USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 922 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 11 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 41 SER OG : rot 180:sc= 0 USER MOD Set 2.2: B 13 MET CE :methyl 164:sc= -0.0166 (180deg=-0.316) USER MOD Set 3.1: A 35 ASN : amide:sc= 0.034 K(o=1,f=-9.8!) USER MOD Set 3.2: B 1 MET N :NH3+ -156:sc= 1.01 (180deg=0) USER MOD Set 4.1: A 11 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 13 MET CE :methyl 165:sc= -0.0109 (180deg=-0.323) USER MOD Set 5.2: B 41 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 1 MET N :NH3+ -167:sc= 1.19 (180deg=0) USER MOD Set 6.2: B 35 ASN : amide:sc= -0.111 K(o=1.1,f=-10!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 172:sc= 1.08 USER MOD Single : A 21 THR OG1 : rot 180:sc= -2.59! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -0.771 K(o=-0.77,f=0) USER MOD Single : A 38 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0315) USER MOD Single : A 43 HIS : no HD1:sc= -0.175 X(o=-0.18,f=-0.27) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc= -3.42 K(o=-3.4,f=-16!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 5 THR OG1 : rot 170:sc= 1.09 USER MOD Single : B 21 THR OG1 : rot 180:sc= -2.59! USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 29 GLN : amide:sc= -0.824 K(o=-0.82,f=0) USER MOD Single : B 38 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0357) USER MOD Single : B 43 HIS : no HD1:sc= -0.112 X(o=-0.11,f=-0.37) USER MOD Single : B 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 52 GLN : amide:sc= -3.33 K(o=-3.3,f=-15!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.228 -9.136 -6.157 1.00 0.00 N ATOM 2 CA MET A 1 -3.052 -9.757 -4.818 1.00 0.00 C ATOM 3 C MET A 1 -1.584 -10.068 -4.543 1.00 0.00 C ATOM 4 O MET A 1 -1.087 -11.135 -4.903 1.00 0.00 O ATOM 5 CB MET A 1 -3.885 -11.041 -4.764 1.00 0.00 C ATOM 6 CG MET A 1 -5.197 -10.883 -4.014 1.00 0.00 C ATOM 7 SD MET A 1 -6.056 -12.451 -3.777 1.00 0.00 S ATOM 8 CE MET A 1 -7.408 -11.941 -2.720 1.00 0.00 C ATOM 0 H1 MET A 1 -4.185 -8.737 -6.231 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.526 -8.379 -6.283 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.096 -9.857 -6.894 1.00 0.00 H new ATOM 0 HA MET A 1 -3.388 -9.058 -4.051 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.095 -11.371 -5.781 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.297 -11.826 -4.289 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.003 -10.429 -3.042 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.844 -10.198 -4.562 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.031 -12.804 -2.485 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.009 -11.519 -1.797 1.00 0.00 H new ATOM 0 HE3 MET A 1 -8.008 -11.189 -3.233 1.00 0.00 H new ATOM 20 N LEU A 2 -0.896 -9.128 -3.903 1.00 0.00 N ATOM 21 CA LEU A 2 0.516 -9.301 -3.580 1.00 0.00 C ATOM 22 C LEU A 2 0.732 -9.306 -2.069 1.00 0.00 C ATOM 23 O LEU A 2 0.602 -8.272 -1.415 1.00 0.00 O ATOM 24 CB LEU A 2 1.342 -8.183 -4.220 1.00 0.00 C ATOM 25 CG LEU A 2 2.783 -8.557 -4.572 1.00 0.00 C ATOM 26 CD1 LEU A 2 2.888 -8.958 -6.035 1.00 0.00 C ATOM 27 CD2 LEU A 2 3.725 -7.401 -4.266 1.00 0.00 C ATOM 0 H LEU A 2 -1.293 -8.239 -3.598 1.00 0.00 H new ATOM 0 HA LEU A 2 0.842 -10.262 -3.978 1.00 0.00 H new ATOM 0 HB2 LEU A 2 0.837 -7.854 -5.128 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.360 -7.332 -3.540 1.00 0.00 H new ATOM 0 HG LEU A 2 3.076 -9.410 -3.960 1.00 0.00 H new ATOM 0 HD11 LEU A 2 3.920 -9.221 -6.267 1.00 0.00 H new ATOM 0 HD12 LEU A 2 2.244 -9.817 -6.224 1.00 0.00 H new ATOM 0 HD13 LEU A 2 2.575 -8.124 -6.664 1.00 0.00 H new ATOM 0 HD21 LEU A 2 4.745 -7.685 -4.523 1.00 0.00 H new ATOM 0 HD22 LEU A 2 3.433 -6.529 -4.851 1.00 0.00 H new ATOM 0 HD23 LEU A 2 3.672 -7.160 -3.204 1.00 0.00 H new ATOM 39 N ILE A 3 1.070 -10.469 -1.519 1.00 0.00 N ATOM 40 CA ILE A 3 1.308 -10.587 -0.085 1.00 0.00 C ATOM 41 C ILE A 3 2.799 -10.503 0.225 1.00 0.00 C ATOM 42 O ILE A 3 3.549 -11.453 0.002 1.00 0.00 O ATOM 43 CB ILE A 3 0.729 -11.907 0.479 1.00 0.00 C ATOM 44 CG1 ILE A 3 -0.800 -11.829 0.547 1.00 0.00 C ATOM 45 CG2 ILE A 3 1.308 -12.216 1.856 1.00 0.00 C ATOM 46 CD1 ILE A 3 -1.320 -10.923 1.648 1.00 0.00 C ATOM 0 H ILE A 3 1.185 -11.338 -2.041 1.00 0.00 H new ATOM 0 HA ILE A 3 0.797 -9.754 0.398 1.00 0.00 H new ATOM 0 HB ILE A 3 1.011 -12.717 -0.194 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.179 -11.474 -0.411 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.199 -12.832 0.696 1.00 0.00 H new ATOM 0 HG21 ILE A 3 0.884 -13.149 2.228 1.00 0.00 H new ATOM 0 HG22 ILE A 3 2.391 -12.314 1.782 1.00 0.00 H new ATOM 0 HG23 ILE A 3 1.063 -11.406 2.544 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -2.410 -10.920 1.632 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.972 -11.288 2.614 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.952 -9.909 1.489 1.00 0.00 H new ATOM 58 N LEU A 4 3.212 -9.360 0.759 1.00 0.00 N ATOM 59 CA LEU A 4 4.604 -9.140 1.128 1.00 0.00 C ATOM 60 C LEU A 4 4.703 -8.746 2.596 1.00 0.00 C ATOM 61 O LEU A 4 4.278 -7.657 2.979 1.00 0.00 O ATOM 62 CB LEU A 4 5.227 -8.056 0.247 1.00 0.00 C ATOM 63 CG LEU A 4 6.652 -8.350 -0.221 1.00 0.00 C ATOM 64 CD1 LEU A 4 7.566 -8.589 0.970 1.00 0.00 C ATOM 65 CD2 LEU A 4 6.667 -9.550 -1.156 1.00 0.00 C ATOM 0 H LEU A 4 2.598 -8.567 0.947 1.00 0.00 H new ATOM 0 HA LEU A 4 5.154 -10.069 0.975 1.00 0.00 H new ATOM 0 HB2 LEU A 4 4.595 -7.912 -0.629 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.227 -7.116 0.798 1.00 0.00 H new ATOM 0 HG LEU A 4 7.022 -7.483 -0.768 1.00 0.00 H new ATOM 0 HD11 LEU A 4 8.576 -8.797 0.617 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.578 -7.702 1.603 1.00 0.00 H new ATOM 0 HD13 LEU A 4 7.200 -9.440 1.544 1.00 0.00 H new ATOM 0 HD21 LEU A 4 7.689 -9.746 -1.480 1.00 0.00 H new ATOM 0 HD22 LEU A 4 6.278 -10.424 -0.633 1.00 0.00 H new ATOM 0 HD23 LEU A 4 6.044 -9.341 -2.026 1.00 0.00 H new ATOM 77 N THR A 5 5.248 -9.635 3.419 1.00 0.00 N ATOM 78 CA THR A 5 5.378 -9.363 4.845 1.00 0.00 C ATOM 79 C THR A 5 6.288 -8.172 5.104 1.00 0.00 C ATOM 80 O THR A 5 7.447 -8.332 5.488 1.00 0.00 O ATOM 81 CB THR A 5 5.910 -10.584 5.587 1.00 0.00 C ATOM 82 OG1 THR A 5 5.789 -11.753 4.796 1.00 0.00 O ATOM 83 CG2 THR A 5 5.192 -10.832 6.895 1.00 0.00 C ATOM 0 H THR A 5 5.605 -10.544 3.125 1.00 0.00 H new ATOM 0 HA THR A 5 4.382 -9.126 5.218 1.00 0.00 H new ATOM 0 HB THR A 5 6.958 -10.367 5.795 1.00 0.00 H new ATOM 0 HG1 THR A 5 6.252 -12.496 5.237 1.00 0.00 H new ATOM 0 HG21 THR A 5 5.612 -11.713 7.379 1.00 0.00 H new ATOM 0 HG22 THR A 5 5.314 -9.967 7.547 1.00 0.00 H new ATOM 0 HG23 THR A 5 4.132 -10.995 6.703 1.00 0.00 H new ATOM 91 N ARG A 6 5.758 -6.979 4.893 1.00 0.00 N ATOM 92 CA ARG A 6 6.527 -5.769 5.107 1.00 0.00 C ATOM 93 C ARG A 6 6.573 -5.406 6.586 1.00 0.00 C ATOM 94 O ARG A 6 5.603 -5.600 7.325 1.00 0.00 O ATOM 95 CB ARG A 6 5.939 -4.612 4.299 1.00 0.00 C ATOM 96 CG ARG A 6 6.008 -4.825 2.795 1.00 0.00 C ATOM 97 CD ARG A 6 4.769 -4.288 2.098 1.00 0.00 C ATOM 98 NE ARG A 6 5.076 -3.751 0.774 1.00 0.00 N ATOM 99 CZ ARG A 6 5.603 -2.546 0.567 1.00 0.00 C ATOM 100 NH1 ARG A 6 5.882 -1.751 1.593 1.00 0.00 N ATOM 101 NH2 ARG A 6 5.852 -2.136 -0.669 1.00 0.00 N ATOM 0 H ARG A 6 4.801 -6.825 4.575 1.00 0.00 H new ATOM 0 HA ARG A 6 7.546 -5.954 4.768 1.00 0.00 H new ATOM 0 HB2 ARG A 6 4.899 -4.468 4.590 1.00 0.00 H new ATOM 0 HB3 ARG A 6 6.471 -3.695 4.553 1.00 0.00 H new ATOM 0 HG2 ARG A 6 6.894 -4.330 2.397 1.00 0.00 H new ATOM 0 HG3 ARG A 6 6.114 -5.889 2.582 1.00 0.00 H new ATOM 0 HD2 ARG A 6 4.032 -5.085 2.004 1.00 0.00 H new ATOM 0 HD3 ARG A 6 4.318 -3.507 2.710 1.00 0.00 H new ATOM 0 HE ARG A 6 4.875 -4.333 -0.039 1.00 0.00 H new ATOM 0 HH11 ARG A 6 5.693 -2.062 2.546 1.00 0.00 H new ATOM 0 HH12 ARG A 6 6.286 -0.829 1.429 1.00 0.00 H new ATOM 0 HH21 ARG A 6 5.640 -2.744 -1.460 1.00 0.00 H new ATOM 0 HH22 ARG A 6 6.256 -1.213 -0.829 1.00 0.00 H new ATOM 115 N ARG A 7 7.715 -4.885 7.005 1.00 0.00 N ATOM 116 CA ARG A 7 7.911 -4.484 8.393 1.00 0.00 C ATOM 117 C ARG A 7 9.216 -3.703 8.583 1.00 0.00 C ATOM 118 O ARG A 7 9.469 -3.166 9.661 1.00 0.00 O ATOM 119 CB ARG A 7 7.888 -5.709 9.306 1.00 0.00 C ATOM 120 CG ARG A 7 7.430 -5.399 10.723 1.00 0.00 C ATOM 121 CD ARG A 7 8.487 -5.774 11.750 1.00 0.00 C ATOM 122 NE ARG A 7 7.896 -6.335 12.963 1.00 0.00 N ATOM 123 CZ ARG A 7 8.513 -6.368 14.143 1.00 0.00 C ATOM 124 NH1 ARG A 7 9.739 -5.879 14.274 1.00 0.00 N ATOM 125 NH2 ARG A 7 7.901 -6.894 15.196 1.00 0.00 N ATOM 0 H ARG A 7 8.524 -4.729 6.403 1.00 0.00 H new ATOM 0 HA ARG A 7 7.090 -3.820 8.663 1.00 0.00 H new ATOM 0 HB2 ARG A 7 7.227 -6.461 8.875 1.00 0.00 H new ATOM 0 HB3 ARG A 7 8.887 -6.145 9.342 1.00 0.00 H new ATOM 0 HG2 ARG A 7 7.201 -4.337 10.807 1.00 0.00 H new ATOM 0 HG3 ARG A 7 6.508 -5.941 10.935 1.00 0.00 H new ATOM 0 HD2 ARG A 7 9.176 -6.498 11.314 1.00 0.00 H new ATOM 0 HD3 ARG A 7 9.073 -4.891 12.007 1.00 0.00 H new ATOM 0 HE ARG A 7 6.955 -6.724 12.902 1.00 0.00 H new ATOM 0 HH11 ARG A 7 10.215 -5.474 13.468 1.00 0.00 H new ATOM 0 HH12 ARG A 7 10.205 -5.908 15.181 1.00 0.00 H new ATOM 0 HH21 ARG A 7 6.959 -7.273 15.102 1.00 0.00 H new ATOM 0 HH22 ARG A 7 8.373 -6.920 16.100 1.00 0.00 H new ATOM 139 N VAL A 8 10.039 -3.634 7.538 1.00 0.00 N ATOM 140 CA VAL A 8 11.304 -2.909 7.610 1.00 0.00 C ATOM 141 C VAL A 8 11.847 -2.576 6.217 1.00 0.00 C ATOM 142 O VAL A 8 13.006 -2.187 6.075 1.00 0.00 O ATOM 143 CB VAL A 8 12.374 -3.706 8.389 1.00 0.00 C ATOM 144 CG1 VAL A 8 12.428 -3.250 9.839 1.00 0.00 C ATOM 145 CG2 VAL A 8 12.107 -5.203 8.305 1.00 0.00 C ATOM 0 H VAL A 8 9.853 -4.070 6.635 1.00 0.00 H new ATOM 0 HA VAL A 8 11.093 -1.981 8.141 1.00 0.00 H new ATOM 0 HB VAL A 8 13.343 -3.511 7.930 1.00 0.00 H new ATOM 0 HG11 VAL A 8 13.187 -3.822 10.372 1.00 0.00 H new ATOM 0 HG12 VAL A 8 12.679 -2.190 9.878 1.00 0.00 H new ATOM 0 HG13 VAL A 8 11.457 -3.411 10.307 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.874 -5.741 8.861 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.128 -5.423 8.732 1.00 0.00 H new ATOM 0 HG23 VAL A 8 12.127 -5.518 7.262 1.00 0.00 H new ATOM 155 N GLY A 9 11.012 -2.735 5.189 1.00 0.00 N ATOM 156 CA GLY A 9 11.445 -2.450 3.833 1.00 0.00 C ATOM 157 C GLY A 9 11.118 -1.035 3.395 1.00 0.00 C ATOM 158 O GLY A 9 11.267 -0.088 4.167 1.00 0.00 O ATOM 0 H GLY A 9 10.047 -3.055 5.273 1.00 0.00 H new ATOM 0 HA2 GLY A 9 12.521 -2.608 3.760 1.00 0.00 H new ATOM 0 HA3 GLY A 9 10.972 -3.155 3.150 1.00 0.00 H new ATOM 162 N GLU A 10 10.677 -0.892 2.147 1.00 0.00 N ATOM 163 CA GLU A 10 10.334 0.416 1.600 1.00 0.00 C ATOM 164 C GLU A 10 8.820 0.578 1.464 1.00 0.00 C ATOM 165 O GLU A 10 8.050 -0.184 2.048 1.00 0.00 O ATOM 166 CB GLU A 10 11.010 0.612 0.241 1.00 0.00 C ATOM 167 CG GLU A 10 11.637 1.985 0.066 1.00 0.00 C ATOM 168 CD GLU A 10 13.056 2.051 0.597 1.00 0.00 C ATOM 169 OE1 GLU A 10 13.977 1.594 -0.113 1.00 0.00 O ATOM 170 OE2 GLU A 10 13.247 2.559 1.721 1.00 0.00 O ATOM 0 H GLU A 10 10.549 -1.667 1.496 1.00 0.00 H new ATOM 0 HA GLU A 10 10.694 1.177 2.292 1.00 0.00 H new ATOM 0 HB2 GLU A 10 11.780 -0.149 0.115 1.00 0.00 H new ATOM 0 HB3 GLU A 10 10.274 0.455 -0.548 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.636 2.248 -0.992 1.00 0.00 H new ATOM 0 HG3 GLU A 10 11.026 2.727 0.580 1.00 0.00 H new ATOM 177 N THR A 11 8.403 1.580 0.694 1.00 0.00 N ATOM 178 CA THR A 11 6.983 1.851 0.483 1.00 0.00 C ATOM 179 C THR A 11 6.565 1.515 -0.944 1.00 0.00 C ATOM 180 O THR A 11 7.406 1.267 -1.808 1.00 0.00 O ATOM 181 CB THR A 11 6.679 3.321 0.778 1.00 0.00 C ATOM 182 OG1 THR A 11 7.080 4.142 -0.305 1.00 0.00 O ATOM 183 CG2 THR A 11 7.365 3.840 2.024 1.00 0.00 C ATOM 0 H THR A 11 9.030 2.219 0.205 1.00 0.00 H new ATOM 0 HA THR A 11 6.415 1.219 1.165 1.00 0.00 H new ATOM 0 HB THR A 11 5.601 3.366 0.933 1.00 0.00 H new ATOM 0 HG1 THR A 11 6.876 5.078 -0.099 1.00 0.00 H new ATOM 0 HG21 THR A 11 7.105 4.888 2.173 1.00 0.00 H new ATOM 0 HG22 THR A 11 7.039 3.260 2.887 1.00 0.00 H new ATOM 0 HG23 THR A 11 8.445 3.746 1.911 1.00 0.00 H new ATOM 191 N LEU A 12 5.258 1.514 -1.183 1.00 0.00 N ATOM 192 CA LEU A 12 4.719 1.214 -2.505 1.00 0.00 C ATOM 193 C LEU A 12 4.139 2.471 -3.146 1.00 0.00 C ATOM 194 O LEU A 12 3.731 3.398 -2.446 1.00 0.00 O ATOM 195 CB LEU A 12 3.646 0.121 -2.411 1.00 0.00 C ATOM 196 CG LEU A 12 2.258 0.596 -1.969 1.00 0.00 C ATOM 197 CD1 LEU A 12 1.181 -0.356 -2.467 1.00 0.00 C ATOM 198 CD2 LEU A 12 2.196 0.732 -0.457 1.00 0.00 C ATOM 0 H LEU A 12 4.551 1.718 -0.477 1.00 0.00 H new ATOM 0 HA LEU A 12 5.533 0.850 -3.132 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.554 -0.358 -3.386 1.00 0.00 H new ATOM 0 HB3 LEU A 12 3.989 -0.642 -1.712 1.00 0.00 H new ATOM 0 HG LEU A 12 2.076 1.577 -2.409 1.00 0.00 H new ATOM 0 HD11 LEU A 12 0.203 -0.001 -2.142 1.00 0.00 H new ATOM 0 HD12 LEU A 12 1.208 -0.399 -3.556 1.00 0.00 H new ATOM 0 HD13 LEU A 12 1.359 -1.351 -2.060 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.203 1.070 -0.163 1.00 0.00 H new ATOM 0 HD22 LEU A 12 2.402 -0.234 0.004 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.939 1.457 -0.126 1.00 0.00 