USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 930 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 59 MET CE :methyl -170:sc= -1.77 (180deg=-2.53!) USER MOD Set 1.2: A 115 HIS : no HD1:sc= -8.6! C(o=-10!,f=-7.3!) USER MOD Set 2.1: A 104 MET CE :methyl 173:sc= -0.173 (180deg=-0.447) USER MOD Set 2.2: A 109 LYS NZ :NH3+ 143:sc= 1.27 (180deg=0.755) USER MOD Set 3.1: A 53 HIS : no HD1:sc= -1.58 K(o=-0.02,f=-5.9!) USER MOD Set 3.2: A 57 LYS NZ :NH3+ -137:sc= 0.181 (180deg=0.0267) USER MOD Set 3.3: A 99 TYR OH : rot 138:sc= 1.38 USER MOD Set 4.1: A 6 THR OG1 : rot 156:sc= 1.34 USER MOD Set 4.2: A 35 GLN : amide:sc= 0.0141 K(o=1.4,f=0.11) USER MOD Single : A 10 HIS : no HD1:sc= -1.02 X(o=-1,f=-0.79) USER MOD Single : A 18 LYS NZ :NH3+ -119:sc= 1.31 (180deg=0.0976) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 TYR OH : rot 165:sc= -0.419 USER MOD Single : A 29 MET CE :methyl -163:sc= -0.789 (180deg=-1.56) USER MOD Single : A 33 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0605) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 173:sc= 2.44 (180deg=2.09) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -121:sc= 0 (180deg=-0.198) USER MOD Single : A 55 THR OG1 : rot 76:sc= 1.05 USER MOD Single : A 68 ASN : amide:sc= -1.02 K(o=-1,f=-0.26) USER MOD Single : A 71 ASN : amide:sc= -0.271 X(o=-0.27,f=-0.28) USER MOD Single : A 76 HIS : no HE2:sc= 0.114 K(o=0.11,f=-1.4) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 ASN : amide:sc= 0.6 K(o=0.6,f=-0.14) USER MOD Single : A 93 GLN : amide:sc= -0.324 X(o=-0.32,f=-0.00069) USER MOD Single : A 95 THR OG1 : rot 81:sc= 0.516 USER MOD Single : A 97 THR OG1 : rot 126:sc= 1.1 USER MOD Single : A 100 CYS SG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 87:sc= 0.719 USER MOD Single : A 102 THR OG1 : rot 85:sc= 0.996 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.569 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 CYS SG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 169:sc= 1.21 (180deg=1.01) USER MOD ----------------------------------------------------------------- ATOM 38 N GLY A 4 -1.896 6.138 1.838 1.00 0.00 N ATOM 39 CA GLY A 4 -2.646 5.799 3.042 1.00 0.00 C ATOM 40 C GLY A 4 -2.380 6.873 4.068 1.00 0.00 C ATOM 41 O GLY A 4 -1.924 6.605 5.177 1.00 0.00 O ATOM 0 HA2 GLY A 4 -3.712 5.735 2.823 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.340 4.824 3.421 1.00 0.00 H new ATOM 45 N ASP A 5 -2.673 8.096 3.635 1.00 0.00 N ATOM 46 CA ASP A 5 -2.508 9.323 4.380 1.00 0.00 C ATOM 47 C ASP A 5 -2.948 10.477 3.483 1.00 0.00 C ATOM 48 O ASP A 5 -3.619 11.397 3.947 1.00 0.00 O ATOM 49 CB ASP A 5 -1.014 9.533 4.758 1.00 0.00 C ATOM 50 CG ASP A 5 -0.801 10.840 5.514 1.00 0.00 C ATOM 51 OD1 ASP A 5 -1.648 11.142 6.383 1.00 0.00 O ATOM 52 OD2 ASP A 5 0.221 11.501 5.236 1.00 0.00 O ATOM 0 H ASP A 5 -3.052 8.257 2.702 1.00 0.00 H new ATOM 0 HA ASP A 5 -3.101 9.279 5.294 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -0.673 8.699 5.371 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -0.406 9.533 3.853 1.00 0.00 H new ATOM 57 N THR A 6 -2.543 10.391 2.203 1.00 0.00 N ATOM 58 CA THR A 6 -2.762 11.324 1.105 1.00 0.00 C ATOM 59 C THR A 6 -2.422 12.740 1.537 1.00 0.00 C ATOM 60 O THR A 6 -1.726 12.910 2.533 1.00 0.00 O ATOM 61 CB THR A 6 -4.121 11.132 0.451 1.00 0.00 C ATOM 62 OG1 THR A 6 -4.209 11.728 -0.828 1.00 0.00 O ATOM 63 CG2 THR A 6 -5.154 11.759 1.344 1.00 0.00 C ATOM 0 H THR A 6 -2.002 9.584 1.891 1.00 0.00 H new ATOM 0 HA THR A 6 -2.068 11.103 0.294 1.00 0.00 H new ATOM 0 HB THR A 6 -4.281 10.062 0.318 1.00 0.00 H new ATOM 0 HG1 THR A 6 -4.906 11.279 -1.351 1.00 0.00 H new ATOM 0 HG21 THR A 6 -6.142 