.401 12.283 1.00 0.00 O ATOM 0 H TYR B 84 -0.505 -4.636 12.359 1.00 0.00 H new ATOM 0 HA TYR B 84 -2.330 -5.801 12.680 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -1.446 -6.089 15.560 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -2.683 -7.037 14.760 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -1.786 -7.985 12.316 1.00 0.00 H new ATOM 0 HD2 TYR B 84 0.632 -7.212 15.787 1.00 0.00 H new ATOM 0 HE1 TYR B 84 0.214 -8.836 11.110 1.00 0.00 H new ATOM 0 HE2 TYR B 84 2.484 -8.517 14.757 1.00 0.00 H new ATOM 0 HH TYR B 84 2.229 -9.842 11.461 1.00 0.00 H new ATOM 2810 N ASN B 85 -3.415 -3.420 13.116 1.00 0.00 N ATOM 2811 CA ASN B 85 -4.618 -2.590 13.153 1.00 0.00 C ATOM 2812 C ASN B 85 -5.856 -3.496 13.193 1.00 0.00 C ATOM 2813 O ASN B 85 -6.234 -4.083 12.177 1.00 0.00 O ATOM 2814 CB ASN B 85 -4.645 -1.666 11.924 1.00 0.00 C ATOM 2815 CG ASN B 85 -5.862 -0.738 11.883 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -6.605 -0.613 12.854 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -6.055 -0.050 10.759 1.00 0.00 N ATOM 0 H ASN B 85 -2.770 -3.160 12.370 1.00 0.00 H new ATOM 0 HA ASN B 85 -4.616 -1.966 14.047 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -3.737 -1.062 11.913 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -4.633 -2.276 11.021 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -6.836 0.602 10.688 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -5.421 -0.175 9.969 1.00 0.00 H new ATOM 2824 N GLU B 86 -6.434 -3.664 14.385 1.00 0.00 N ATOM 2825 CA GLU B 86 -7.506 -4.609 14.671 1.00 0.00 C ATOM 2826 C GLU B 86 -7.220 -5.997 14.087 1.00 0.00 C ATOM 2827 O GLU B 86 -8.108 -6.619 13.514 1.00 0.00 O ATOM 2828 CB GLU B 86 -8.852 -4.025 14.227 1.00 0.00 C ATOM 2829 CG GLU B 86 -9.228 -2.800 15.066 1.00 0.00 C ATOM 2830 CD GLU B 86 -10.570 -2.215 14.637 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -10.680 -1.869 13.441 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -11.452 -2.103 15.515 1.00 0.00 O ATOM 0 H GLU B 86 -6.155 -3.124 15.204 1.00 0.00 H new ATOM 0 HA GLU B 86 -7.561 -4.763 15.749 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -8.801 -3.746 13.174 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -9.629 -4.784 14.319 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -9.272 -3.079 16.119 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -8.452 -2.041 14.970 1.00 0.00 H new ATOM 2839 N ALA B 87 -5.981 -6.481 14.233 1.00 0.00 N ATOM 2840 CA ALA B 87 -5.554 -7.772 13.699 1.00 0.00 C ATOM 2841 C ALA B 87 -5.893 -7.894 12.211 1.00 0.00 C ATOM 2842 O ALA B 87 -6.438 -8.902 11.771 1.00 0.00 O ATOM 2843 CB ALA B 87 -6.145 -8.915 14.536 1.00 0.00 C ATOM 0 H ALA B 87 -5.244 -5.981 14.730 1.00 0.00 H new ATOM 0 HA ALA B 87 -4.469 -7.844 13.773 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -5.819 -9.871 14.127 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -5.803 -8.825 15.567 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -7.233 -8.861 14.509 1.00 0.00 H new ATOM 2849 N LEU B 88 -5.558 -6.851 11.444 1.00 0.00 N ATOM 2850 CA LEU B 88 -5.952 -6.693 10.050 1.00 0.00 C ATOM 2851 C LEU B 88 -7.481 -6.627 9.965 1.00 0.00 C ATOM 2852 O LEU B 88 -8.097 -7.315 9.153 1.00 0.00 O ATOM 2853 CB LEU B 88 -5.342 -7.771 9.123 1.00 0.00 C ATOM 2854 CG LEU B 88 -3.879 -7.522 8.723 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -2.928 -7.646 9.914 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -3.470 -8.539 7.649 1.00 0.00 C ATOM 0 H LEU B 88 -4.991 -6.077 11.789 1.00 0.00 H new ATOM 0 HA LEU B 88 -5.542 -5.754 9.678 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -5.409 -8.738 9.621 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -5.946 -7.836 8.218 1.00 0.00 H new ATOM 0 HG LEU B 88 -3.808 -6.503 8.341 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -1.906 -7.462 9.584 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -3.201 -6.915 10.675 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -2.999 -8.650 10.333 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -2.433 -8.367 7.361 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -3.574 -9.549 8.046 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -4.112 -8.424 6.776 1.00 0.00 H new