H new ATOM 210 N MET A 13 4.100 2.502 -4.474 1.00 0.00 N ATOM 211 CA MET A 13 3.562 3.654 -5.183 1.00 0.00 C ATOM 212 C MET A 13 2.536 3.229 -6.225 1.00 0.00 C ATOM 213 O MET A 13 2.887 2.793 -7.321 1.00 0.00 O ATOM 214 CB MET A 13 4.690 4.441 -5.852 1.00 0.00 C ATOM 215 CG MET A 13 4.222 5.722 -6.525 1.00 0.00 C ATOM 216 SD MET A 13 4.972 5.972 -8.145 1.00 0.00 S ATOM 217 CE MET A 13 3.643 5.437 -9.220 1.00 0.00 C ATOM 0 H MET A 13 4.432 1.748 -5.076 1.00 0.00 H new ATOM 0 HA MET A 13 3.064 4.293 -4.454 1.00 0.00 H new ATOM 0 HB2 MET A 13 5.443 4.688 -5.104 1.00 0.00 H new ATOM 0 HB3 MET A 13 5.174 3.806 -6.594 1.00 0.00 H new ATOM 0 HG2 MET A 13 3.138 5.696 -6.632 1.00 0.00 H new ATOM 0 HG3 MET A 13 4.459 6.571 -5.885 1.00 0.00 H new ATOM 0 HE1 MET A 13 3.840 5.774 -10.238 1.00 0.00 H new ATOM 0 HE2 MET A 13 3.578 4.349 -9.204 1.00 0.00 H new ATOM 0 HE3 MET A 13 2.701 5.862 -8.873 1.00 0.00 H new ATOM 227 N ILE A 14 1.265 3.368 -5.870 1.00 0.00 N ATOM 228 CA ILE A 14 0.176 3.011 -6.759 1.00 0.00 C ATOM 229 C ILE A 14 -0.618 4.255 -7.159 1.00 0.00 C ATOM 230 O ILE A 14 -1.100 4.996 -6.303 1.00 0.00 O ATOM 231 CB ILE A 14 -0.764 1.983 -6.094 1.00 0.00 C ATOM 232 CG1 ILE A 14 -1.982 1.697 -6.980 1.00 0.00 C ATOM 233 CG2 ILE A 14 -1.203 2.476 -4.723 1.00 0.00 C ATOM 234 CD1 ILE A 14 -1.624 1.333 -8.404 1.00 0.00 C ATOM 0 H ILE A 14 0.965 3.729 -4.964 1.00 0.00 H new ATOM 0 HA ILE A 14 0.607 2.561 -7.653 1.00 0.00 H new ATOM 0 HB ILE A 14 -0.214 1.050 -5.969 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -2.558 0.883 -6.540 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -2.628 2.575 -6.990 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -1.865 1.740 -4.267 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -0.327 2.618 -4.090 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -1.731 3.423 -4.829 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.535 1.144 -8.971 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -1.075 2.155 -8.863 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -1.004 0.437 -8.405 1.00 0.00 H new ATOM 246 N GLY A 15 -0.748 4.479 -8.463 1.00 0.00 N ATOM 247 CA GLY A 15 -1.479 5.637 -8.949 1.00 0.00 C ATOM 248 C GLY A 15 -0.710 6.388 -10.020 1.00 0.00 C ATOM 249 O GLY A 15 -0.618 5.933 -11.160 1.00 0.00 O ATOM 0 H GLY A 15 -0.361 3.880 -9.192 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -2.440 5.316 -9.351 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.690 6.308 -8.116 1.00 0.00 H new ATOM 253 N ASP A 16 -0.153 7.539 -9.655 1.00 0.00 N ATOM 254 CA ASP A 16 0.615 8.347 -10.600 1.00 0.00 C ATOM 255 C ASP A 16 1.533 9.344 -9.887 1.00 0.00 C ATOM 256 O ASP A 16 2.085 10.240 -10.523 1.00 0.00 O ATOM 257 CB ASP A 16 -0.330 9.098 -11.540 1.00 0.00 C ATOM 258 CG ASP A 16 0.293 9.359 -12.897 1.00 0.00 C ATOM 259 OD1 ASP A 16 0.990 10.384 -13.043 1.00 0.00 O ATOM 260 OD2 ASP A 16 0.083 8.537 -13.814 1.00 0.00 O ATOM 0 H ASP A 16 -0.218 7.933 -8.716 1.00 0.00 H new ATOM 0 HA ASP A 16 1.243 7.667 -11.175 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.245 8.520 -11.668 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -0.613 10.047 -11.084 1.00 0.00 H new ATOM 265 N GLU A 17 1.695 9.176 -8.569 1.00 0.00 N ATOM 266 CA GLU A 17 2.546 10.050 -7.754 1.00 0.00 C ATOM 267 C GLU A 17 2.137 9.947 -6.286 1.00 0.00 C ATOM 268 O GLU A 17 1.702 10.927 -5.681 1.00 0.00 O ATOM 269 CB GLU A 17 2.455 11.513 -8.217 1.00 0.00 C ATOM 270 CG GLU A 17 3.204 12.490 -7.320 1.00 0.00 C ATOM 271 CD GLU A 17 4.373 13.152 -8.025 1.00 0.00 C ATOM 272 OE1 GLU A 17 5.414 12.485 -8.202 1.00 0.00 O ATOM 273 OE2 GLU A 17 4.246 14.336 -8.401 1.00 0.00 O ATOM 0 H GLU A 17 1.241 8.432 -8.039 1.00 0.00 H new ATOM 0 HA GLU A 17 3.579 9.722 -7.873 1.00 0.00 H new ATOM 0 HB2 GLU A 17 2.850 11.589 -9.230 1.00 0.00 H new ATOM 0 HB3 GLU A 17 1.406 11.806 -8.261 1.00 0.00 H new ATOM 0 HG2 GLU A 17 2.514 13.258 -6.970 1.00 0.00 H new ATOM 0 HG3 GLU A 17 3.568 11.962 -6.439 1.00 0.00 H new ATOM 280 N VAL A 18 2.260 8.749 -5.725 1.00 0.00 N ATOM 281 CA VAL A 18 1.887 8.512 -4.346 1.00 0.00 C ATOM 282 C VAL A 18 3.087 8.062 -3.504 1.00 0.00 C ATOM 283 O VAL A 18 4.239 8.313 -3.860 1.00 0.00 O ATOM 284 CB VAL A 18 0.775 7.450 -4.278 1.00 0.00 C ATOM 285 CG1 VAL A 18 -0.367 7.811 -5.215 1.00 0.00 C ATOM 286 CG2 VAL A 18 1.324 6.065 -4.599 1.00 0.00 C ATOM 0 H VAL A 18 2.617 7.927 -6.212 1.00 0.00 H new ATOM 0 HA VAL A 18 1.522 9.453 -3.934 1.00 0.00 H new ATOM 0 HB VAL A 18 0.387 7.428 -3.260 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.143 7.048 -5.153 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.783 8.776 -4.927 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.005 7.867 -6.238 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.519 5.333 -4.544 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.747 6.065 -5.604 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.100 5.805 -3.879 1.00 0.00 H new ATOM 296 N THR A 19 2.800 7.391 -2.389 1.00 0.00 N ATOM 297 CA THR A 19 3.828 6.890 -1.481 1.00 0.00 C ATOM 298 C THR A 19 3.179 6.457 -0.170 1.00 0.00 C ATOM 299 O THR A 19 2.825 7.291 0.660 1.00 0.00 O ATOM 300 CB THR A 19 4.899 7.957 -1.216 1.00 0.00 C ATOM 301 OG1 THR A 19 5.579 7.697 -0.001 1.00 0.00 O ATOM 302 CG2 THR A 19 4.347 9.365 -1.139 1.00 0.00 C ATOM 0 H THR A 19 1.848 7.180 -2.091 1.00 0.00 H new ATOM 0 HA THR A 19 4.318 6.034 -1.946 1.00 0.00 H new ATOM 0 HB THR A 19 5.574 7.898 -2.070 1.00 0.00 H new ATOM 0 HG1 THR A 19 6.258 8.388 0.148 1.00 0.00 H new ATOM 0 HG21 THR A 19 5.161 10.065 -0.950 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.863 9.618 -2.082 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.620 9.427 -0.330 1.00 0.00 H new ATOM 310 N VAL A 20 3.004 5.151 0.004 1.00 0.00 N ATOM 311 CA VAL A 20 2.374 4.628 1.211 1.00 0.00 C ATOM 312 C VAL A 20 3.313 3.715 1.995 1.00 0.00 C ATOM 313 O VAL A 20 3.677 2.632 1.533 1.00 0.00 O ATOM 314 CB VAL A 20 1.088 3.848 0.875 1.00 0.00 C ATOM 315 CG1 VAL A 20 0.353 3.448 2.146 1.00 0.00 C ATOM 316 CG2 VAL A 20 0.186 4.669 -0.033 1.00 0.00 C ATOM 0 H VAL A 20 3.287 4.440 -0.670 1.00 0.00 H new ATOM 0 HA VAL A 20 2.127 5.492 1.828 1.00 0.00 H new ATOM 0 HB VAL A 20 1.369 2.938 0.345 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -0.552 2.899 1.886 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.998 2.816 2.756 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.085 4.343 2.708 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.717 4.101 -0.259 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -0.086 5.598 0.468 1.00 0.00 H new ATOM 0 HG23 VAL A 20 0.713 4.897 -0.960 1.00 0.00 H new ATOM 326 N THR A 21 3.692 4.159 3.190 1.00 0.00 N ATOM 327 CA THR A 21 4.577 3.388 4.056 1.00 0.00 C ATOM 328 C THR A 21 3.767 2.583 5.070 1.00 0.00 C ATOM 329 O THR A 21 3.112 3.149 5.945 1.00 0.00 O ATOM 330 CB THR A 21 5.547 4.318 4.786 1.00 0.00 C ATOM 331 OG1 THR A 21 6.036 5.320 3.912 1.00 0.00 O ATOM 332 CG2 THR A 21 6.742 3.598 5.373 1.00 0.00 C ATOM 0 H THR A 21 3.398 5.054 3.582 1.00 0.00 H new ATOM 0 HA THR A 21 5.147 2.697 3.435 1.00 0.00 H new ATOM 0 HB THR A 21 4.969 4.753 5.602 1.00 0.00 H new ATOM 0 HG1 THR A 21 6.653 5.905 4.398 1.00 0.00 H new ATOM 0 HG21 THR A 21 7.389 4.317 5.876 1.00 0.00 H new ATOM 0 HG22 THR A 21 6.401 2.852 6.091 1.00 0.00 H new ATOM 0 HG23 THR A 21 7.298 3.106 4.575 1.00 0.00 H new ATOM 340 N VAL A 22 3.806 1.260 4.938 1.00 0.00 N ATOM 341 CA VAL A 22 3.064 0.378 5.835 1.00 0.00 C ATOM 342 C VAL A 22 3.750 0.240 7.193 1.00 0.00 C ATOM 343 O VAL A 22 3.122 -0.158 8.173 1.00 0.00 O ATOM 344 CB VAL A 22 2.891 -1.024 5.221 1.00 0.00 C ATOM 345 CG1 VAL A 22 2.012 -0.961 3.981 1.00 0.00 C ATOM 346 CG2 VAL A 22 4.245 -1.635 4.895 1.00 0.00 C ATOM 0 H VAL A 22 4.343 0.775 4.219 1.00 0.00 H new ATOM 0 HA VAL A 22 2.086 0.837 5.978 1.00 0.00 H new ATOM 0 HB VAL A 22 2.398 -1.663 5.954 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.902 -1.961 3.562 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.031 -0.570 4.250 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.473 -0.306 3.241 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.103 -2.625 4.462 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.769 -0.999 4.181 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.835 -1.719 5.807 1.00 0.00 H new ATOM 356 N LEU A 23 5.037 0.574 7.246 1.00 0.00 N ATOM 357 CA LEU A 23 5.801 0.487 8.488 1.00 0.00 C ATOM 358 C LEU A 23 5.881 -0.959 8.984 1.00 0.00 C ATOM 359 O LEU A 23 6.911 -1.616 8.835 1.00 0.00 O ATOM 360 CB LEU A 23 5.175 1.385 9.561 1.00 0.00 C ATOM 361 CG LEU A 23 6.173 2.106 10.470 1.00 0.00 C ATOM 362 CD1 LEU A 23 6.860 1.115 11.398 1.00 0.00 C ATOM 363 CD2 LEU A 23 7.200 2.864 9.640 1.00 0.00 C ATOM 0 H LEU A 23 5.572 0.907 6.444 1.00 0.00 H new ATOM 0 HA LEU A 23 6.815 0.832 8.288 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.551 2.131 9.069 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.516 0.778 10.181 1.00 0.00 H new ATOM 0 HG LEU A 23 5.627 2.826 11.080 1.00 0.00 H new ATOM 0 HD11 LEU A 23 7.566 1.645 12.037 1.00 0.00 H new ATOM 0 HD12 LEU A 23 6.113 0.618 12.017 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.394 0.372 10.806 1.00 0.00 H new ATOM 0 HD21 LEU A 23 7.901 3.371 10.303 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.742 2.164 9.004 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.692 3.601 9.018 1.00 0.00 H new ATOM 375 N GLY A 24 4.789 -1.452 9.565 1.00 0.00 N ATOM 376 CA GLY A 24 4.762 -2.817 10.061 1.00 0.00 C ATOM 377 C GLY A 24 5.156 -2.929 11.523 1.00 0.00 C ATOM 378 O GLY A 24 4.554 -3.695 12.276 1.00 0.00 O ATOM 0 H GLY A 24 3.923 -0.930 9.701 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.760 -3.225 9.929 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.437 -3.428 9.462 1.00 0.00 H new ATOM 382 N VAL A 25 6.172 -2.172 11.927 1.00 0.00 N ATOM 383 CA VAL A 25 6.645 -2.199 13.305 1.00 0.00 C ATOM 384 C VAL A 25 5.839 -1.244 14.176 1.00 0.00 C ATOM 385 O VAL A 25 5.521 -0.132 13.755 1.00 0.00 O ATOM 386 CB VAL A 25 8.140 -1.824 13.410 1.00 0.00 C ATOM 387 CG1 VAL A 25 8.784 -2.525 14.596 1.00 0.00 C ATOM 388 CG2 VAL A 25 8.881 -2.159 12.122 1.00 0.00 C ATOM 0 H VAL A 25 6.683 -1.532 11.318 1.00 0.00 H new ATOM 0 HA VAL A 25 6.514 -3.222 13.657 1.00 0.00 H new ATOM 0 HB VAL A 25 8.207 -0.747 13.566 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.837 -2.249 14.654 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.279 -2.225 15.514 1.00 0.00 H new ATOM 0 HG13 VAL A 25 8.698 -3.604 14.471 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.931 -1.885 12.224 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.803 -3.228 11.925 1.00 0.00 H new ATOM 0 HG23 VAL A 25 8.440 -1.604 11.294 1.00 0.00 H new ATOM 398 N LYS A 26 5.515 -1.677 15.397 1.00 0.00 N ATOM 399 CA LYS A 26 4.748 -0.855 16.332 1.00 0.00 C ATOM 400 C LYS A 26 4.194 -1.708 17.473 1.00 0.00 C ATOM 401 O LYS A 26 4.185 -2.937 17.398 1.00 0.00 O ATOM 402 CB LYS A 26 3.606 -0.126 15.621 1.00 0.00 C ATOM 403 CG LYS A 26 3.861 1.362 15.446 1.00 0.00 C ATOM 404 CD LYS A 26 3.100 2.182 16.476 1.00 0.00 C ATOM 405 CE LYS A 26 3.881 3.419 16.890 1.00 0.00 C ATOM 406 NZ LYS A 26 4.874 3.117 17.958 1.00 0.00 N ATOM 0 H LYS A 26 5.773 -2.594 15.760 1.00 0.00 H new ATOM 0 HA LYS A 26 5.425 -0.109 16.747 1.00 0.00 H new ATOM 0 HB2 LYS A 26 3.449 -0.578 14.642 1.00 0.00 H new ATOM 0 HB3 LYS A 26 2.686 -0.266 16.188 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.929 1.562 15.536 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.563 1.668 14.443 1.00 0.00 H new ATOM 0 HD2 LYS A 26 2.135 2.480 16.065 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.897 1.568 17.353 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.396 3.831 16.022 1.00 0.00 H new ATOM 0 HE3 LYS A 26 3.189 4.184 17.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 5.386 3.986 18.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 4.381 2.748 18.