11.637 0.900 1.00 0.00 H new ATOM 0 HG22 THR A 6 -5.133 11.275 2.320 1.00 0.00 H new ATOM 0 HG23 THR A 6 -4.938 12.821 1.461 1.00 0.00 H new ATOM 71 N PHE A 7 -2.849 13.741 0.752 1.00 0.00 N ATOM 72 CA PHE A 7 -2.431 15.120 0.974 1.00 0.00 C ATOM 73 C PHE A 7 -3.497 16.204 0.864 1.00 0.00 C ATOM 74 O PHE A 7 -4.658 15.928 0.568 1.00 0.00 O ATOM 75 CB PHE A 7 -1.189 15.319 0.105 1.00 0.00 C ATOM 76 CG PHE A 7 -0.274 14.072 0.252 1.00 0.00 C ATOM 77 CD1 PHE A 7 0.573 13.918 1.378 1.00 0.00 C ATOM 78 CD2 PHE A 7 -0.324 13.005 -0.683 1.00 0.00 C ATOM 79 CE1 PHE A 7 1.379 12.777 1.531 1.00 0.00 C ATOM 80 CE2 PHE A 7 0.486 11.865 -0.527 1.00 0.00 C ATOM 81 CZ PHE A 7 1.347 11.755 0.573 1.00 0.00 C ATOM 0 H PHE A 7 -3.482 13.615 -0.038 1.00 0.00 H new ATOM 0 HA PHE A 7 -2.200 15.259 2.030 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -1.475 15.457 -0.938 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -0.654 16.218 0.410 1.00 0.00 H new ATOM 0 HD1 PHE A 7 0.599 14.691 2.132 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -0.994 13.069 -1.527 1.00 0.00 H new ATOM 0 HE1 PHE A 7 2.026 12.687 2.391 1.00 0.00 H new ATOM 0 HE2 PHE A 7 0.444 11.071 -1.258 1.00 0.00 H new ATOM 0 HZ PHE A 7 1.982 10.888 0.682 1.00 0.00 H new ATOM 91 N ILE A 8 -3.084 17.443 1.160 1.00 0.00 N ATOM 92 CA ILE A 8 -3.952 18.604 1.219 1.00 0.00 C ATOM 93 C ILE A 8 -4.021 19.381 -0.094 1.00 0.00 C ATOM 94 O ILE A 8 -3.027 19.445 -0.815 1.00 0.00 O ATOM 95 CB ILE A 8 -3.451 19.553 2.333 1.00 0.00 C ATOM 96 CG1 ILE A 8 -3.189 18.837 3.667 1.00 0.00 C ATOM 97 CG2 ILE A 8 -4.430 20.709 2.563 1.00 0.00 C ATOM 98 CD1 ILE A 8 -4.461 18.240 4.273 1.00 0.00 C ATOM 0 H ILE A 8 -2.110 17.661 1.369 1.00 0.00 H new ATOM 0 HA ILE A 8 -4.957 18.235 1.425 1.00 0.00 H new ATOM 0 HB ILE A 8 -2.499 19.944 1.975 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -2.458 18.044 3.512 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -2.750 19.542 4.373 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -4.049 21.357 3.352 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -4.538 21.283 1.643 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -5.401 20.311 2.858 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -4.219 17.746 5.214 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -5.184 19.035 4.456 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -4.887 17.513 3.581 1.00 0.00 H new ATOM 110 N ARG A 9 -5.172 20.016 -0.371 1.00 0.00 N ATOM 111 CA ARG A 9 -5.341 20.896 -1.514 1.00 0.00 C ATOM 112 C ARG A 9 -5.089 22.283 -0.925 1.00 0.00 C ATOM 113 O ARG A 9 -4.136 22.955 -1.313 1.00 0.00 O ATOM 114 CB ARG A 9 -6.762 20.760 -2.124 1.00 0.00 C ATOM 115 CG ARG A 9 -6.838 21.273 -3.569 1.00 0.00 C ATOM 116 CD ARG A 9 -6.722 22.800 -3.669 1.00 0.00 C ATOM 117 NE ARG A 9 -6.992 23.277 -5.034 1.00 0.00 N ATOM 118 CZ ARG A 9 -6.107 23.285 -6.048 1.00 0.00 C ATOM 119 NH1 ARG A 9 -4.867 22.805 -5.877 1.00 0.00 N ATOM 120 NH2 ARG A 9 -6.468 23.778 -7.239 1.00 0.00 N ATOM 0 H ARG A 9 -6.010 19.925 0.203 1.00 0.00 H new ATOM 0 HA ARG A 9 -4.668 20.669 -2.341 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -7.065 19.713 -2.098 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.472 21.313 -1.509 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -6.041 20.814 -4.154 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -7.782 20.956 -4.012 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -7.423 23.265 -2.976 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -5.722 23.110 -3.366 1.00 0.00 H new ATOM 0 HE ARG A 9 -7.928 23.631 -5.228 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -4.586 22.429 -4.971 