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 5.550 2.406 17.613 1.00 0.00 H new ATOM 420 N GLY A 27 3.740 -1.042 18.529 1.00 0.00 N ATOM 421 CA GLY A 27 3.195 -1.746 19.679 1.00 0.00 C ATOM 422 C GLY A 27 1.789 -2.272 19.446 1.00 0.00 C ATOM 423 O GLY A 27 0.827 -1.505 19.447 1.00 0.00 O ATOM 0 H GLY A 27 3.739 -0.025 18.611 1.00 0.00 H new ATOM 0 HA2 GLY A 27 3.851 -2.579 19.931 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.187 -1.075 20.538 1.00 0.00 H new ATOM 427 N ASN A 28 1.673 -3.587 19.254 1.00 0.00 N ATOM 428 CA ASN A 28 0.377 -4.227 19.025 1.00 0.00 C ATOM 429 C ASN A 28 -0.251 -3.751 17.719 1.00 0.00 C ATOM 430 O ASN A 28 -0.297 -4.487 16.733 1.00 0.00 O ATOM 431 CB ASN A 28 -0.570 -3.943 20.194 1.00 0.00 C ATOM 432 CG ASN A 28 -0.539 -5.037 21.243 1.00 0.00 C ATOM 433 OD1 ASN A 28 0.211 -4.960 22.216 1.00 0.00 O ATOM 434 ND2 ASN A 28 -1.357 -6.066 21.049 1.00 0.00 N ATOM 0 H ASN A 28 2.464 -4.231 19.253 1.00 0.00 H new ATOM 0 HA ASN A 28 0.543 -5.302 18.952 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -0.298 -2.994 20.655 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -1.587 -3.835 19.816 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -1.380 -6.833 21.721 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -1.962 -6.089 20.228 1.00 0.00 H new ATOM 441 N GLN A 29 -0.724 -2.511 17.720 1.00 0.00 N ATOM 442 CA GLN A 29 -1.340 -1.920 16.539 1.00 0.00 C ATOM 443 C GLN A 29 -0.261 -1.343 15.632 1.00 0.00 C ATOM 444 O GLN A 29 0.687 -0.726 16.111 1.00 0.00 O ATOM 445 CB GLN A 29 -2.338 -0.836 16.948 1.00 0.00 C ATOM 446 CG GLN A 29 -3.537 -0.731 16.021 1.00 0.00 C ATOM 447 CD GLN A 29 -4.721 -1.549 16.501 1.00 0.00 C ATOM 448 OE1 GLN A 29 -5.867 -1.106 16.426 1.00 0.00 O ATOM 449 NE2 GLN A 29 -4.449 -2.749 17.001 1.00 0.00 N ATOM 0 H GLN A 29 -0.692 -1.892 18.530 1.00 0.00 H new ATOM 0 HA GLN A 29 -1.882 -2.692 15.993 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -2.689 -1.040 17.960 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -1.826 0.126 16.976 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.834 0.314 15.934 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -3.250 -1.065 15.024 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -3.484 -3.077 17.044 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.205 -3.343 17.342 1.00 0.00 H new ATOM 458 N VAL A 30 -0.384 -1.568 14.326 1.00 0.00 N ATOM 459 CA VAL A 30 0.621 -1.085 13.386 1.00 0.00 C ATOM 460 C VAL A 30 0.257 0.280 12.822 1.00 0.00 C ATOM 461 O VAL A 30 -0.779 0.442 12.178 1.00 0.00 O ATOM 462 CB VAL A 30 0.816 -2.072 12.218 1.00 0.00 C ATOM 463 CG1 VAL A 30 1.985 -1.643 11.344 1.00 0.00 C ATOM 464 CG2 VAL A 30 1.023 -3.486 12.740 1.00 0.00 C ATOM 0 H VAL A 30 -1.160 -2.075 13.900 1.00 0.00 H new ATOM 0 HA VAL A 30 1.551 -0.999 13.947 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.087 -2.064 11.607 1.00 0.00 H new ATOM 0 HG11 VAL A 30 2.107 -2.352 10.525 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.791 -0.650 10.938 1.00 0.00 H new ATOM 0 HG13 VAL A 30 2.896 -1.619 11.941 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.159 -4.168 11.900 1.00 0.00 H new ATOM 0 HG22 VAL A 30 1.908 -3.513 13.376 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.151 -3.792 13.318 1.00 0.00 H new ATOM 474 N ARG A 31 1.127 1.260 13.061 1.00 0.00 N ATOM 475 CA ARG A 31 0.907 2.604 12.571 1.00 0.00 C ATOM 476 C ARG A 31 1.201 2.670 11.080 1.00 0.00 C ATOM 477 O ARG A 31 2.355 2.764 10.664 1.00 0.00 O ATOM 478 CB ARG A 31 1.787 3.601 13.329 1.00 0.00 C ATOM 479 CG ARG A 31 1.032 4.823 13.828 1.00 0.00 C ATOM 480 CD ARG A 31 0.676 4.697 15.301 1.00 0.00 C ATOM 481 NE ARG A 31 -0.488 5.506 15.655 1.00 0.00 N ATOM 482 CZ ARG A 31 -0.429 6.804 15.946 1.00 0.00 C ATOM 483 NH1 ARG A 31 0.731 7.447 15.920 1.00 0.00 N ATOM 484 NH2 ARG A 31 -1.537 7.462 16.261 1.00 0.00 N ATOM 0 H ARG A 31 1.989 1.140 13.592 1.00 0.00 H new ATOM 0 HA ARG A 31 -0.137 2.869 12.737 1.00 0.00 H new ATOM 0 HB2 ARG A 31 2.245 3.095 14.179 1.00 0.00 H new ATOM 0 HB3 ARG A 31 2.598 3.926 12.677 1.00 0.00 H new ATOM 0 HG2 ARG A 31 1.640 5.715 13.675 1.00 0.00 H new ATOM 0 HG3 ARG A 31 0.122 4.953 13.243 1.00 0.00 H new ATOM 0 HD2 ARG A 31 0.476 3.652 15.537 1.00 0.00 H new ATOM 0 HD3 ARG A 31 1.528 5.004 15.907 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.400 5.049 15.681 1.00 0.00 H new ATOM 0 HH11 ARG A 31 1.586 6.947 15.676 1.00 0.00 H new ATOM 0 HH12 ARG A 31 0.768 8.441 16.144 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -2.432 6.974 16.280 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -1.494 8.456 16.484 1.00 0.00 H new ATOM 498 N ILE A 32 0.146 2.599 10.282 1.00 0.00 N ATOM 499 CA ILE A 32 0.282 2.629 8.834 1.00 0.00 C ATOM 500 C ILE A 32 0.171 4.049 8.295 1.00 0.00 C ATOM 501 O ILE A 32 -0.822 4.738 8.527 1.00 0.00 O ATOM 502 CB ILE A 32 -0.781 1.735 8.165 1.00 0.00 C ATOM 503 CG1 ILE A 32 -0.895 0.405 8.920 1.00 0.00 C ATOM 504 CG2 ILE A 32 -0.436 1.501 6.700 1.00 0.00 C ATOM 505 CD1 ILE A 32 0.340 -0.463 8.807 1.00 0.00 C ATOM 0 H ILE A 32 -0.815 2.520 10.614 1.00 0.00 H new ATOM 0 HA ILE A 32 1.273 2.245 8.594 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.746 2.241 8.206 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.090 0.610 9.973 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.754 -0.148 8.538 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.197 0.868 6.244 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.398 2.457 6.178 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.535 1.010 6.629 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.188 -1.387 9.365 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.524 -0.699 7.759 1.00 0.00 H new ATOM 0 HD13 ILE A 32 1.198 0.070 9.215 1.00 0.00 H new ATOM 517 N GLY A 33 1.200 4.478 7.572 1.00 0.00 N ATOM 518 CA GLY A 33 1.206 5.812 7.007 1.00 0.00 C ATOM 519 C GLY A 33 0.914 5.807 5.523 1.00 0.00 C ATOM 520 O GLY A 33 1.650 5.207 4.743 1.00 0.00 O ATOM 0 H GLY A 33 2.031 3.923 7.368 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.464 6.425 7.519 1.00 0.00 H new ATOM 0 HA3 GLY A 33 2.177 6.274 7.183 1.00 0.00 H new ATOM 524 N VAL A 34 -0.165 6.472 5.131 1.00 0.00 N ATOM 525 CA VAL A 34 -0.549 6.534 3.730 1.00 0.00 C ATOM 526 C VAL A 34 -0.338 7.931 3.161 1.00 0.00 C ATOM 527 O VAL A 34 -1.125 8.844 3.416 1.00 0.00 O ATOM 528 CB VAL A 34 -2.022 6.129 3.534 1.00 0.00 C ATOM 529 CG1 VAL A 34 -2.354 6.019 2.054 1.00 0.00 C ATOM 530 CG2 VAL A 34 -2.316 4.821 4.254 1.00 0.00 C ATOM 0 H VAL A 34 -0.788 6.975 5.763 1.00 0.00 H new ATOM 0 HA VAL A 34 0.089 5.829 3.197 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.654 6.905 3.966 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -3.399 5.732 1.936 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -2.185 6.981 1.571 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.716 5.265 1.593 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -3.361 4.550 4.105 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -1.677 4.034 3.854 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.121 4.941 5.320 1.00 0.00 H new ATOM 540 N ASN A 35 0.727 8.088 2.383 1.00 0.00 N ATOM 541 CA ASN A 35 1.037 9.372 1.769 1.00 0.00 C ATOM 542 C ASN A 35 0.594 9.381 0.310 1.00 0.00 C ATOM 543 O ASN A 35 1.198 8.730 -0.542 1.00 0.00 O ATOM 544 CB ASN A 35 2.533 9.674 1.873 1.00 0.00 C ATOM 545 CG ASN A 35 2.807 11.116 2.254 1.00 0.00 C ATOM 546 OD1 ASN A 35 1.905 11.953 2.251 1.00 0.00 O ATOM 547 ND2 ASN A 35 4.058 11.413 2.584 1.00 0.00 N ATOM 0 H ASN A 35 1.389 7.343 2.163 1.00 0.00 H new ATOM 0 HA ASN A 35 0.493 10.150 2.305 1.00 0.00 H new ATOM 0 HB2 ASN A 35 2.983 9.014 2.614 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.012 9.456 0.918 1.00 0.00 H new ATOM 0 HD21 ASN A 35 4.303 12.367 2.849 1.00 0.00 H new ATOM 0 HD22 ASN A 35 4.774 10.687 2.573 1.00 0.00 H new ATOM 554 N ALA A 36 -0.474 10.118 0.040 1.00 0.00 N ATOM 555 CA ALA A 36 -1.017 10.212 -1.310 1.00 0.00 C ATOM 556 C ALA A 36 -1.535 11.614 -1.613 1.00 0.00 C ATOM 557 O ALA A 36 -2.027 12.311 -0.725 1.00 0.00 O ATOM 558 CB ALA A 36 -2.125 9.188 -1.503 1.00 0.00 C ATOM 0 H ALA A 36 -0.983 10.661 0.738 1.00 0.00 H new ATOM 0 HA ALA A 36 -0.207 10.001 -2.009 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -2.522 9.268 -2.515 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.725 8.186 -1.349 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.923 9.375 -0.784 1.00 0.00 H new ATOM 564 N PRO A 37 -1.435 12.044 -2.884 1.00 0.00 N ATOM 565 CA PRO A 37 -1.899 13.364 -3.315 1.00 0.00 C ATOM 566 C PRO A 37 -3.414 13.416 -3.475 1.00 0.00 C ATOM 567 O PRO A 37 -4.061 12.388 -3.677 1.00 0.00 O ATOM 568 CB PRO A 37 -1.211 13.548 -4.665 1.00 0.00 C ATOM 569 CG PRO A 37 -1.065 12.166 -5.200 1.00 0.00 C ATOM 570 CD PRO A 37 -0.864 11.270 -4.006 1.00 0.00 C ATOM 0 HA PRO A 37 -1.663 14.143 -2.590 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -1.806 14.171 -5.332 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -0.242 14.035 -4.554 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -1.951 11.871 -5.763 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -0.218 12.101 -5.882 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -1.373 10.315 -4.133 1.00 0.00 H new ATOM 0 HD3 PRO A 37 0.191 11.050 -3.844 1.00 0.00 H new ATOM 578 N LYS A 38 -3.976 14.617 -3.384 1.00 0.00 N ATOM 579 CA LYS A 38 -5.418 14.796 -3.519 1.00 0.00 C ATOM 580 C LYS A 38 -5.810 15.058 -4.973 1.00 0.00 C ATOM 581 O LYS A 38 -6.792 15.748 -5.243 1.00 0.00 O ATOM 582 CB LYS A 38 -5.892 15.953 -2.634 1.00 0.00 C ATOM 583 CG LYS A 38 -7.016 15.571 -1.685 1.00 0.00 C ATOM 584 CD LYS A 38 -8.002 16.712 -1.501 1.00 0.00 C ATOM 585 CE LYS A 38 -7.536 17.684 -0.429 1.00 0.00 C ATOM 586 NZ LYS A 38 -7.744 17.140 0.941 1.00 0.00 N ATOM 0 H LYS A 38 -3.457 15.479 -3.218 1.00 0.00 H new ATOM 0 HA LYS A 38 -5.902 13.874 -3.197 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.048 16.325 -2.053 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -6.227 16.772 -3.270 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.539 14.696 -2.072 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -6.598 15.291 -0.718 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -8.127 17.242 -2.445 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -8.978 16.310 -1.230 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -6.479 17.906 -0.575 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -8.077 18.625 -0.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -7.558 17.885 1.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -8.725 16.810 1.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.094 16.344 1.101 1.00 0.00 H new ATOM 600 N GLU A 39 -5.041 14.502 -5.906 1.00 0.00 N ATOM 601 CA GLU A 39 -5.316 14.679 -7.327 1.00 0.00 C ATOM 602 C GLU A 39 -5.897 13.403 -7.932 1.00 0.00 C ATOM 603 O GLU A 39 -6.786 13.457 -8.781 1.00 0.00 O ATOM 604 CB GLU A 39 -4.039 15.075 -8.071 1.00 0.00 C ATOM 605 CG GLU A 39 -4.272 16.086 -9.182 1.00 0.00 C ATOM 606 CD GLU A 39 -4.750 17.426 -8.658 1.00 0.00 C ATOM 607 OE1 GLU A 39 -4.362 17.796 -7.530 1.00 0.00 O ATOM 608 OE2 GLU A 39 -5.513 18.106 -9.377 1.00 0.00 O ATOM 0 H GLU A 39 -4.224 13.926 -5.703 1.00 0.00 H new ATOM 0 HA GLU A 39 -6.051 15.477 -7.432 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.326 15.489 -7.358 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.583 14.180 -8.495 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.346 16.227 -9.740 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -5.008 15.689 -9.881 1.00 0.00 H new ATOM 615 N VAL A 40 -5.390 12.257 -7.486 1.00 0.00 N ATOM 616 CA VAL A 40 -5.864 10.970 -7.982 1.00 0.00 C ATOM 617 C VAL A 40 -7.013 10.446 -7.127 1.00 0.00 C ATOM 618 O VAL A 40 -7.066 10.693 -5.923 1.00 0.00 O ATOM 619 CB VAL A 40 -4.733 9.922 -8.009 1.00 0.00 C ATOM 620 CG1 VAL A 40 -5.193 8.657 -8.717 1.00 0.00 C ATOM 621 CG2 VAL A 40 -3.492 10.494 -8.677 1.00 0.00 C ATOM 0 H VAL A 40 -4.653 12.194 -6.784 1.00 0.00 H new ATOM 0 HA VAL A 40 -6.216 11.132 -9.001 1.00 0.00 H new ATOM 0 HB VAL A 40 -4.478 9.663 -6.981 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -4.381 7.929 -8.726 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -6.051 8.237 -8.191 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -5.477 8.896 -9.742 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.704 9.741 -8.687 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.730 10.783 -9.700 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.151 11.368 -8.123 1.00 0.00 H new ATOM 631 N SER A 41 -7.935 9.726 -7.760 1.00 0.00 N ATOM 632 CA SER A 41 -9.089 9.171 -7.058 1.00 0.00 C ATOM 633 C SER A 41 -8.654 8.326 -5.864 1.00 0.00 C ATOM 634 O SER A 41 -8.266 7.168 -6.018 1.00 0.00 O ATOM 635 CB SER A 41 -9.934 8.325 -8.012 1.00 0.00 C ATOM 636 OG SER A 41 -11.216 8.067 -7.466 1.00 0.00 O ATOM 0 H SER A 41 -7.906 9.513 -8.757 1.00 0.00 H new ATOM 0 HA SER A 41 -9.688 10.004 -6.689 1.00 0.00 H new ATOM 0 HB2 SER A 41 -10.039 8.842 -8.966 1.00 0.00 H new ATOM 0 HB3 SER A 41 -9.425 7.383 -8.215 1.00 0.00 H new ATOM 0 HG SER A 41 -11.737 7.526 -8.096 1.00 0.00 H new ATOM 642 N VAL A 42 -8.729 8.912 -4.672 1.00 0.00 N ATOM 643 CA VAL A 42 -8.350 8.213 -3.451 1.00 0.00 C ATOM 644 C VAL A 42 -9.513 8.177 -2.461 1.00 0.00 C ATOM 645 O VAL A 42 -10.059 9.219 -2.097 1.00 0.00 O ATOM 646 CB VAL A 42 -7.132 8.879 -2.778 1.00 0.00 C ATOM 647 CG1 VAL A 42 -7.459 10.305 -2.360 1.00 0.00 C ATOM 648 CG2 VAL A 42 -6.665 8.059 -1.585 1.00 0.00 C ATOM 0 H VAL A 42 -9.049 9.870 -4.527 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.084 7.194 -3.734 1.00 0.00 H new ATOM 0 HB VAL A 42 -6.320 8.918 -3.504 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.586 10.755 -1.888 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -7.737 10.887 -3.239 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -8.289 10.296 -1.654 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.805 8.545 -1.124 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.473 7.983 -0.857 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.382 7.061 -1.918 1.00 0.00 H new ATOM 658 N HIS A 43 -9.889 6.977 -2.025 1.00 0.00 N ATOM 659 CA HIS A 43 -10.985 6.817 -1.076 1.00 0.00 C ATOM 660 C HIS A 43 -10.546 5.967 0.113 1.00 0.00 C ATOM 661 O HIS A 43 -9.887 4.942 -0.059 1.00 0.00 O ATOM 662 CB HIS A 43 -12.194 6.176 -1.763 1.00 0.00 C ATOM 663 CG HIS A 43 -13.324 7.129 -1.996 1.00 0.00 C ATOM 664 ND1 HIS A 43 -13.755 8.033 -1.048 1.00 0.00 N ATOM 665 CD2 HIS A 43 -14.118 7.318 -3.078 1.00 0.00 C ATOM 666 CE1 HIS A 43 -14.763 8.735 -1.534 1.00 0.00 C ATOM 667 NE2 HIS A 43 -15.002 8.321 -2.765 1.00 0.00 N ATOM 0 H HIS A 43 -9.451 6.103 -2.314 1.00 0.00 H new ATOM 0 HA HIS A 43 -11.269 7.804 -0.711 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -11.879 5.758 -2.719 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -12.550 5.345 -1.154 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -14.065 6.780 -4.013 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -15.300 9.514 -1.014 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -15.726 8.687 -3.383 1.00 0.00 H new ATOM 675 N ARG A 44 -10.916 6.394 1.317 1.00 0.00 N ATOM 676 CA ARG A 44 -10.558 5.664 2.528 1.00 0.00 C ATOM 677 C ARG A 44 -11.646 5.816 3.587 1.00 0.00 C ATOM 678 O ARG A 44 -12.680 6.438 3.342 1.00 0.00 O ATOM 679 CB ARG A 44 -9.221 6.167 3.075 1.00 0.00 C ATOM 680 CG ARG A 44 -8.013 5.609 2.339 1.00 0.00 C ATOM 681 CD ARG A 44 -7.197 6.713 1.685 1.00 0.00 C ATOM 682 NE ARG A 44 -6.847 7.770 2.631 1.00 0.00 N ATOM 683 CZ ARG A 44 -5.909 8.686 2.405 1.00 0.00 C ATOM 684 NH1 ARG A 44 -5.225 8.679 1.268 1.00 0.00 N ATOM 685 NH2 ARG A 44 -5.654 9.613 3.319 1.00 0.00 N ATOM 0 H ARG A 44 -11.462 7.240 1.479 1.00 0.00 H new ATOM 0 HA ARG A 44 -10.462 4.608 2.276 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -9.201 7.255 3.017 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -9.147 5.903 4.130 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -7.384 5.056 3.037 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -8.344 4.901 1.579 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -6.286 6.289 1.263 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -7.763 7.140 0.857 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.351 7.808 3.517 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -5.417 7.969 0.562 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -4.507 9.384 1.100 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.177 9.623 4.195 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -4.935 10.315 3.146 1.00 0.00 H new ATOM 699 N GLU A 45 -11.407 5.248 4.765 1.00 0.00 N ATOM 700 CA GLU A 45 -12.370 5.326 5.858 1.00 0.00 C ATOM 701 C GLU A 45 -12.648 6.778 6.235 1.00 0.00 C ATOM 702 O GLU A 45 -11.733 7.601 6.299 1.00 0.00 O ATOM 703 CB GLU A 45 -11.855 4.557 7.077 1.00 0.00 C ATOM 704 CG GLU A 45 -12.903 3.662 7.719 1.00 0.00 C ATOM 705 CD GLU A 45 -12.291 2.552 8.551 1.00 0.00 C ATOM 706 OE1 GLU A 45 -11.740 1.601 7.959 1.00 0.00 O ATOM 707 OE2 GLU A 45 -12.362 2.636 9.795 1.00 0.00 O ATOM 0 H GLU A 45 -10.557 4.730 4.987 1.00 0.00 H new ATOM 0 HA GLU A 45 -13.302 4.873 5.521 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -11.002 3.947 6.778 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -11.493 5.269 7.819 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -13.555 4.267 8.350 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -13.528 3.225 6.941 1.00 0.00 H new ATOM 714 N GLU A 46 -13.918 7.089 6.479 1.00 0.00 N ATOM 715 CA GLU A 46 -14.318 8.443 6.844 1.00 0.00 C ATOM 716 C GLU A 46 -13.561 8.927 8.078 1.00 0.00 C ATOM 717 O GLU A 46 -12.830 9.915 8.020 1.00 0.00 O ATOM 718 CB GLU A 46 -15.827 8.499 7.100 1.00 0.00 C ATOM 719 CG GLU A 46 -16.592 9.290 6.051 1.00 0.00 C ATOM 720 CD GLU A 46 -16.920 8.463 4.823 1.00 0.00 C ATOM 721 OE1 GLU A 46 -15.976 8.016 4.139 1.00 0.00 O ATOM 722 OE2 GLU A 46 -18.121 8.262 4.546 1.00 0.00 O ATOM 0 H GLU A 46 -14.687 6.421 6.430 1.00 0.00 H new ATOM 0 HA GLU A 46 -14.071 9.103 6.012 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -16.219 7.483 7.135 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -16.005 8.943 8.079 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -17.516 9.667 6.488 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -16.003 10.157 5.754 1.00 0.00 H new ATOM 729 N ILE A 47 -13.743 8.226 9.194 1.00 0.00 N ATOM 730 CA ILE A 47 -13.079 8.587 10.443 1.00 0.00 C ATOM 731 C ILE A 47 -11.567 8.678 10.262 1.00 0.00 C ATOM 732 O ILE A 47 -10.922 9.593 10.777 1.00 0.00 O ATOM 733 CB ILE A 47 -13.400 7.572 11.561 1.00 0.00 C ATOM 734 CG1 ILE A 47 -12.726 7.985 12.871 1.00 0.00 C ATOM 735 CG2 ILE A 47 -12.962 6.174 11.152 1.00 0.00 C ATOM 736 CD1 ILE A 47 -13.459 7.504 14.104 1.00 0.00 C ATOM 0 H ILE A 47 -14.345 7.405 9.259 1.00 0.00 H new ATOM 0 HA ILE A 47 -13.460 9.566 10.733 1.00 0.00 H new ATOM 0 HB ILE A 47 -14.478 7.562 11.719 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -11.709 7.593 12.887 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -12.649 9.072 12.904 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -13.196 5.471 11.952 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -13.488 5.879 10.244 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -11.888 6.169 10.967 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -12.925 7.833 14.996 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -14.468 7.917 14.112 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -13.513 6.415 14.094 1.00 0.00 H new ATOM 748 N TYR A 48 -11.005 7.724 9.524 1.00 0.00 N ATOM 749 CA TYR A 48 -9.568 7.693 9.271 1.00 0.00 C ATOM 750 C TYR A 48 -9.051 9.072 8.869 1.00 0.00 C ATOM 751 O TYR A 48 -8.171 9.634 9.523 1.00 0.00 O ATOM 752 CB TYR A 48 -9.247 6.678 8.170 1.00 0.00 C ATOM 753 CG TYR A 48 -9.176 5.244 8.653 1.00 0.00 C ATOM 754 CD1 TYR A 48 -9.865 4.832 9.788 1.00 0.00 C ATOM 755 CD2 TYR A 48 -8.418 4.301 7.969 1.00 0.00 C ATOM 756 CE1 TYR A 48 -9.800 3.524 10.228 1.00 0.00 C ATOM 757 CE2 TYR A 48 -8.349 2.990 8.403 1.00 0.00 C ATOM 758 CZ TYR A 48 -9.041 2.607 9.532 1.00 0.00 C ATOM 759 OH TYR A 48 -8.974 1.303 9.967 1.00 0.00 O ATOM 0 H TYR A 48 -11.525 6.961 9.090 1.00 0.00 H new ATOM 0 HA TYR A 48 -9.070 7.394 10.194 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -10.006 6.751 7.391 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -8.294 6.944 7.712 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -10.461 5.547 10.335 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -7.874 4.597 7.084 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -10.341 3.221 11.112 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -7.756 2.269 7.860 1.00 0.00 H new ATOM 0 HH TYR A 48 -8.399 0.786 9.365 1.00 0.00 H new ATOM 769 N GLN A 49 -9.602 9.608 7.786 1.00 0.00 N ATOM 770 CA GLN A 49 -9.195 10.916 7.292 1.00 0.00 C ATOM 771 C GLN A 49 -9.774 12.045 8.144 1.00 0.00 C ATOM 772 O GLN A 49 -9.257 13.159 8.133 1.00 0.00 O ATOM 773 CB GLN A 49 -9.630 11.088 5.835 1.00 0.00 C ATOM 774 CG GLN A 49 -8.691 10.427 4.840 1.00 0.00 C ATOM 775 CD GLN A 49 -9.040 10.755 3.401 1.00 0.00 C ATOM 776 OE1 GLN A 49 -9.831 10.056 2.767 1.00 0.00 O ATOM 777 NE2 GLN A 49 -8.449 11.823 2.878 1.00 0.00 N ATOM 0 H GLN A 49 -10.331 9.156 7.234 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.108 10.970 7.356 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -10.630 10.672 5.711 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -9.697 12.152 5.607 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -7.669 10.746 5.044 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -8.722 9.346 4.980 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -7.800 12.373 3.440 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -8.644 12.093 1.914 1.00 0.00 H new ATOM 786 N ARG A 50 -10.846 11.758 8.880 1.00 0.00 N ATOM 787 CA ARG A 50 -11.476 12.767 9.725 1.00 0.00 C ATOM 788 C ARG A 50 -10.629 13.068 10.964 1.00 0.00 C ATOM 789 O ARG A 50 -10.865 14.055 11.659 1.00 0.00 O ATOM 790 CB ARG A 50 -12.894 12.321 10.126 1.00 0.00 C ATOM 791 CG ARG A 50 -13.032 11.850 11.569 1.00 0.00 C ATOM 792 CD ARG A 50 -14.477 11.523 11.910 1.00 0.00 C ATOM 793 NE ARG A 50 -14.602 10.878 13.215 1.00 0.00 N ATOM 794 CZ ARG A 50 -15.755 10.734 13.864 1.00 0.00 C ATOM 795 NH1 ARG A 50 -16.885 11.186 13.332 1.00 0.00 N ATOM 796 NH2 ARG A 50 -15.781 10.136 15.047 1.00 0.00 N ATOM 0 H ARG A 50 -11.293 10.842 8.908 1.00 0.00 H new ATOM 0 HA ARG A 50 -11.551 13.689 9.148 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -13.581 13.152 9.962 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -13.207 11.514 9.464 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -12.411 10.968 11.726 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -12.664 12.624 12.243 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -15.067 12.439 11.901 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -14.891 10.870 11.142 1.00 0.00 H new ATOM 0 HE ARG A 50 -13.756 10.517 13.655 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -16.872 11.646 12.422 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -17.766 11.073 13.834 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -14.917 9.786 15.461 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -16.665 10.026 15.544 1.00 0.00 H new ATOM 810 N ILE A 51 -9.649 12.212 11.238 1.00 0.00 N ATOM 811 CA ILE A 51 -8.781 12.397 12.395 1.00 0.00 C ATOM 812 C ILE A 51 -7.375 12.812 11.974 1.00 0.00 C ATOM 813 O ILE A 51 -6.701 13.560 12.683 1.00 0.00 O ATOM 814 CB ILE A 51 -8.695 11.114 13.244 1.00 0.00 C ATOM 815 CG1 ILE A 51 -10.096 10.604 13.581 1.00 0.00 C ATOM 816 CG2 ILE A 51 -7.899 11.369 14.516 1.00 0.00 C ATOM 817 CD1 ILE A 51 -10.123 9.157 14.027 1.00 0.00 C ATOM 0 H ILE A 51 -9.437 11.387 10.677 1.00 0.00 H new ATOM 0 HA ILE A 51 -9.223 13.192 12.995 1.00 0.00 H new ATOM 0 HB ILE A 51 -8.179 10.349 12.664 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -10.520 11.226 14.369 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -10.735 10.718 12.706 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.848 10.452 15.103 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -6.890 11.689 14.256 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -8.388 12.148 15.101 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -11.149 8.864 14.249 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -9.729 8.524 13.232 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -9.511 9.040 14.921 1.00 0.00 H new ATOM 829 N GLN A 52 -6.932 12.318 10.822 1.00 0.00 N ATOM 830 CA GLN A 52 -5.599 12.639 10.319 1.00 0.00 C ATOM 831 C GLN A 52 -5.667 13.622 9.153 1.00 0.00 C ATOM 832 O GLN A 52 -4.981 14.644 9.152 1.00 0.00 O ATOM 833 CB GLN A 52 -4.874 11.362 9.887 1.00 0.00 C ATOM 834 CG GLN A 52 -3.752 10.954 10.827 1.00 0.00 C ATOM 835 CD GLN A 52 -4.240 10.682 12.237 1.00 0.00 C ATOM 836 OE1 GLN A 52 -5.327 11.110 12.623 1.00 0.00 O ATOM 837 NE2 GLN A 52 -3.435 9.966 13.014 1.00 0.00 N ATOM 0 H GLN A 52 -7.473 11.697 10.221 1.00 0.00 H new ATOM 0 HA GLN A 52 -5.042 13.112 11.128 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -5.596 10.548 9.821 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -4.465 11.507 8.887 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.264 10.061 10.437 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.000 11.743 10.853 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -2.542 9.631 12.652 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -3.710 9.751 13.972 1.00 0.00 H new ATOM 846 N ALA A 53 -6.496 13.309 8.163 1.00 0.00 N ATOM 847 CA ALA A 53 -6.647 14.169 6.996 1.00 0.00 C ATOM 848 C ALA A 53 -7.188 15.535 7.398 1.00 0.00 C ATOM 849 O ALA A 53 -6.480 16.540 7.333 1.00 0.00 O ATOM 850 CB ALA A 53 -7.560 13.515 5.971 1.00 0.00 C ATOM 0 H ALA A 53 -7.072 12.468 8.146 1.00 0.00 H new ATOM 0 HA ALA A 53 -5.665 14.311 6.546 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -7.663 14.169 5.105 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -7.132 12.563 5.657 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.541 13.343 6.415 1.00 0.00 H new ATOM 856 N GLU A 54 -8.446 15.561 7.821 1.00 0.00 N ATOM 857 CA GLU A 54 -9.087 16.798 8.245 1.00 0.00 C ATOM 858 C GLU A 54 -9.403 16.752 9.735 1.00 0.00 C ATOM 859 O GLU A 54 -10.169 15.904 10.191 1.00 0.00 O ATOM 860 CB GLU A 54 -10.369 17.034 7.444 1.00 0.00 C ATOM 861 CG GLU A 54 -10.850 18.475 7.477 1.00 0.00 C ATOM 862 CD GLU A 54 -9.824 19.445 6.924 1.00 0.00 C ATOM 863 OE1 GLU A 54 -9.648 19.482 5.688 1.00 0.00 O ATOM 864 OE2 GLU A 54 -9.197 20.168 7.727 1.00 0.00 O ATOM 0 H GLU A 54 -9.043 14.736 7.879 1.00 0.00 H new ATOM 0 HA GLU A 54 -8.399 17.623 8.060 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.200 16.740 6.408 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.156 16.388 7.834 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.772 18.560 6.902 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.089 18.751 8.504 1.00 0.00 H new ATOM 871 N LYS A 55 -8.811 17.672 10.489 1.00 0.00 N ATOM 872 CA LYS A 55 -9.028 17.744 11.920 1.00 0.00 C ATOM 873 C LYS A 55 -10.511 17.907 12.231 1.00 0.00 C ATOM 874 O LYS A 55 -11.062 19.001 12.104 1.00 0.00 O ATOM 875 CB LYS A 55 -8.236 18.906 12.522 1.00 0.00 C ATOM 876 CG LYS A 55 -6.731 18.705 12.479 1.00 0.00 C ATOM 877 CD LYS A 55 -5.992 20.033 12.431 1.00 0.00 C ATOM 878 CE LYS A 55 -4.748 20.011 13.304 1.00 0.00 C ATOM 879 NZ LYS A 55 -3.678 19.152 12.725 1.00 0.00 N ATOM 0 H LYS A 55 -8.174 18.380 10.125 1.00 0.00 H new ATOM 0 HA LYS A 55 -8.679 16.812 12.365 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -8.487 19.822 11.986 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -8.546 19.047 13.558 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -6.413 18.142 13.357 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -6.467 18.109 11.605 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -5.711 20.257 11.402 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -6.656 20.832 12.762 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -4.372 21.027 13.426 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -5.008 19.646 14.