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -4.204 22.816 -6.652 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -7.410 24.145 -7.375 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -5.801 23.786 -8.011 1.00 0.00 H new ATOM 134 N HIS A 10 -5.938 22.687 0.030 1.00 0.00 N ATOM 135 CA HIS A 10 -5.856 23.960 0.731 1.00 0.00 C ATOM 136 C HIS A 10 -6.860 24.035 1.878 1.00 0.00 C ATOM 137 O HIS A 10 -7.531 23.051 2.196 1.00 0.00 O ATOM 138 CB HIS A 10 -6.004 25.119 -0.292 1.00 0.00 C ATOM 139 CG HIS A 10 -7.308 25.896 -0.323 1.00 0.00 C ATOM 140 ND1 HIS A 10 -7.349 27.279 -0.209 1.00 0.00 N ATOM 141 CD2 HIS A 10 -8.627 25.522 -0.454 1.00 0.00 C ATOM 142 CE1 HIS A 10 -8.640 27.655 -0.271 1.00 0.00 C ATOM 143 NE2 HIS A 10 -9.470 26.624 -0.423 1.00 0.00 N ATOM 0 H HIS A 10 -6.722 22.113 0.340 1.00 0.00 H new ATOM 0 HA HIS A 10 -4.877 24.056 1.201 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -5.199 25.830 -0.106 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -5.841 24.706 -1.287 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -8.962 24.502 -0.566 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -8.968 28.682 -0.205 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -10.487 26.641 -0.499 1.00 0.00 H new ATOM 151 N ILE A 11 -6.934 25.223 2.489 1.00 0.00 N ATOM 152 CA ILE A 11 -7.797 25.547 3.605 1.00 0.00 C ATOM 153 C ILE A 11 -8.648 26.773 3.274 1.00 0.00 C ATOM 154 O ILE A 11 -8.182 27.679 2.587 1.00 0.00 O ATOM 155 CB ILE A 11 -6.992 25.783 4.898 1.00 0.00 C ATOM 156 CG1 ILE A 11 -5.671 24.984 4.946 1.00 0.00 C ATOM 157 CG2 ILE A 11 -7.914 25.468 6.086 1.00 0.00 C ATOM 158 CD1 ILE A 11 -4.803 25.307 6.170 1.00 0.00 C ATOM 0 H ILE A 11 -6.362 26.015 2.196 1.00 0.00 H new ATOM 0 HA ILE A 11 -8.453 24.694 3.778 1.00 0.00 H new ATOM 0 HB ILE A 11 -6.674 26.825 4.939 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -5.900 23.918 4.944 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.099 25.189 4.041 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -7.372 25.626 7.019 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -8.784 26.125 6.056 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -8.241 24.430 6.027 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -3.892 24.709 6.138 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.543 26.366 6.163 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.357 25.076 7.080 1.00 0.00 H new ATOM 170 N ALA A 12 -9.884 26.807 3.779 1.00 0.00 N ATOM 171 CA ALA A 12 -10.845 27.881 3.616 1.00 0.00 C ATOM 172 C ALA A 12 -11.499 28.015 4.984 1.00 0.00 C ATOM 173 O ALA A 12 -11.312 27.148 5.841 1.00 0.00 O ATOM 174 CB ALA A 12 -11.876 27.510 2.540 1.00 0.00 C ATOM 0 H ALA A 12 -10.253 26.040 4.342 1.00 0.00 H new ATOM 0 HA ALA A 12 -10.387 28.815 3.292 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.592 28.324 2.426 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -11.367 27.340 1.591 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -12.402 26.603 2.837 1.00 0.00 H new ATOM 180 N LEU A 13 -12.270 29.083 5.210 1.00 0.00 N ATOM 181 CA LEU A 13 -12.933 29.256 6.487 1.00 0.00 C ATOM 182 C LEU A 13 -14.338 29.761 6.244 1.00 0.00 C ATOM 183 O LEU A 13 -14.560 30.562 5.337 1.00 0.00 O ATOM 184 CB LEU A 13 -12.034 30.115 7.387 1.00 0.00 C ATOM 185 CG LEU A 13 -12.128 29.955 8.927 1.00 0.00 C ATOM 186 CD1 LEU A 13 -10.837 30.574 9.442 1.00 0.00 C ATOM 187 CD2 LEU A 13 -13.264 30.635 9.697 1.00 0.00 C ATOM 0 H LEU A 13 -12.443 29.825 4.532 1.00 0.00 H new ATOM 0 HA LEU A 13 -13.071 28.324 7.035 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -11.001 29.920 7.100 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -12.238 31.160 