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -2.847 19.164 13.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -4.028 18.177 12.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -3.411 19.515 11.788 1.00 0.00 H new ATOM 983 N MET B 1 0.225 12.619 4.105 1.00 0.00 N ATOM 984 CA MET B 1 0.755 11.929 5.311 1.00 0.00 C ATOM 985 C MET B 1 -0.364 11.592 6.291 1.00 0.00 C ATOM 986 O MET B 1 -0.725 12.407 7.141 1.00 0.00 O ATOM 987 CB MET B 1 1.788 12.841 5.978 1.00 0.00 C ATOM 988 CG MET B 1 3.226 12.450 5.682 1.00 0.00 C ATOM 989 SD MET B 1 4.418 13.398 6.647 1.00 0.00 S ATOM 990 CE MET B 1 5.943 12.566 6.212 1.00 0.00 C ATOM 0 H1 MET B 1 0.879 12.478 3.309 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.706 12.226 3.861 1.00 0.00 H new ATOM 0 H3 MET B 1 0.131 13.636 4.300 1.00 0.00 H new ATOM 0 HA MET B 1 1.220 10.990 5.012 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.623 13.866 5.646 1.00 0.00 H new ATOM 0 HB3 MET B 1 1.631 12.826 7.057 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.359 11.388 5.889 1.00 0.00 H new ATOM 0 HG3 MET B 1 3.427 12.595 4.620 1.00 0.00 H new ATOM 0 HE1 MET B 1 6.776 13.039 6.732 1.00 0.00 H new ATOM 0 HE2 MET B 1 5.881 11.518 6.504 1.00 0.00 H new ATOM 0 HE3 MET B 1 6.101 12.635 5.136 1.00 0.00 H new ATOM 1002 N LEU B 2 -0.910 10.387 6.166 1.00 0.00 N ATOM 1003 CA LEU B 2 -1.989 9.941 7.041 1.00 0.00 C ATOM 1004 C LEU B 2 -1.554 8.738 7.872 1.00 0.00 C ATOM 1005 O LEU B 2 -1.389 7.639 7.345 1.00 0.00 O ATOM 1006 CB LEU B 2 -3.223 9.580 6.211 1.00 0.00 C ATOM 1007 CG LEU B 2 -4.564 9.769 6.922 1.00 0.00 C ATOM 1008 CD1 LEU B 2 -5.177 11.113 6.558 1.00 0.00 C ATOM 1009 CD2 LEU B 2 -5.518 8.635 6.573 1.00 0.00 C ATOM 0 H LEU B 2 -0.623 9.701 5.467 1.00 0.00 H new ATOM 0 HA LEU B 2 -2.237 10.757 7.719 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -3.222 10.186 5.305 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -3.139 8.539 5.898 1.00 0.00 H new ATOM 0 HG LEU B 2 -4.388 9.752 7.998 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -6.130 11.230 7.073 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -4.502 11.914 6.858 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -5.339 11.160 5.481 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -6.467 8.786 7.088 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -5.688 8.621 5.496 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -5.084 7.685 6.885 1.00 0.00 H new ATOM 1021 N ILE B 3 -1.377 8.946 9.174 1.00 0.00 N ATOM 1022 CA ILE B 3 -0.970 7.865 10.065 1.00 0.00 C ATOM 1023 C ILE B 3 -2.179 7.257 10.769 1.00 0.00 C ATOM 1024 O ILE B 3 -2.733 7.842 11.699 1.00 0.00 O ATOM 1025 CB ILE B 3 0.057 8.351 11.115 1.00 0.00 C ATOM 1026 CG1 ILE B 3 1.423 8.578 10.457 1.00 0.00 C ATOM 1027 CG2 ILE B 3 0.180 7.357 12.266 1.00 0.00 C ATOM 1028 CD1 ILE B 3 2.144 7.297 10.084 1.00 0.00 C ATOM 0 H ILE B 3 -1.508 9.848 9.633 1.00 0.00 H new ATOM 0 HA ILE B 3 -0.496 7.101 9.449 1.00 0.00 H new ATOM 0 HB ILE B 3 -0.299 9.297 11.524 1.00 0.00 H new ATOM 0 HG12 ILE B 3 1.288 9.182 9.560 1.00 0.00 H new ATOM 0 HG13 ILE B 3 2.052 9.153 11.137 1.00 0.00 H new ATOM 0 HG21 ILE B 3 0.909 7.725 12.988 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -0.788 7.243 12.753 1.00 0.00 H new ATOM 0 HG23 ILE B 3 0.508 6.392 11.880 1.00 0.00 H new ATOM 0 HD11 ILE B 3 3.102 7.539 9.624 1.00 0.00 H new ATOM 0 HD12 ILE B 3 2.313 6.700 10.980 1.00 0.00 H new ATOM 0 HD13 ILE B 3 1.536 6.729 9.379 1.00 0.00 H new ATOM 1040 N LEU B 4 -2.568 6.068 10.323 1.00 0.00 N ATOM 1041 CA LEU B 4 -3.694 5.355 10.910 1.00 0.00 C ATOM 1042 C LEU B 4 -3.258 3.969 11.366 1.00 0.00 C ATOM 1043 O LEU B 4 -2.956 3.108 10.541 1.00 0.00 O ATOM 1044 CB LEU B 4 -4.841 5.245 9.904 1.00 0.00 C ATOM 1045 CG LEU B 4 -6.233 5.478 10.490 1.00 0.00 C ATOM 1046 CD1 LEU B 4 -6.499 4.512 11.634 1.00 0.00 C ATOM 1047 CD2 LEU B 4 -6.378 6.917 10.961 1.00 0.00 C ATOM 0 H LEU B 4 -2.116 5.576 9.552 1.00 0.00 H new ATOM 0 HA LEU B 4 -4.046 5.915 11.776 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -4.674 5.966 9.104 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -4.814 4.254 9.451 1.00 0.00 H new ATOM 0 HG LEU B 4 -6.971 5.296 9.709 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -7.495 4.693 12.039 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -6.437 3.488 11.267 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -5.756 4.662 12.417 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -7.375 7.065 11.375 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -5.632 7.126 11.727 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -6.231 7.592 10.118 1.00 0.00 H new ATOM 1059 N THR B 5 -3.211 3.758 12.677 1.00 0.00 N ATOM 1060 CA THR B 5 -2.794 2.470 13.219 1.00 0.00 C ATOM 1061 C THR B 5 -3.746 1.358 12.808 1.00 0.00 C ATOM 1062 O THR B 5 -4.578 0.912 13.597 1.00 0.00 O ATOM 1063 CB THR B 5 -2.698 2.523 14.740 1.00 0.00 C ATOM 1064 OG1 THR B 5 -2.668 3.863 15.201 1.00 0.00 O ATOM 1065 CG2 THR B 5 -1.469 1.822 15.273 1.00 0.00 C ATOM 0 H THR B 5 -3.454 4.456 13.379 1.00 0.00 H new ATOM 0 HA THR B 5 -1.809 2.253 12.807 1.00 0.00 H new ATOM 0 HB THR B 5 -3.586 2.008 15.108 1.00 0.00 H new ATOM 0 HG1 THR B 5 -2.769 3.876 16.176 1.00 0.00 H new ATOM 0 HG21 THR B 5 -1.453 1.892 16.361 1.00 0.00 H new ATOM 0 HG22 THR B 5 -1.491 0.773 14.977 1.00 0.00 H new ATOM 0 HG23 THR B 5 -0.575 2.295 14.866 1.00 0.00 H new ATOM 1073 N ARG B 6 -3.619 0.913 11.569 1.00 0.00 N ATOM 1074 CA ARG B 6 -4.469 -0.147 11.062 1.00 0.00 C ATOM 1075 C ARG B 6 -3.976 -1.511 11.525 1.00 0.00 C ATOM 1076 O ARG B 6 -2.770 -1.755 11.634 1.00 0.00 O ATOM 1077 CB ARG B 6 -4.530 -0.099 9.534 1.00 0.00 C ATOM 1078 CG ARG B 6 -5.168 1.169 8.991 1.00 0.00 C ATOM 1079 CD ARG B 6 -4.474 1.646 7.726 1.00 0.00 C ATOM 1080 NE ARG B 6 -5.407 2.272 6.794 1.00 0.00 N ATOM 1081 CZ ARG B 6 -6.216 1.591 5.985 1.00 0.00 C ATOM 1082 NH1 ARG B 6 -6.208 0.264 5.991 1.00 0.00 N ATOM 1083 NH2 ARG B 6 -7.035 2.240 5.168 1.00 0.00 N ATOM 0 H ARG B 6 -2.937 1.269 10.899 1.00 0.00 H new ATOM 0 HA ARG B 6 -5.472 0.007 11.460 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -3.519 -0.187 9.135 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -5.091 -0.961 9.174 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -6.222 0.986 8.782 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -5.125 1.952 9.748 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -3.691 2.358 7.988 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -3.987 0.801 7.239 1.00 0.00 H new ATOM 0 HE ARG B 6 -5.441 3.291 6.761 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -5.580 -0.239 6.618 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -6.830 -0.253 5.369 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -7.045 3.260 5.160 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -7.655 1.719 4.548 1.00 0.00 H new ATOM 1097 N ARG B 7 -4.924 -2.392 11.802 1.00 0.00 N ATOM 1098 CA ARG B 7 -4.609 -3.742 12.253 1.00 0.00 C ATOM 1099 C ARG B 7 -5.852 -4.639 12.285 1.00 0.00 C ATOM 1100 O ARG B 7 -5.744 -5.845 12.503 1.00 0.00 O ATOM 1101 CB ARG B 7 -3.950 -3.698 13.631 1.00 0.00 C ATOM 1102 CG ARG B 7 -3.024 -4.876 13.897 1.00 0.00 C ATOM 1103 CD ARG B 7 -3.455 -5.663 15.124 1.00 0.00 C ATOM 1104 NE ARG B 7 -2.310 -6.130 15.904 1.00 0.00 N ATOM 1105 CZ ARG B 7 -2.361 -7.148 16.761 1.00 0.00 C ATOM 1106 NH1 ARG B 7 -3.497 -7.806 16.957 1.00 0.00 N ATOM 1107 NH2 ARG B 7 -1.272 -7.509 17.427 1.00 0.00 N ATOM 0 H ARG B 7 -5.922 -2.197 11.723 1.00 0.00 H new ATOM 0 HA ARG B 7 -3.912 -4.175 11.535 1.00 0.00 H new ATOM 0 HB2 ARG B 7 -3.383 -2.772 13.725 1.00 0.00 H new ATOM 0 HB3 ARG B 7 -4.726 -3.676 14.396 1.00 0.00 H new ATOM 0 HG2 ARG B 7 -3.013 -5.534 13.028 1.00 0.00 H new ATOM 0 HG3 ARG B 7 -2.005 -4.514 14.036 1.00 0.00 H new ATOM 0 HD2 ARG B 7 -4.090 -5.038 15.751 1.00 0.00 H new ATOM 0 HD3 ARG B 7 -4.056 -6.518 14.814 1.00 0.00 H new ATOM 0 HE ARG B 7 -1.419 -5.647 15.785 1.00 0.00 H new ATOM 0 HH11 ARG B 7 -4.339 -7.533 16.450 1.00 0.00 H new ATOM 0 HH12 ARG B 7 -3.528 -8.585 17.615 1.00 0.00 H new ATOM 0 HH21 ARG B 7 -0.396 -7.007 17.283 1.00 0.00 H new ATOM 0 HH22 ARG B 7 -1.311 -8.289 18.084 1.00 0.00 H new ATOM 1121 N VAL B 8 -7.028 -4.053 12.063 1.00 0.00 N ATOM 1122 CA VAL B 8 -8.272 -4.816 12.064 1.00 0.00 C ATOM 1123 C VAL B 8 -9.400 -4.063 11.352 1.00 0.00 C ATOM 1124 O VAL B 8 -10.567 -4.437 11.463 1.00 0.00 O ATOM 1125 CB VAL B 8 -8.727 -5.161 13.500 1.00 0.00 C ATOM 1126 CG1 VAL B 8 -8.272 -6.561 13.881 1.00 0.00 C ATOM 1127 CG2 VAL B 8 -8.205 -4.136 14.498 1.00 0.00 C ATOM 0 H VAL B 8 -7.144 -3.056 11.881 1.00 0.00 H new ATOM 0 HA VAL B 8 -8.064 -5.739 11.523 1.00 0.00 H new ATOM 0 HB VAL B 8 -9.816 -5.133 13.527 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -8.601 -6.787 14.895 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -8.704 -7.285 13.190 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -7.185 -6.616 13.832 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -8.539 -4.402 15.501 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -7.115 -4.123 14.470 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -8.586 -3.148 14.238 1.00 0.00 H new ATOM 1137 N GLY B 9 -9.052 -2.999 10.627 1.00 0.00 N ATOM 1138 CA GLY B 9 -10.056 -2.222 9.924 1.00 0.00 C ATOM 1139 C GLY B 9 -10.250 -2.670 8.487 1.00 0.00 C ATOM 1140 O GLY B 9 -10.264 -3.867 8.199 1.00 0.00 O ATOM 0 H GLY B 9 -8.095 -2.664 10.516 1.00 0.00 H new ATOM 0 HA2 GLY B 9 -11.005 -2.299 10.455 1.00 0.00 H new ATOM 0 HA3 GLY B 9 -9.769 -1.171 9.936 1.00 0.00 H new ATOM 1144 N GLU B 10 -10.406 -1.704 7.585 1.00 0.00 N ATOM 1145 CA GLU B 10 -10.608 -2.001 6.171 1.00 0.00 C ATOM 1146 C GLU B 10 -9.359 -1.671 5.354 1.00 0.00 C ATOM 1147 O GLU B 10 -8.273 -1.495 5.906 1.00 0.00 O ATOM 1148 CB GLU B 10 -11.811 -1.219 5.635 1.00 0.00 C ATOM 1149 CG GLU B 10 -12.731 -2.048 4.754 1.00 0.00 C ATOM 1150 CD GLU B 10 -13.781 -2.798 5.550 1.00 0.00 C ATOM 1151 OE1 GLU B 10 -14.793 -2.174 5.935 1.00 0.00 O ATOM 1152 OE2 GLU B 10 -13.593 -4.010 5.789 1.00 0.00 O ATOM 0 H GLU B 10 -10.396 -0.709 7.809 1.00 0.00 H new ATOM 0 HA GLU B 10 -10.803 -3.069 6.074 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -12.383 -0.827 6.476 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -11.452 -0.361 5.066 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -13.224 -1.395 4.034 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -12.136 -2.760 4.183 1.00 0.00 H new ATOM 1159 N THR B 11 -9.522 -1.595 4.035 1.00 0.00 N ATOM 1160 CA THR B 11 -8.410 -1.294 3.137 1.00 0.00 C ATOM 1161 C THR B 11 -8.558 0.094 2.524 1.00 0.00 C ATOM 1162 O THR B 11 -9.607 0.728 2.641 1.00 0.00 O ATOM 1163 CB THR B 11 -8.332 -2.343 2.026 1.00 0.00 C ATOM 1164 OG1 THR B 11 -9.310 -2.093 1.032 1.00 0.00 O ATOM 1165 CG2 THR B 11 -8.535 -3.760 2.520 1.00 0.00 C ATOM 0 H THR B 11 -10.415 -1.738 3.564 1.00 0.00 H new ATOM 0 HA THR B 11 -7.490 -1.315 3.722 1.00 0.00 H new ATOM 0 HB THR B 11 -7.323 -2.258 1.622 1.00 0.00 H new ATOM 0 HG1 THR B 11 -9.243 -2.773 0.329 1.00 0.00 H new ATOM 0 HG21 THR B 11 -8.467 -4.451 1.680 1.00 0.00 H new ATOM 0 HG22 THR B 11 -7.766 -4.003 3.253 1.00 0.00 H new ATOM 0 HG23 THR B 11 -9.518 -3.847 2.983 1.00 0.00 H new ATOM 1173 N LEU B 12 -7.500 0.557 1.867 1.00 0.00 N ATOM 1174 CA LEU B 12 -7.506 1.869 1.229 1.00 0.00 C ATOM 1175 C LEU B 12 -7.526 1.725 -0.290 1.00 0.00 C ATOM 1176 O LEU B 12 -7.073 0.715 -0.829 1.00 0.00 O ATOM 1177 CB LEU B 12 -6.285 2.686 1.671 1.00 0.00 C ATOM 1178 CG LEU B 12 -4.975 2.356 0.948 1.00 0.00 C ATOM 1179 CD1 LEU B 12 -4.025 3.543 0.990 1.00 0.00 C ATOM 1180 CD2 LEU B 12 -4.324 1.125 1.557 1.00 0.00 C ATOM 0 H LEU B 12 -6.626 0.042 1.762 1.00 0.00 H new ATOM 0 HA LEU B 12 -8.408 2.397 1.538 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -6.505 3.744 1.524 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -6.137 2.537 2.741 1.00 0.00 H new ATOM 0 HG LEU B 12 -5.205 2.141 -0.096 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -3.101 3.288 0.471 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -4.491 4.399 0.502 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -3.802 3.794 2.027 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -3.395 0.906 1.030 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -4.109 1.310 2.610 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -5.000 