7.153 1.00 0.00 H new ATOM 0 HG LEU A 13 -12.314 28.894 9.096 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -10.811 30.508 10.530 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.985 30.037 9.025 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.790 31.620 9.141 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -13.168 30.412 10.760 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.211 31.713 9.546 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -14.223 30.264 9.334 1.00 0.00 H new ATOM 199 N LEU A 14 -15.280 29.234 7.029 1.00 0.00 N ATOM 200 CA LEU A 14 -16.688 29.549 6.866 1.00 0.00 C ATOM 201 C LEU A 14 -17.059 30.727 7.733 1.00 0.00 C ATOM 202 O LEU A 14 -17.662 31.688 7.259 1.00 0.00 O ATOM 203 CB LEU A 14 -17.532 28.289 7.173 1.00 0.00 C ATOM 204 CG LEU A 14 -18.528 28.081 6.010 1.00 0.00 C ATOM 205 CD1 LEU A 14 -17.835 27.672 4.682 1.00 0.00 C ATOM 206 CD2 LEU A 14 -19.614 27.066 6.380 1.00 0.00 C ATOM 0 H LEU A 14 -15.083 28.582 7.788 1.00 0.00 H new ATOM 0 HA LEU A 14 -16.895 29.840 5.836 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -16.887 27.417 7.282 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -18.067 28.410 8.115 1.00 0.00 H new ATOM 0 HG LEU A 14 -18.996 29.051 5.840 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -18.587 27.541 3.904 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -17.135 28.452 4.382 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -17.296 26.736 4.826 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -20.298 26.943 5.540 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -19.151 26.107 6.615 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -20.166 27.425 7.249 1.00 0.00 H new ATOM 218 N GLY A 15 -16.678 30.652 9.002 1.00 0.00 N ATOM 219 CA GLY A 15 -16.964 31.763 9.892 1.00 0.00 C ATOM 220 C GLY A 15 -16.806 31.399 11.354 1.00 0.00 C ATOM 221 O GLY A 15 -15.783 30.841 11.748 1.00 0.00 O ATOM 0 H GLY A 15 -16.188 29.863 9.424 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -16.299 32.593 9.655 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -17.982 32.110 9.717 1.00 0.00 H new ATOM 225 N PHE A 16 -17.832 31.720 12.147 1.00 0.00 N ATOM 226 CA PHE A 16 -17.843 31.488 13.575 1.00 0.00 C ATOM 227 C PHE A 16 -18.399 30.078 13.830 1.00 0.00 C ATOM 228 O PHE A 16 -18.457 29.286 12.892 1.00 0.00 O ATOM 229 CB PHE A 16 -18.706 32.599 14.234 1.00 0.00 C ATOM 230 CG PHE A 16 -18.119 33.224 15.522 1.00 0.00 C ATOM 231 CD1 PHE A 16 -16.755 33.603 15.610 1.00 0.00 C ATOM 232 CD2 PHE A 16 -18.935 33.443 16.656 1.00 0.00 C ATOM 233 CE1 PHE A 16 -16.233 34.171 16.784 1.00 0.00 C ATOM 234 CE2 PHE A 16 -18.410 34.012 17.830 1.00 0.00 C ATOM 235 CZ PHE A 16 -17.059 34.375 17.898 1.00 0.00 C ATOM 0 H PHE A 16 -18.687 32.155 11.799 1.00 0.00 H new ATOM 0 HA PHE A 16 -16.845 31.534 14.011 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -18.863 33.394 13.504 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -19.686 32.183 14.467 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -16.106 33.452 14.760 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -19.979 33.169 16.620 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -15.191 34.452 16.828 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -19.052 34.170 18.684 1.00 0.00 H new ATOM 0 HZ PHE A 16 -16.657 34.809 18.802 1.00 0.00 H new ATOM 245 N GLU A 17 -18.797 29.770 15.073 1.00 0.00 N ATOM 246 CA GLU A 17 -19.370 28.502 15.530 1.00 0.00 C ATOM 247 C GLU A 17 -19.620 28.590 17.049 1.00 0.00 C ATOM 248 O GLU A 17 -19.107 29.483 17.720 1.00 0.00 O ATOM 249 CB GLU A 17 -18.522 27.288 15.092 1.00 0.00 C ATOM 250 CG GLU A 17 -18.885 25.897 15.645 1.00 