0.275 1.469 1.00 0.00 H new ATOM 1192 N MET B 13 -8.047 2.735 -0.979 1.00 0.00 N ATOM 1193 CA MET B 13 -8.111 2.699 -2.433 1.00 0.00 C ATOM 1194 C MET B 13 -7.543 3.975 -3.040 1.00 0.00 C ATOM 1195 O MET B 13 -8.214 5.005 -3.096 1.00 0.00 O ATOM 1196 CB MET B 13 -9.553 2.496 -2.898 1.00 0.00 C ATOM 1197 CG MET B 13 -9.690 2.340 -4.405 1.00 0.00 C ATOM 1198 SD MET B 13 -11.078 3.273 -5.079 1.00 0.00 S ATOM 1199 CE MET B 13 -10.232 4.704 -5.744 1.00 0.00 C ATOM 0 H MET B 13 -8.428 3.582 -0.557 1.00 0.00 H new ATOM 0 HA MET B 13 -7.505 1.859 -2.774 1.00 0.00 H new ATOM 0 HB2 MET B 13 -9.962 1.611 -2.411 1.00 0.00 H new ATOM 0 HB3 MET B 13 -10.154 3.345 -2.573 1.00 0.00 H new ATOM 0 HG2 MET B 13 -8.769 2.670 -4.885 1.00 0.00 H new ATOM 0 HG3 MET B 13 -9.816 1.285 -4.647 1.00 0.00 H new ATOM 0 HE1 MET B 13 -10.893 5.230 -6.433 1.00 0.00 H new ATOM 0 HE2 MET B 13 -9.951 5.372 -4.929 1.00 0.00 H new ATOM 0 HE3 MET B 13 -9.336 4.383 -6.275 1.00 0.00 H new ATOM 1209 N ILE B 14 -6.301 3.889 -3.499 1.00 0.00 N ATOM 1210 CA ILE B 14 -5.628 5.020 -4.110 1.00 0.00 C ATOM 1211 C ILE B 14 -5.356 4.746 -5.589 1.00 0.00 C ATOM 1212 O ILE B 14 -4.734 3.744 -5.939 1.00 0.00 O ATOM 1213 CB ILE B 14 -4.301 5.331 -3.384 1.00 0.00 C ATOM 1214 CG1 ILE B 14 -3.529 6.444 -4.101 1.00 0.00 C ATOM 1215 CG2 ILE B 14 -3.451 4.074 -3.274 1.00 0.00 C ATOM 1216 CD1 ILE B 14 -4.357 7.682 -4.370 1.00 0.00 C ATOM 0 H ILE B 14 -5.739 3.039 -3.457 1.00 0.00 H new ATOM 0 HA ILE B 14 -6.284 5.886 -4.023 1.00 0.00 H new ATOM 0 HB ILE B 14 -4.537 5.681 -2.379 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -2.664 6.720 -3.499 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -3.149 6.059 -5.047 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -2.519 4.309 -2.760 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -3.995 3.315 -2.711 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -3.230 3.696 -4.272 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -3.744 8.426 -4.879 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -5.208 7.421 -4.999 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -4.715 8.092 -3.426 1.00 0.00 H new ATOM 1228 N GLY B 15 -5.828 5.639 -6.452 1.00 0.00 N ATOM 1229 CA GLY B 15 -5.630 5.469 -7.881 1.00 0.00 C ATOM 1230 C GLY B 15 -6.913 5.674 -8.664 1.00 0.00 C ATOM 1231 O GLY B 15 -7.370 6.805 -8.832 1.00 0.00 O ATOM 0 H GLY B 15 -6.344 6.478 -6.188 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -4.877 6.176 -8.229 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -5.243 4.469 -8.076 1.00 0.00 H new ATOM 1235 N ASP B 16 -7.499 4.580 -9.141 1.00 0.00 N ATOM 1236 CA ASP B 16 -8.742 4.654 -9.906 1.00 0.00 C ATOM 1237 C ASP B 16 -9.472 3.309 -9.943 1.00 0.00 C ATOM 1238 O ASP B 16 -10.414 3.138 -10.715 1.00 0.00 O ATOM 1239 CB ASP B 16 -8.455 5.125 -11.333 1.00 0.00 C ATOM 1240 CG ASP B 16 -9.623 5.877 -11.939 1.00 0.00 C ATOM 1241 OD1 ASP B 16 -10.520 5.220 -12.510 1.00 0.00 O ATOM 1242 OD2 ASP B 16 -9.642 7.122 -11.843 1.00 0.00 O ATOM 0 H ASP B 16 -7.136 3.635 -9.013 1.00 0.00 H new ATOM 0 HA ASP B 16 -9.391 5.372 -9.405 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -7.575 5.768 -11.330 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -8.219 4.263 -11.957 1.00 0.00 H new ATOM 1247 N GLU B 17 -9.036 2.364 -9.101 1.00 0.00 N ATOM 1248 CA GLU B 17 -9.638 1.028 -9.023 1.00 0.00 C ATOM 1249 C GLU B 17 -8.647 0.051 -8.396 1.00 0.00 C ATOM 1250 O GLU B 17 -8.220 -0.913 -9.032 1.00 0.00 O ATOM 1251 CB GLU B 17 -10.061 0.519 -10.411 1.00 0.00 C ATOM 1252 CG GLU B 17 -10.561 -0.919 -10.413 1.00 0.00 C ATOM 1253 CD GLU B 17 -12.028 -1.027 -10.782 1.00 0.00 C ATOM 1254 OE1 GLU B 17 -12.881 -0.711 -9.926 1.00 0.00 O ATOM 1255 OE2 GLU B 17 -12.324 -1.427 -11.928 1.00 0.00 O ATOM 0 H GLU B 17 -8.258 2.504 -8.456 1.00 0.00 H new ATOM 0 HA GLU B 17 -10.531 1.097 -8.402 1.00 0.00 H new ATOM 0 HB2 GLU B 17 -10.846 1.167 -10.802 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -9.213 0.600 -11.091 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -9.969 -1.504 -11.117 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -10.406 -1.355 -9.426 1.00 0.00 H new ATOM 1262 N VAL B 18 -8.269 0.316 -7.150 1.00 0.00 N ATOM 1263 CA VAL B 18 -7.318 -0.520 -6.448 1.00 0.00 C ATOM 1264 C VAL B 18 -7.936 -1.150 -5.194 1.00 0.00 C ATOM 1265 O VAL B 18 -9.156 -1.275 -5.085 1.00 0.00 O ATOM 1266 CB VAL B 18 -6.079 0.306 -6.059 1.00 0.00 C ATOM 1267 CG1 VAL B 18 -5.532 1.052 -7.267 1.00 0.00 C ATOM 1268 CG2 VAL B 18 -6.402 1.272 -4.924 1.00 0.00 C ATOM 0 H VAL B 18 -8.612 1.109 -6.608 1.00 0.00 H new ATOM 0 HA VAL B 18 -7.026 -1.327 -7.120 1.00 0.00 H new ATOM 0 HB VAL B 18 -5.310 -0.381 -5.705 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -4.656 1.630 -6.972 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -5.251 0.337 -8.040 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -6.296 1.725 -7.656 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -5.510 1.844 -4.668 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -7.192 1.954 -5.240 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -6.736 0.710 -4.052 1.00 0.00 H new ATOM 1278 N THR B 19 -7.077 -1.541 -4.252 1.00 0.00 N ATOM 1279 CA THR B 19 -7.504 -2.155 -2.999 1.00 0.00 C ATOM 1280 C THR B 19 -6.295 -2.761 -2.294 1.00 0.00 C ATOM 1281 O THR B 19 -5.816 -3.826 -2.674 1.00 0.00 O ATOM 1282 CB THR B 19 -8.570 -3.231 -3.246 1.00 0.00 C ATOM 1283 OG1 THR B 19 -8.614 -4.152 -2.170 1.00 0.00 O ATOM 1284 CG2 THR B 19 -8.349 -4.023 -4.518 1.00 0.00 C ATOM 0 H THR B 19 -6.066 -1.440 -4.338 1.00 0.00 H new ATOM 0 HA THR B 19 -7.947 -1.386 -2.367 1.00 0.00 H new ATOM 0 HB THR B 19 -9.508 -2.684 -3.339 1.00 0.00 H new ATOM 0 HG1 THR B 19 -9.301 -4.829 -2.346 1.00 0.00 H new ATOM 0 HG21 THR B 19 -9.140 -4.765 -4.627 1.00 0.00 H new ATOM 0 HG22 THR B 19 -8.364 -3.348 -5.374 1.00 0.00 H new ATOM 0 HG23 THR B 19 -7.384 -4.527 -4.470 1.00 0.00 H new ATOM 1292 N VAL B 20 -5.790 -2.070 -1.277 1.00 0.00 N ATOM 1293 CA VAL B 20 -4.621 -2.546 -0.546 1.00 0.00 C ATOM 1294 C VAL B 20 -4.933 -2.798 0.928 1.00 0.00 C ATOM 1295 O VAL B 20 -5.214 -1.867 1.684 1.00 0.00 O ATOM 1296 CB VAL B 20 -3.455 -1.542 -0.643 1.00 0.00 C ATOM 1297 CG1 VAL B 20 -2.194 -2.120 -0.018 1.00 0.00 C ATOM 1298 CG2 VAL B 20 -3.208 -1.149 -2.091 1.00 0.00 C ATOM 0 H VAL B 20 -6.169 -1.184 -0.942 1.00 0.00 H new ATOM 0 HA VAL B 20 -4.332 -3.488 -1.011 1.00 0.00 H new ATOM 0 HB VAL B 20 -3.728 -0.645 -0.087 1.00 0.00 H new ATOM 0 HG11 VAL B 20 -1.384 -1.395 -0.097 1.00 0.00 H new ATOM 0 HG12 VAL B 20 -2.379 -2.345 1.033 1.00 0.00 H new ATOM 0 HG13 VAL B 20 -1.915 -3.035 -0.541 1.00 0.00 H new ATOM 0 HG21 VAL B 20 -2.382 -0.440 -2.140 1.00 0.00 H new ATOM 0 HG22 VAL B 20 -2.959 -2.037 -2.672 1.00 0.00 H new ATOM 0 HG23 VAL B 20 -4.106 -0.688 -2.501 1.00 0.00 H new ATOM 1308 N THR B 21 -4.870 -4.065 1.327 1.00 0.00 N ATOM 1309 CA THR B 21 -5.131 -4.452 2.709 1.00 0.00 C ATOM 1310 C THR B 21 -3.822 -4.571 3.488 1.00 0.00 C ATOM 1311 O THR B 21 -3.001 -5.446 3.210 1.00 0.00 O ATOM 1312 CB THR B 21 -5.885 -5.782 2.753 1.00 0.00 C ATOM 1313 OG1 THR B 21 -6.892 -5.821 1.757 1.00 0.00 O ATOM 1314 CG2 THR B 21 -6.546 -6.053 4.087 1.00 0.00 C ATOM 0 H THR B 21 -4.639 -4.844 0.710 1.00 0.00 H new ATOM 0 HA THR B 21 -5.745 -3.680 3.172 1.00 0.00 H new ATOM 0 HB THR B 21 -5.129 -6.548 2.580 1.00 0.00 H new ATOM 0 HG1 THR B 21 -7.362 -6.680 1.800 1.00 0.00 H new ATOM 0 HG21 THR B 21 -7.063 -7.012 4.049 1.00 0.00 H new ATOM 0 HG22 THR B 21 -5.788 -6.080 4.870 1.00 0.00 H new ATOM 0 HG23 THR B 21 -7.264 -5.262 4.305 1.00 0.00 H new ATOM 1322 N VAL B 22 -3.629 -3.680 4.455 1.00 0.00 N ATOM 1323 CA VAL B 22 -2.413 -3.678 5.265 1.00 0.00 C ATOM 1324 C VAL B 22 -2.429 -4.784 6.318 1.00 0.00 C ATOM 1325 O VAL B 22 -1.383 -5.163 6.843 1.00 0.00 O ATOM 1326 CB VAL B 22 -2.214 -2.323 5.970 1.00 0.00 C ATOM 1327 CG1 VAL B 22 -1.963 -1.221 4.952 1.00 0.00 C ATOM 1328 CG2 VAL B 22 -3.418 -1.993 6.839 1.00 0.00 C ATOM 0 H VAL B 22 -4.298 -2.950 4.698 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.586 -3.857 4.578 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.338 -2.395 6.614 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -1.825 -0.272 5.470 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -1.067 -1.454 4.377 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -2.817 -1.146 4.279 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.260 -1.032 7.330 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -4.312 -1.941 6.217 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -3.546 -2.769 7.594 1.00 0.00 H new ATOM 1338 N LEU B 23 -3.617 -5.301 6.620 1.00 0.00 N ATOM 1339 CA LEU B 23 -3.761 -6.366 7.610 1.00 0.00 C ATOM 1340 C LEU B 23 -3.319 -5.891 8.995 1.00 0.00 C ATOM 1341 O LEU B 23 -4.152 -5.599 9.853 1.00 0.00 O ATOM 1342 CB LEU B 23 -2.955 -7.599 7.186 1.00 0.00 C ATOM 1343 CG LEU B 23 -3.616 -8.945 7.489 1.00 0.00 C ATOM 1344 CD1 LEU B 23 -3.629 -9.206 8.988 1.00 0.00 C ATOM 1345 CD2 LEU B 23 -5.030 -8.985 6.926 1.00 0.00 C ATOM 0 H LEU B 23 -4.494 -5.000 6.194 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.815 -6.637 7.666 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -2.765 -7.538 6.114 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -1.986 -7.568 7.683 1.00 0.00 H new ATOM 0 HG LEU B 23 -3.034 -9.731 7.008 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -4.103 -10.168 9.186 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -2.606 -9.221 9.364 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -4.188 -8.416 9.490 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -5.484 -9.950 7.151 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -5.624 -8.190 7.377 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -4.996 -8.844 5.846 1.00 0.00 H new ATOM 1357 N GLY B 24 -2.007 -5.806 9.207 1.00 0.00 N ATOM 1358 CA GLY B 24 -1.487 -5.357 10.488 1.00 0.00 C ATOM 1359 C GLY B 24 -1.207 -6.496 11.451 1.00 0.00 C ATOM 1360 O GLY B 24 -0.199 -6.483 12.158 1.00 0.00 O ATOM 0 H GLY B 24 -1.295 -6.040 8.515 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -0.568 -4.795 10.323 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -2.202 -4.672 10.943 1.00 0.00 H new ATOM 1364 N VAL B 25 -2.101 -7.480 11.487 1.00 0.00 N ATOM 1365 CA VAL B 25 -1.943 -8.623 12.378 1.00 0.00 C ATOM 1366 C VAL B 25 -1.073 -9.697 11.737 1.00 0.00 C ATOM 1367 O VAL B 25 -1.202 -9.976 10.544 1.00 0.00 O ATOM 1368 CB VAL B 25 -3.303 -9.249 12.759 1.00 0.00 C ATOM 1369 CG1 VAL B 25 -3.233 -9.874 14.143 1.00 0.00 C ATOM 1370 CG2 VAL B 25 -4.420 -8.217 12.692 1.00 0.00 C ATOM 0 H VAL B 25 -2.941 -7.508 10.910 1.00 0.00 H new ATOM 0 HA VAL B 25 -1.462 -8.248 13.282 1.00 0.00 H new ATOM 0 HB VAL B 25 -3.528 -10.033 12.036 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -4.200 -10.310 14.395 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -2.470 -10.653 14.152 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -2.979 -9.108 14.876 1.00 0.00 H new ATOM 0 HG21 VAL B 25 -5.365 -8.686 12.965 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -4.205 -7.403 13.384 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -4.490 -7.822 11.678 1.00 0.00 H new ATOM 1380 N LYS B 26 -0.189 -10.304 12.532 1.00 0.00 N ATOM 1381 CA LYS B 26 0.701 -11.355 12.041 1.00 0.00 C ATOM 1382 C LYS B 26 1.845 -11.598 13.024 1.00 0.00 C ATOM 1383 O LYS B 26 2.084 -10.797 13.928 1.00 0.00 O ATOM 1384 CB LYS B 26 1.263 -11.006 10.660 1.00 0.00 C ATOM 1385 CG LYS B 26 0.647 -11.823 9.537 1.00 0.00 C ATOM 1386 CD LYS B 26 1.571 -12.948 9.097 1.00 0.00 C ATOM 1387 CE LYS B 26 0.788 -14.179 8.673 1.00 0.00 C ATOM 1388 NZ LYS B 26 0.416 -15.028 9.837 1.00 0.00 N ATOM 0 H LYS B 26 -0.071 -10.084 13.521 1.00 0.00 H new ATOM 0 HA LYS B 26 0.113 -12.268 11.951 1.00 0.00 H new ATOM 0 HB2 LYS B 26 1.095 -9.947 10.464 1.00 0.00 H new ATOM 0 HB3 LYS B 26 2.342 -11.162 10.664 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -0.304 -12.240 9.868 1.00 0.00 H new ATOM 0 HG3 LYS B 26 0.432 -11.174 8.688 1.00 0.00 H new ATOM 0 HD2 LYS B 26 2.192 -12.607 8.268 1.00 0.00 H new ATOM 0 HD3 LYS B 26 2.244 -13.208 9.914 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -0.115 -13.871 8.145 1.00 0.00 H new ATOM 0 HE3 LYS B 26 1.383 -14.764 7.972 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -0.117 -15.857 9.506 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 1.278 -15.343 10.326 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -0.173 -14.478 10.494 1.00 0.00 H new ATOM 1402 N GLY B 27 2.543 -12.714 12.842 1.00 0.00 N ATOM 1403 CA GLY B 27 3.650 -13.057 13.719 1.00 0.00 C ATOM 1404 C GLY B 27 4.910 -12.259 13.427 1.00 0.00 C ATOM 1405 O GLY B 27 5.599 -12.517 12.441 1.00 0.00 O ATOM 0 H GLY B 27 2.362 -13.390 12.100 1.00 0.00 H new ATOM 0 HA2 GLY B 27 3.352 -12.889 14.754 1.00 0.00 H new ATOM 0 HA3 GLY B 27 3.869 -14.120 13.619 1.00 0.00 H new ATOM 1409 N ASN B 28 5.214 -11.293 14.296 1.00 0.00 N ATOM 1410 CA ASN B 28 6.404 -10.455 14.140 1.00 0.00 C ATOM 1411 C ASN B 28 6.317 -9.604 12.875 1.00 0.00 C ATOM 1412 O ASN B 28 6.107 -8.393 12.941 1.00 0.00 O ATOM 1413 CB ASN B 28 7.664 -11.321 14.101 1.00 0.00 C ATOM 1414 CG ASN B 28 8.304 -11.472 15.467 1.00 0.00 C ATOM 1415 OD1 ASN B 28 8.027 -12.426 16.194 1.00 0.00 O ATOM 1416 ND2 ASN B 28 9.167 -10.527 15.824 1.00 0.00 N ATOM 0 H ASN B 28 4.651 -11.071 15.117 1.00 0.00 H new ATOM 0 HA ASN B 28 6.457 -9.786 14.999 1.00 0.00 H new ATOM 0 HB2 ASN B 28 7.412 -12.307 13.710 1.00 0.00 H new ATOM 0 HB3 ASN B 28 8.384 -10.879 13.412 1.00 0.00 H new ATOM 0 HD21 ASN B 28 9.629 -10.575 16.732 1.00 0.00 H new ATOM 0 HD22 ASN B 28 9.367 -9.753 15.190 1.00 0.00 H new ATOM 1423 N GLN B 29 6.472 -10.252 11.728 1.00 0.00 N ATOM 1424 CA GLN B 29 6.403 -9.570 10.442 1.00 0.00 C ATOM 1425 C GLN B 29 4.949 -9.453 10.002 1.00 0.00 C ATOM 1426 O GLN B 29 4.177 -10.396 10.154 1.00 0.00 O ATOM 1427 CB GLN B 29 7.224 -10.326 9.397 1.00 0.00 C ATOM 1428 CG GLN B 29 7.880 -9.422 8.367 1.00 0.00 C ATOM 1429 CD GLN B 29 9.300 -9.045 8.740 1.00 0.00 C ATOM 1430 OE1 GLN B 29 10.189 -9.009 7.890 1.00 0.00 O ATOM 1431 NE2 GLN B 29 9.522 -8.762 10.019 1.00 0.00 N ATOM 0 H GLN B 29 6.647 -11.255 11.662 1.00 0.00 H new ATOM 0 HA GLN B 29 6.821 -8.569 10.544 1.00 0.00 H new ATOM 0 HB2 GLN B 29 7.996 -10.905 9.904 1.00 0.00 H new ATOM 0 HB3 GLN B 29 6.577 -11.037 8.884 1.00 0.00 H new ATOM 0 HG2 GLN B 29 7.884 -9.924 7.399 1.00 0.00 H new ATOM 0 HG3 GLN B 29 7.285 -8.515 8.254 1.00 0.00 H new ATOM 0 HE21 GLN B 29 8.756 -8.804 10.691 1.00 0.00 H new ATOM 0 HE22 GLN B 29 10.459 -8.503 10.329 1.00 0.00 H new ATOM 1440 N VAL B 30 4.566 -8.288 9.485 1.00 0.00 N ATOM 1441 CA VAL B 30 3.185 -8.072 9.070 1.00 0.00 C ATOM 1442 C VAL B 30 2.982 -8.386 7.595 1.00 0.00 C ATOM 1443 O VAL B 30 3.598 -7.768 6.728 1.00 0.00 O ATOM 1444 CB VAL B 30 2.739 -6.621 9.337 1.00 0.00 C ATOM 1445 CG1 VAL B 30 1.252 -6.459 9.064 1.00 0.00 C ATOM 1446 CG2 VAL B 30 3.073 -6.212 10.765 1.00 0.00 C ATOM 0 H VAL B 30 5.185 -7.489 9.345 1.00 0.00 H new ATOM 0 HA VAL B 30 2.576 -8.754 9.664 1.00 0.00 H new ATOM 0 HB VAL B 30 3.283 -5.964 8.658 1.00 0.00 H new ATOM 0 HG11 VAL B 30 0.957 -5.428 9.258 1.00 0.00 H new ATOM 0 HG12 VAL B 30 1.044 -6.706 8.023 1.00 0.00 H new ATOM 0 HG13 VAL B 30 0.688 -7.127 9.715 1.00 0.00 H new ATOM 0 HG21 VAL B 30 2.750 -5.185 10.934 1.00 0.00 H new ATOM 0 HG22 VAL B 30 2.559 -6.873 11.463 1.00 0.00 H new ATOM 0 HG23 VAL B 30 4.149 -6.285 10.922 1.00 0.00 H new ATOM 1456 N ARG B 31 2.102 -9.347 7.319 1.00 0.00 N ATOM 1457 CA ARG B 31 1.808 -9.735 5.956 1.00 0.00 C ATOM 1458 C ARG B 31 0.917 -8.693 5.298 1.00 0.00 C ATOM 1459 O ARG B 31 -0.298 -8.677 5.500 1.00 0.00 O ATOM 1460 CB ARG B 31 1.129 -11.107 5.925 1.00 0.00 C ATOM 1461 CG ARG B 31 1.743 -12.067 4.918 1.00 0.00 C ATOM 1462 CD ARG B 31 2.695 -13.046 5.589 1.00 0.00 C ATOM 1463 NE ARG B 31 3.699 -13.558 4.659 1.00 0.00 N ATOM 1464 CZ ARG B 31 3.491 -14.578 3.828 1.00 0.00 C ATOM 1465 NH1 ARG B 31 2.316 -15.195 3.801 1.00 0.00 N ATOM 1466 NH2 ARG B 31 4.462 -14.981 3.019 1.00 0.00 N ATOM 0 H ARG B 31 1.584 -9.867 8.027 1.00 0.00 H new ATOM 0 HA ARG B 31 2.744 -9.800 5.402 1.00 0.00 H new ATOM 0 HB2 ARG B 31 1.183 -11.552 6.918 1.00 0.00 H new ATOM 0 HB3 ARG B 31 0.073 -10.975 5.691 1.00 0.00 H new ATOM 0 HG2 ARG B 31 0.952 -12.618 4.410 1.00 0.00 H new ATOM 0 HG3 ARG B 31 2.279 -11.502 4.155 1.00 0.00 H new ATOM 0 HD2 ARG B 31 3.192 -12.553 6.424 1.00 0.00 H new ATOM 0 HD3 ARG B 31 2.126 -13.879 6.003 1.00 0.00 H new ATOM 0 HE ARG B 31 4.614 -13.107 4.645 1.00 0.00 H new ATOM 0 HH11 ARG B 31 1.565 -14.889 4.419 1.00 0.00 H new ATOM 0 HH12 ARG B 31 2.164 -15.975 3.162 1.00 0.00 H new ATOM 0 HH21 ARG B 31 5.367 -14.510 3.034 1.00 0.00 H new ATOM 0 HH22 ARG B 31 4.304 -15.762 2.382 1.00 0.00 H new ATOM 1480 N ILE B 32 1.534 -7.812 4.526 1.00 0.00 N ATOM 1481 CA ILE B 32 0.810 -6.746 3.852 1.00 0.00 C ATOM 1482 C ILE B 32 0.382 -7.166 2.452 1.00 0.00 C ATOM 1483 O ILE B 32 1.210 -7.549 1.625 1.00 0.00 O ATOM 1484 CB ILE B 32 1.664 -5.467 3.772 1.00 0.00 C ATOM 1485 CG1 ILE B 32 2.361 -5.218 5.115 1.00 0.00 C ATOM 1486 CG2 ILE B 32 0.803 -4.273 3.377 1.00 0.00 C ATOM 1487 CD1 ILE B 32 1.406 -4.871 6.237 1.00 0.00 C ATOM 0 H ILE B 32 2.539 -7.815 4.350 1.00 0.00 H new ATOM 0 HA ILE B 32 -0.084 -6.539 4.440 1.00 0.00 H new ATOM 0 HB ILE B 32 2.427 -5.599 3.005 1.00 0.00 H new ATOM 0 HG12 ILE B 32 2.926 -6.108 5.392 1.00 0.00 H new ATOM 0 HG13 ILE B 32 3.080 -4.407 4.997 1.00 0.00 H new ATOM 0 HG21 ILE B 32 1.423 -3.378 3.325 1.00 0.00 H new ATOM 0 HG22 ILE B 32 0.350 -4.457 2.403 1.00 0.00 H new ATOM 0 HG23 ILE B 32 0.019 -4.128 4.120 1.00 0.00 H new ATOM 0 HD11 ILE B 32 1.969 -4.708 7.156 1.00 0.00 H new ATOM 0 HD12 ILE B 32 0.858 -3.964 5.981 1.00 0.00 H new ATOM 0 HD13 ILE B 32 0.702 -5.691 6.382 1.00 0.00 H new ATOM 1499 N GLY B 33 -0.920 -7.090 2.194 1.00 0.00 N ATOM 1500 CA GLY B 33 -1.443 -7.462 0.895 1.00 0.00 C ATOM 1501 C GLY B 33 -1.797 -6.258 0.052 1.00 0.00 C ATOM 1502 O GLY B 33 -2.643 -5.453 0.435 1.00 0.00 O ATOM 0 H GLY B 33 -1.622 -6.777 2.864 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -0.705 -8.067 0.368 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -2.329 -8.083 1.027 1.00 0.00 H new ATOM 1506 N VAL B 34 -1.146 -6.128 -1.096 1.00 0.00 N ATOM 1507 CA VAL B 34 -1.399 -5.008 -1.987 1.00 0.00 C ATOM 1508 C VAL B 34 -2.119 -5.459 -3.252 1.00 0.00 C ATOM 1509 O VAL B 34 -1.511 -6.038 -4.153 1.00 0.00 O ATOM 1510 CB VAL B 34 -0.090 -4.298 -2.381 1.00 0.00 C ATOM 1511 CG1 VAL B 34 -0.384 -3.024 -3.157 1.00 0.00 C ATOM 1512 CG2 VAL B 34 0.747 -3.999 -1.146 1.00 0.00 C ATOM 0 H VAL B 34 -0.440 -6.784 -1.430 1.00 0.00 H new ATOM 0 HA VAL B 34 -2.034 -4.310 -1.442 1.00 0.00 H new ATOM 0 HB VAL B 34 0.482 -4.964 -3.027 1.00 0.00 H new ATOM 0 HG11 VAL B 34 0.553 -2.537 -3.426 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -0.938 -3.269 -4.063 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -0.978 -2.351 -2.539 1.00 0.00 H new ATOM 0 HG21 VAL B 34 1.668 -3.497 -1.443 1.00 0.00 H new ATOM 0 HG22 VAL B 34 0.184 -3.354 -0.472 1.00 0.00 H new ATOM 0 HG23 VAL B 34 0.990 -4.932 -0.637 1.00 0.00 H new ATOM 1522 N ASN B 35 -3.417 -5.184 -3.312 1.00 0.00 N ATOM 1523 CA ASN B 35 -4.219 -5.554 -4.470 1.00 0.00 C ATOM 1524 C ASN B 35 -4.432 -4.344 -5.373 1.00 0.00 C ATOM 1525 O ASN B 35 -5.180 -3.425 -5.040 1.00 0.00 O ATOM 1526 CB ASN B 35 -5.565 -6.134 -4.033 1.00 0.00 C ATOM 1527 CG ASN B 35 -5.957 -7.356 -4.840 1.00 0.00 C ATOM 1528 OD1 ASN B 35 -5.339 -7.667 -5.858 1.00 0.00 O ATOM 1529 ND2 ASN B 35 -6.991 -8.057 -4.389 1.00 0.00 N ATOM 0 H ASN B 35 -3.935 -4.707 -2.574 1.00 0.00 H new ATOM 0 HA ASN B 35 -3.682 -6.320 -5.030 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -5.518 -6.399 -2.977 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -6.337 -5.371 -4.136 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -7.301 -8.889 -4.891 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -7.475 -7.763 -3.540 1.00 0.00 H new ATOM 1536 N ALA B 36 -3.756 -4.354 -6.513 1.00 0.00 N ATOM 1537 CA ALA B 36 -3.855 -3.258 -7.470 1.00 0.00 C ATOM 1538 C ALA B 36 -3.820 -3.762 -8.910 1.00 0.00 C ATOM 1539 O ALA B 36 -3.165 -4.759 -9.214 1.00 0.00 O ATOM 1540 CB ALA B 36 -2.735 -2.255 -7.236 1.00 0.00 C ATOM 0 H ALA B 36 -3.132 -5.109 -6.799 1.00 0.00 H new ATOM 0 HA ALA B 36 -4.816 -2.767 -7.315 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -2.819 -1.441 -7.956 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -2.811 -1.854 -6.225 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -1.772 -2.750 -7.359 1.00 0.00 H new ATOM 1546 N PRO B 37 -4.525 -3.067 -9.819 1.00 0.00 N ATOM 1547 CA PRO B 37 -4.574 -3.434 -11.235 1.00 0.00 C ATOM 1548 C PRO B 37 -3.311 -3.018 -11.981 1.00 0.00 C ATOM 1549 O PRO B 37 -2.602 -2.105 -11.557 1.00 0.00 O ATOM 1550 CB PRO B 37 -5.781 -2.655 -11.752 1.00 0.00 C ATOM 1551 CG PRO B 37 -5.837 -1.440 -10.892 1.00 0.00 C ATOM 1552 CD PRO B 37 -5.329 -1.860 -9.537 1.00 0.00 C ATOM 0 HA PRO B 37 -4.648 -4.512 -11.380 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -5.663 -2.392 -12.803 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -6.696 -3.241 -11.671 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -5.223 -0.641 -11.307 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -6.855 -1.058 -10.824 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -4.727 -1.077 -9.076 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -6.149 -2.077 -8.852 1.00 0.00 H new ATOM 1560 N LYS B 38 -3.031 -3.693 -13.091 1.00 0.00 N ATOM 1561 CA LYS B 38 -1.849 -3.391 -13.891 1.00 0.00 C ATOM 1562 C LYS B 38 -2.159 -2.348 -14.965 1.00 0.00 C ATOM 1563 O LYS B 38 -1.549 -2.348 -16.034 1.00 0.00 O ATOM 1564 CB LYS B 38 -1.310 -4.668 -14.542 1.00 0.00 C ATOM 1565 CG LYS B 38 0.159 -4.926 -14.249 1.00 0.00 C ATOM 1566 CD LYS B 38 0.864 -5.546 -15.445 1.00 0.00 C ATOM 1567 CE LYS B 38 0.688 -7.055 -15.474 1.00 0.00 C ATOM 1568 NZ LYS B 38 1.555 -7.735 -14.472 1.00 0.00 N ATOM 0 H LYS B 38 -3.606 -4.452 -13.457 1.00 0.00 H new ATOM 0 HA LYS B 38 -1.090 -2.979 -13.226 1.00 0.00 H new ATOM 0 HB2 LYS B 38 -1.896 -5.519 -14.194 1.00 0.00 H new ATOM 0 HB3 LYS B 38 -1.451 -4.603 -15.621 1.00 0.00 H new ATOM 0 HG2 LYS B 38 0.648 -3.989 -13.982 1.00 0.00 H new ATOM 0 HG3 LYS B 38 0.249 -5.589 -13.388 1.00 0.00 H new ATOM 0 HD2 LYS B 38 0.469 -5.115 -16.365 1.00 0.00 H new ATOM 0 HD3 LYS B 38 1.926 -5.303 -15.409 1.00 0.00 H new ATOM 0 HE2 LYS B 38 -0.355 -7.303 -15.279 1.00 0.00 H new ATOM 0 HE3 LYS B 38 0.923 -7.429 -16.471 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 1.548 -8.760 -14.646 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 2.528 -7.376 -14.554 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 1.195 -7.544 -13.515 1.00 0.00 H new ATOM 1582 N GLU B 39 -3.108 -1.460 -14.677 1.00 0.00 N ATOM 1583 CA GLU B 39 -3.489 -0.417 -15.621 1.00 0.00 C ATOM 1584 C GLU B 39 -2.953 0.941 -15.177 1.00 0.00 C ATOM 1585 O GLU B 39 -2.527 1.751 -16.001 1.00 0.00 O ATOM 1586 CB GLU B 39 -5.012 -0.357 -15.761 1.00 0.00 C ATOM 1587 CG GLU B 39 -5.482 -0.065 -17.176 1.00 0.00 C ATOM 1588 CD GLU B 39 -5.128 -1.174 -18.148 1.00 0.00 C ATOM 1589 OE1 GLU B 39 -5.083 -2.347 -17.720 1.00 0.00 O ATOM 1590 OE2 GLU B 39 -4.895 -0.870 -19.337 1.00 0.00 O ATOM 0 H GLU B 39 -3.625 -1.443 -13.798 1.00 0.00 H new ATOM 0 HA GLU B 39 -3.052 -0.661 -16.589 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -5.436 -1.307 -15.435 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -5.400 0.412 -15.092 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -6.562 0.080 -17.174 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -5.036 0.869 -17.518 1.00 0.00 H new ATOM 1597 N VAL B 40 -2.974 1.184 -13.869 1.00 0.00 N ATOM 1598 CA VAL B 40 -2.485 2.443 -13.319 1.00 0.00 C ATOM 1599 C VAL B 40 -1.003 2.348 -12.974 1.00 0.00 C ATOM 1600 O VAL B 40 -0.510 1.285 -12.596 1.00 0.00 O ATOM 1601 CB VAL B 40 -3.273 2.855 -12.059 1.00 0.00 C ATOM 1602 CG1 VAL B 40 -2.890 4.260 -11.624 1.00 0.00 C ATOM 1603 CG2 VAL B 40 -4.770 2.758 -12.312 1.00 0.00 C ATOM 0 H VAL B 40 -3.324 0.526 -13.172 1.00 0.00 H new ATOM 0 HA VAL B 40 -2.630 3.202 -14.087 1.00 0.00 H new ATOM 0 HB VAL B 40 -3.017 2.168 -11.252 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -3.457 4.532 -10.734 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -1.824 4.294 -11.400 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -3.115 4.963 -12.426 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -5.311 3.052 -11.413 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -5.044 3.420 -13.133 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -5.029 1.732 -12.572 1.00 0.00 H new ATOM 1613 N SER B 41 -0.294 3.465 -13.111 1.00 0.00 N ATOM 1614 CA SER B 41 1.135 3.508 -12.819 1.00 0.00 C ATOM 1615 C SER B 41 1.425 3.008 -11.407 1.00 0.00 C ATOM 1616 O SER B 41 1.263 3.743 -10.432 1.00 0.00 O ATOM 1617 CB SER B 41 1.669 4.932 -12.986 1.00 0.00 C ATOM 1618 OG SER B 41 3.084 4.942 -13.051 1.00 0.00 O ATOM 0 H SER B 41 -0.687 4.353 -13.423 1.00 0.00 H new ATOM 0 HA SER B 41 1.640 2.850 -13.526 1.00 0.00 H new ATOM 0 HB2 SER B 41 1.257 5.374 -13.893 1.00 0.00 H new ATOM 0 HB3 SER B 41 1.336 5.549 -12.151 1.00 0.00 H new ATOM 0 HG SER B 41 3.400 5.863 -13.159 1.00 0.00 H new ATOM 1624 N VAL B 42 1.858 1.755 -11.305 1.00 0.00 N ATOM 1625 CA VAL B 42 2.177 1.158 -10.014 1.00 0.00 C ATOM 1626 C VAL B 42 3.624 0.667 -9.983 1.00 0.00 C ATOM 1627 O VAL B 42 4.035 -0.125 -10.831 1.00 0.00 O ATOM 1628 CB VAL B 42 1.236 -0.021 -9.693 1.00 0.00 C ATOM 1629 CG1 VAL B 42 1.394 -1.133 -10.719 1.00 0.00 C ATOM 1630 CG2 VAL B 42 1.491 -0.541 -8.286 1.00 0.00 C ATOM 0 H VAL B 42 1.996 1.134 -12.102 1.00 0.00 H new ATOM 0 HA VAL B 42 2.042 1.934 -9.260 1.00 0.00 H new ATOM 0 HB VAL B 42 0.208 0.338 -9.742 1.00 0.00 H new ATOM 0 HG11 VAL B 42 0.721 -1.954 -10.472 1.00 0.00 H new ATOM 0 HG12 VAL B 42 1.152 -0.750 -11.710 1.00 0.00 H new ATOM 0 HG13 VAL B 42 2.423 -1.493 -10.710 1.00 0.00 H new ATOM 0 HG21 VAL B 42 0.818 -1.372 -8.078 1.00 0.00 H new ATOM 0 HG22 VAL B 42 2.523 -0.881 -8.205 1.00 0.00 H new ATOM 0 HG23 VAL B 42 1.315 0.258 -7.565 1.00 0.00 H new ATOM 1640 N HIS B 43 4.393 1.137 -9.004 1.00 0.00 N ATOM 1641 CA HIS B 43 5.790 0.739 -8.870 1.00 0.00 C ATOM 1642 C HIS B 43 6.075 0.246 -7.455 1.00 0.00 C ATOM 1643 O HIS B 43 5.639 0.856 -6.479 1.00 0.00 O ATOM 1644 CB HIS B 43 6.712 1.912 -9.214 1.00 0.00 C ATOM 1645 CG HIS B 43 7.414 1.757 -10.527 1.00 0.00 C ATOM 1646 ND1 HIS B 43 7.994 0.575 -10.937 1.00 0.00 N ATOM 1647 CD2 HIS B 43 7.628 2.643 -11.529 1.00 0.00 C ATOM 1648 CE1 HIS B 43 8.535 0.739 -12.130 1.00 0.00 C ATOM 1649 NE2 HIS B 43 8.326 1.986 -12.512 1.00 0.00 N ATOM 0 H HIS B 43 4.072 1.794 -8.293 1.00 0.00 H new ATOM 0 HA HIS B 43 5.982 -0.077 -9.567 1.00 0.00 H new ATOM 0 HB2 HIS B 43 6.126 2.831 -9.231 1.00 0.00 H new ATOM 0 HB3 HIS B 43 7.456 2.023 -8.425 1.00 0.00 H new ATOM 0 HD2 HIS B 43 7.309 3.675 -11.551 1.00 0.00 H new ATOM 0 HE1 HIS B 43 9.059 -0.017 -12.696 1.00 0.00 H new ATOM 0 HE2 HIS B 43 8.633 2.395 -13.394 1.00 0.00 H new ATOM 1657 N ARG B 44 6.809 -0.857 -7.347 1.00 0.00 N ATOM 1658 CA ARG B 44 7.149 -1.423 -6.047 1.00 0.00 C ATOM 1659 C ARG B 44 8.517 -2.096 -6.095 1.00 0.00 C ATOM 1660 O ARG B 44 9.199 -2.063 -7.119 1.00 0.00 O ATOM 1661 CB ARG B 44 6.085 -2.433 -5.612 1.00 0.00 C ATOM 1662 CG ARG B 44 4.830 -1.787 -5.044 1.00 0.00 C ATOM 1663 CD ARG B 44 3.601 -2.126 -5.874 1.00 0.00 C ATOM 1664 NE ARG B 44 3.458 -3.566 -6.077 1.00 0.00 N ATOM 1665 CZ ARG B 44 2.339 -4.146 -6.504 1.00 0.00 C ATOM 1666 NH1 ARG B 44 1.264 -3.414 -6.772 1.00 0.00 N ATOM 1667 NH2 ARG B 44 2.294 -5.462 -6.664 1.00 0.00 N ATOM 0 H ARG B 44 7.179 -1.376 -8.143 1.00 0.00 H new ATOM 0 HA ARG B 44 7.185 -0.612 -5.320 1.00 0.00 H new ATOM 0 HB2 ARG B 44 5.811 -3.051 -6.467 1.00 0.00 H new ATOM 0 HB3 ARG B 44 6.512 -3.099 -4.862 1.00 0.00 H new ATOM 0 HG2 ARG B 44 4.680 -2.122 -4.018 1.00 0.00 H new ATOM 0 HG3 ARG B 44 4.960 -0.705 -5.011 1.00 0.00 H new ATOM 0 HD2 ARG B 44 2.711 -1.740 -5.378 1.00 0.00 H new ATOM 0 HD3 ARG B 44 3.668 -1.628 -6.841 1.00 0.00 H new ATOM 0 HE ARG B 44 4.263 -4.161 -5.880 1.00 0.00 H new ATOM 0 HH11 ARG B 44 1.293 -2.402 -6.651 1.00 0.00 H new ATOM 0 HH12 ARG B 44 0.409 -3.864 -7.099 1.00 0.00 H new ATOM 0 HH21 ARG B 44 3.117 -6.029 -6.460 1.00 0.00 H new ATOM 0 HH22 ARG B 44 1.436 -5.907 -6.991 1.00 0.00 H new ATOM 1681 N GLU B 45 8.914 -2.709 -4.984 1.00 0.00 N ATOM 1682 CA GLU B 45 10.202 -3.389 -4.907 1.00 0.00 C ATOM 1683 C GLU B 45 10.294 -4.496 -5.954 1.00 0.00 C ATOM 1684 O GLU B 45 9.336 -5.237 -6.176 1.00 0.00 O ATOM 1685 CB GLU B 45 10.415 -3.971 -3.508 1.00 0.00 C ATOM 1686 CG GLU B 45 11.798 -3.700 -2.940 1.00 0.00 C ATOM 1687 CD GLU B 45 11.837 -3.799 -1.428 1.00 0.00 C ATOM 1688 OE1 GLU B 45 11.308 -2.887 -0.759 1.00 0.00 O ATOM 1689 OE2 GLU B 45 12.397 -4.790 -0.913 1.00 0.00 O ATOM 0 H GLU B 45 8.363 -2.749 -4.126 1.00 0.00 H new ATOM 0 HA GLU B 45 10.984 -2.657 -5.108 1.00 0.00 H new ATOM 0 HB2 GLU B 45 9.667 -3.556 -2.833 1.00 0.00 H new ATOM 0 HB3 GLU B 45 10.250 -5.048 -3.543 1.00 0.00 H new ATOM 0 HG2 GLU B 45 12.507 -4.410 -3.365 1.00 0.00 H new ATOM 0 HG3 GLU B 45 12.123 -2.705 -3.244 1.00 0.00 H new ATOM 1696 N GLU B 46 11.453 -4.601 -6.598 1.00 0.00 N ATOM 1697 CA GLU B 46 11.670 -5.614 -7.625 1.00 0.00 C ATOM 1698 C GLU B 46 11.407 -7.015 -7.081 1.00 0.00 C ATOM 1699 O GLU B 46 10.525 -7.723 -7.566 1.00 0.00 O ATOM 1700 CB GLU B 46 13.099 -5.521 -8.167 1.00 0.00 C ATOM 1701 CG GLU B 46 13.174 -5.030 -9.603 1.00 0.00 C ATOM 1702 CD GLU B 46 13.132 -3.518 -9.704 1.00 0.00 C ATOM 1703 OE1 GLU B 46 12.109 -2.924 -9.304 1.00 0.00 O ATOM 1704 OE2 GLU B 46 14.123 -2.927 -10.182 1.00 0.00 O ATOM 0 H GLU B 46 12.256 -3.996 -6.426 1.00 0.00 H new ATOM 0 HA GLU B 46 10.967 -5.427 -8.437 1.00 0.00 H new ATOM 0 HB2 GLU B 46 13.677 -4.850 -7.532 1.00 0.00 H new ATOM 0 HB3 GLU B 46 13.568 -6.503 -8.103 1.00 0.00 H new ATOM 0 HG2 GLU B 46 14.093 -5.396 -10.061 1.00 0.00 H new ATOM 0 HG3 GLU B 46 12.345 -5.452 -10.171 1.00 0.00 H new ATOM 1711 N ILE B 47 12.179 -7.410 -6.072 1.00 0.00 N ATOM 1712 CA ILE B 47 12.032 -8.728 -5.464 1.00 0.00 C ATOM 1713 C ILE B 47 10.598 -8.967 -4.997 1.00 0.00 C ATOM 1714 O ILE B 47 10.046 -10.054 -5.183 1.00 0.00 O ATOM 1715 CB ILE B 47 12.993 -8.906 -4.270 1.00 0.00 C ATOM 1716 CG1 ILE B 47 12.851 -10.305 -3.668 1.00 0.00 C ATOM 1717 CG2 ILE B 47 12.735 -7.841 -3.215 1.00 0.00 C ATOM 1718 CD1 ILE B 47 14.112 -10.805 -2.998 1.00 0.00 C ATOM 0 H ILE B 47 12.913 -6.835 -5.658 1.00 0.00 H new ATOM 0 HA ILE B 47 12.282 -9.460 -6.232 1.00 0.00 H new ATOM 0 HB ILE B 47 14.015 -8.792 -4.632 1.00 0.00 H new ATOM 0 HG12 ILE B 47 12.040 -10.298 -2.939 1.00 0.00 H new ATOM 0 HG13 ILE B 47 12.566 -11.003 -4.455 1.00 0.00 H new ATOM 0 HG21 ILE B 47 13.422 -7.982 -2.380 1.00 0.00 H new ATOM 0 HG22 ILE B 47 12.890 -6.853 -3.650 1.00 0.00 H new ATOM 0 HG23 ILE B 47 11.708 -7.924 -2.858 1.00 0.00 H new ATOM 0 HD11 ILE B 47 13.938 -11.802 -2.594 1.00 0.00 H new ATOM 0 HD12 ILE B 47 14.921 -10.845 -3.728 1.00 0.00 H new ATOM 0 HD13 ILE B 47 14.387 -10.128 -2.189 1.00 0.00 H new ATOM 1730 N TYR B 48 9.999 -7.945 -4.392 1.00 0.00 N ATOM 1731 CA TYR B 48 8.629 -8.038 -3.897 1.00 0.00 C ATOM 1732 C TYR B 48 7.711 -8.672 -4.939 1.00 0.00 C ATOM 1733 O TYR B 48 7.082 -9.702 -4.688 1.00 0.00 O ATOM 1734 CB TYR B 48 8.106 -6.648 -3.523 1.00 0.00 C ATOM 1735 CG TYR B 48 8.549 -6.168 -2.157 1.00 0.00 C ATOM 1736 CD1 TYR B 48 9.716 -6.643 -1.571 1.00 0.00 C ATOM 1737 CD2 TYR B 48 7.796 -5.236 -1.453 1.00 0.00 C ATOM 1738 CE1 TYR B 48 10.120 -6.205 -0.324 1.00 0.00 C ATOM 1739 CE2 TYR B 48 8.194 -4.792 -0.205 1.00 0.00 C ATOM 1740 CZ TYR B 48 9.356 -5.279 0.354 1.00 0.00 C ATOM 1741 OH TYR B 48 9.754 -4.840 1.596 1.00 0.00 O ATOM 0 H TYR B 48 10.442 -7.040 -4.232 1.00 0.00 H new ATOM 0 HA TYR B 48 8.634 -8.672 -3.010 1.00 0.00 H new ATOM 0 HB2 TYR B 48 8.440 -5.932 -4.274 1.00 0.00 H new ATOM 0 HB3 TYR B 48 7.017 -6.660 -3.556 1.00 0.00 H new ATOM 0 HD1 TYR B 48 10.318 -7.367 -2.099 1.00 0.00 H new ATOM 0 HD2 TYR B 48 6.885 -4.852 -1.888 1.00 0.00 H new ATOM 0 HE1 TYR B 48 11.029 -6.586 0.117 1.00 0.00 H new ATOM 0 HE2 TYR B 48 7.597 -4.067 0.329 1.00 0.00 H new ATOM 0 HH TYR B 48 9.106 -4.189 1.936 1.00 0.00 H new ATOM 1751 N GLN B 49 7.637 -8.047 -6.109 1.00 0.00 N ATOM 1752 CA GLN B 49 6.793 -8.544 -7.187 1.00 0.00 C ATOM 1753 C GLN B 49 7.417 -9.756 -7.877 1.00 0.00 C ATOM 1754 O GLN B 49 6.718 -10.531 -8.525 1.00 0.00 O ATOM 1755 CB GLN B 49 6.539 -7.437 -8.211 1.00 0.00 C ATOM 1756 CG GLN B 49 5.437 -6.473 -7.801 1.00 0.00 C ATOM 1757 CD GLN B 49 5.081 -5.492 -8.901 1.00 0.00 C ATOM 1758 OE1 GLN B 49 5.667 -4.414 -9.001 1.00 0.00 O ATOM 1759 NE2 GLN B 49 4.114 -5.861 -9.733 1.00 0.00 N ATOM 0 H GLN B 49 8.152 -7.196 -6.334 1.00 0.00 H new ATOM 0 HA GLN B 49 5.846 -8.857 -6.748 1.00 0.00 H new ATOM 0 HB2 GLN B 49 7.461 -6.877 -8.366 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.277 -7.890 -9.167 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.548 -7.040 -7.523 1.00 0.00 H new ATOM 0 HG3 GLN B 49 5.753 -5.921 -6.916 1.00 0.00 H new ATOM 0 HE21 GLN B 49 3.655 -6.764 -9.613 1.00 0.00 H new ATOM 0 HE22 GLN B 49 3.830 -5.241 -10.492 1.00 0.00 H new ATOM 1768 N ARG B 50 8.732 -9.920 -7.739 1.00 0.00 N ATOM 1769 CA ARG B 50 9.425 -11.043 -8.362 1.00 0.00 C ATOM 1770 C ARG B 50 9.124 -12.357 -7.637 1.00 0.00 C ATOM 1771 O ARG B 50 9.412 -13.437 -8.152 1.00 0.00 O ATOM 1772 CB ARG B 50 10.940 -10.779 -8.410 1.00 0.00 C ATOM 1773 CG ARG B 50 11.760 -11.573 -7.399 1.00 0.00 C ATOM 1774 CD ARG B 50 13.250 -11.330 -7.579 1.00 0.00 C ATOM 1775 NE ARG B 50 14.037 -11.916 -6.497 1.00 0.00 N ATOM 1776 CZ ARG B 50 15.357 -12.081 -6.546 1.00 0.00 C ATOM 1777 NH1 ARG B 50 16.040 -11.704 -7.620 1.00 0.00 N ATOM 1778 NH2 ARG B 50 15.996 -12.624 -5.519 1.00 0.00 N ATOM 0 H ARG B 50 9.334 -9.293 -7.205 1.00 0.00 H new ATOM 0 HA ARG B 50 9.057 -11.140 -9.383 1.00 0.00 H new ATOM 0 HB2 ARG B 50 11.303 -11.009 -9.412 1.00 0.00 H new ATOM 0 HB3 ARG B 50 11.115 -9.716 -8.244 1.00 0.00 H new ATOM 0 HG2 ARG B 50 11.464 -11.293 -6.388 1.00 0.00 H new ATOM 0 HG3 ARG B 50 11.547 -12.636 -7.511 1.00 0.00 H new ATOM 0 HD2 ARG B 50 13.573 -11.751 -8.531 1.00 0.00 H new ATOM 0 HD3 ARG B 50 13.439 -10.257 -7.624 1.00 0.00 H new ATOM 0 HE ARG B 50 13.546 -12.216 -5.655 1.00 0.00 H new ATOM 0 HH11 ARG B 50 15.553 -11.286 -8.413 1.00 0.00 H new ATOM 0 HH12 ARG B 50 17.051 -11.833 -7.652 1.00 0.00 H new ATOM 0 HH21 ARG B 50 15.476 -12.915 -4.691 1.00 0.00 H new ATOM 0 HH22 ARG B 50 17.007 -12.750 -5.557 1.00 0.00 H new ATOM 1792 N ILE B 51 8.550 -12.261 -6.441 1.00 0.00 N ATOM 1793 CA ILE B 51 8.222 -13.446 -5.658 1.00 0.00 C ATOM 1794 C ILE B 51 6.714 -13.674 -5.600 1.00 0.00 C ATOM 1795 O ILE B 51 6.252 -14.814 -5.550 1.00 0.00 O ATOM 1796 CB ILE B 51 8.770 -13.341 -4.221 1.00 0.00 C ATOM 1797 CG1 ILE B 51 10.259 -12.993 -4.244 1.00 0.00 C ATOM 1798 CG2 ILE B 51 8.538 -14.642 -3.466 1.00 0.00 C ATOM 1799 CD1 ILE B 51 10.775 -12.457 -2.926 1.00 0.00 C ATOM 0 H ILE B 51 8.303 -11.377 -5.995 1.00 0.00 H new ATOM 0 HA ILE B 51 8.693 -14.292 -6.159 1.00 0.00 H new ATOM 0 HB ILE B 51 8.236 -12.544 -3.704 1.00 0.00 H new ATOM 0 HG12 ILE B 51 10.828 -13.883 -4.513 1.00 0.00 H new ATOM 0 HG13 ILE B 51 10.439 -12.253 -5.023 1.00 0.00 H new ATOM 0 HG21 ILE B 51 8.931 -14.550 -2.453 1.00 0.00 H new ATOM 0 HG22 ILE B 51 7.469 -14.852 -3.423 1.00 0.00 H new ATOM 0 HG23 ILE B 51 9.047 -15.457 -3.980 1.00 0.00 H new ATOM 0 HD11 ILE B 51 11.838 -12.232 -3.016 1.00 0.00 H new ATOM 0 HD12 ILE B 51 10.232 -11.548 -2.665 1.00 0.00 H new ATOM 0 HD13 ILE B 51 10.627 -13.204 -2.146 1.00 0.00 H new ATOM 1811 N GLN B 52 5.951 -12.585 -5.602 1.00 0.00 N ATOM 1812 CA GLN B 52 4.495 -12.677 -5.543 1.00 0.00 C ATOM 1813 C GLN B 52 3.863 -12.361 -6.896 1.00 0.00 C ATOM 1814 O GLN B 52 3.037 -13.123 -7.398 1.00 0.00 O ATOM 1815 CB GLN B 52 3.947 -11.729 -4.473 1.00 0.00 C ATOM 1816 CG GLN B 52 3.429 -12.444 -3.236 1.00 0.00 C ATOM 1817 CD GLN B 52 4.503 -13.258 -2.539 1.00 0.00 C ATOM 1818 OE1 GLN B 52 5.534 -13.581 -3.129 1.00 0.00 O ATOM 1819 NE2 GLN B 52 4.265 -13.594 -1.277 1.00 0.00 N ATOM 0 H GLN B 52 6.314 -11.633 -5.644 1.00 0.00 H new ATOM 0 HA GLN B 52 4.235 -13.702 -5.280 1.00 0.00 H new ATOM 0 HB2 GLN B 52 4.733 -11.034 -4.178 1.00 0.00 H new ATOM 0 HB3 GLN B 52 3.141 -11.135 -4.904 1.00 0.00 H new ATOM 0 HG2 GLN B 52 3.025 -11.710 -2.539 1.00 0.00 H new ATOM 0 HG3 GLN B 52 2.606 -13.101 -3.519 1.00 0.00 H new ATOM 0 HE21 GLN B 52 3.396 -13.305 -0.827 1.00 0.00 H new ATOM 0 HE22 GLN B 52 4.951 -14.142 -0.757 1.00 0.00 H new ATOM 1828 N ALA B 53 4.254 -11.234 -7.483 1.00 0.00 N ATOM 1829 CA ALA B 53 3.722 -10.825 -8.776 1.00 0.00 C ATOM 1830 C ALA B 53 4.076 -11.843 -9.853 1.00 0.00 C ATOM 1831 O ALA B 53 3.209 -12.552 -10.364 1.00 0.00 O ATOM 1832 CB ALA B 53 4.246 -9.448 -9.152 1.00 0.00 C ATOM 0 H ALA B 53 4.936 -10.589 -7.084 1.00 0.00 H new ATOM 0 HA ALA B 53 2.636 -10.775 -8.699 1.00 0.00 H new ATOM 0 HB1 ALA B 53 3.840 -9.156 -10.120 1.00 0.00 H new ATOM 0 HB2 ALA B 53 3.940 -8.724 -8.397 1.00 0.00 H new ATOM 0 HB3 ALA B 53 5.334 -9.476 -9.208 1.00 0.00 H new ATOM 1838 N GLU B 54 5.359 -11.915 -10.186 1.00 0.00 N ATOM 1839 CA GLU B 54 5.839 -12.850 -11.193 1.00 0.00 C ATOM 1840 C GLU B 54 6.747 -13.896 -10.557 1.00 0.00 C ATOM 1841 O GLU B 54 7.784 -13.566 -9.984 1.00 0.00 O ATOM 1842 CB GLU B 54 6.592 -12.104 -12.297 1.00 0.00 C ATOM 1843 CG GLU B 54 6.723 -12.898 -13.586 1.00 0.00 C ATOM 1844 CD GLU B 54 5.379 -13.277 -14.177 1.00 0.00 C ATOM 1845 OE1 GLU B 54 4.704 -12.387 -14.735 1.00 0.00 O ATOM 1846 OE2 GLU B 54 5.002 -14.464 -14.081 1.00 0.00 O ATOM 0 H GLU B 54 6.087 -11.334 -9.771 1.00 0.00 H new ATOM 0 HA GLU B 54 4.978 -13.354 -11.633 1.00 0.00 H new ATOM 0 HB2 GLU B 54 6.077 -11.167 -12.508 1.00 0.00 H new ATOM 0 HB3 GLU B 54 7.588 -11.846 -11.936 1.00 0.00 H new ATOM 0 HG2 GLU B 54 7.283 -12.312 -14.314 1.00 0.00 H new ATOM 0 HG3 GLU B 54 7.299 -13.803 -13.394 1.00 0.00 H new ATOM 1853 N LYS B 55 6.352 -15.159 -10.665 1.00 0.00 N ATOM 1854 CA LYS B 55 7.131 -16.255 -10.101 1.00 0.00 C ATOM 1855 C LYS B 55 8.544 -16.263 -10.673 1.00 0.00 C ATOM 1856 O LYS B 55 8.761 -16.679 -11.811 1.00 0.00 O ATOM 1857 CB LYS B 55 6.446 -17.594 -10.381 1.00 0.00 C ATOM 1858 CG LYS B 55 5.009 -17.657 -9.888 1.00 0.00 C ATOM 1859 CD LYS B 55 4.417 -19.047 -10.064 1.00 0.00 C ATOM 1860 CE LYS B 55 4.240 -19.752 -8.729 1.00 0.00 C ATOM 1861 NZ LYS B 55 2.835 -19.676 -8.242 1.00 0.00 N ATOM 0 H LYS B 55 5.496 -15.450 -11.138 1.00 0.00 H new ATOM 0 HA LYS B 55 7.194 -16.108 -9.023 1.00 0.00 H new ATOM 0 HB2 LYS B 55 6.462 -17.783 -11.454 1.00 0.00 H new ATOM 0 HB3 LYS B 55 7.019 -18.392 -9.908 1.00 0.00 H new ATOM 0 HG2 LYS B 55 4.972 -17.376 -8.836 1.00 0.00 H new ATOM 0 HG3 LYS B 55 4.405 -16.932 -10.433 1.00 0.00 H new ATOM 0 HD2 LYS B 55 3.453 -18.972 -10.567 1.00 0.00 H new ATOM 0 HD3 LYS B 55 5.066 -19.641 -10.707 1.00 0.00 H new ATOM 0 HE2 LYS B 55 4.533 -20.797 -8.829 1.00 0.00 H new ATOM 0 HE3 LYS B 55 4.905 -19.303 -7.991 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 2.757 -20.169 -7.329 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 2.563 -18.680 -8.122 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 2.203 -20.127 -8.934 1.00 0.00 H new