0.00 C ATOM 251 CD GLU A 17 -20.262 25.364 15.258 1.00 0.00 C ATOM 252 OE1 GLU A 17 -20.973 26.025 14.471 1.00 0.00 O ATOM 253 OE2 GLU A 17 -20.624 24.306 15.814 1.00 0.00 O ATOM 0 H GLU A 17 -18.721 30.446 15.833 1.00 0.00 H new ATOM 0 HA GLU A 17 -20.333 28.333 15.048 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -18.561 27.232 14.004 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -17.486 27.492 15.364 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -18.133 25.185 15.306 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -18.823 25.932 16.733 1.00 0.00 H new ATOM 260 N LYS A 18 -20.444 27.672 17.567 1.00 0.00 N ATOM 261 CA LYS A 18 -20.928 27.531 18.926 1.00 0.00 C ATOM 262 C LYS A 18 -20.658 26.146 19.537 1.00 0.00 C ATOM 263 O LYS A 18 -21.456 25.224 19.383 1.00 0.00 O ATOM 264 CB LYS A 18 -22.428 27.883 18.985 1.00 0.00 C ATOM 265 CG LYS A 18 -23.475 27.031 18.227 1.00 0.00 C ATOM 266 CD LYS A 18 -23.084 26.722 16.782 1.00 0.00 C ATOM 267 CE LYS A 18 -24.175 26.090 15.920 1.00 0.00 C ATOM 268 NZ LYS A 18 -23.667 25.887 14.548 1.00 0.00 N ATOM 0 H LYS A 18 -20.823 26.935 16.972 1.00 0.00 H new ATOM 0 HA LYS A 18 -20.362 28.233 19.539 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -22.716 27.882 20.036 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -22.530 28.908 18.628 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -23.624 26.093 18.762 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -24.430 27.556 18.232 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -22.762 27.648 16.306 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -22.223 26.054 16.793 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -24.485 25.137 16.349 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -25.055 26.732 15.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -24.245 26.434 13.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -22.679 26.206 14.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -23.719 24.877 14.305 1.00 0.00 H new ATOM 282 N ARG A 19 -19.553 26.009 20.273 1.00 0.00 N ATOM 283 CA ARG A 19 -19.165 24.828 21.024 1.00 0.00 C ATOM 284 C ARG A 19 -19.125 25.356 22.453 1.00 0.00 C ATOM 285 O ARG A 19 -18.195 26.062 22.830 1.00 0.00 O ATOM 286 CB ARG A 19 -17.809 24.278 20.557 1.00 0.00 C ATOM 287 CG ARG A 19 -17.879 22.935 19.813 1.00 0.00 C ATOM 288 CD ARG A 19 -18.610 22.980 18.463 1.00 0.00 C ATOM 289 NE ARG A 19 -18.389 21.722 17.725 1.00 0.00 N ATOM 290 CZ ARG A 19 -19.237 21.137 16.862 1.00 0.00 C ATOM 291 NH1 ARG A 19 -20.377 21.731 16.491 1.00 0.00 N ATOM 292 NH2 ARG A 19 -18.926 19.943 16.341 1.00 0.00 N ATOM 0 H ARG A 19 -18.873 26.764 20.361 1.00 0.00 H new ATOM 0 HA ARG A 19 -19.842 23.983 20.901 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -17.339 25.014 19.905 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -17.161 24.162 21.426 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -16.864 22.575 19.648 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -18.375 22.207 20.454 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -19.677 23.134 18.623 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -18.251 23.824 17.874 1.00 0.00 H new ATOM 0 HE ARG A 19 -17.501 21.247 17.886 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -20.619 22.649 16.865 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -21.004 21.266 15.834 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -18.052 19.486 16.600 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -19.563 19.491 15.685 1.00 0.00 H new ATOM 401 N TYR A 26 -16.926 30.488 22.236 1.00 0.00 N ATOM 402 CA TYR A 26 -17.330 30.216 20.855 1.00 0.00 C ATOM 403 C TYR A 26 -16.068 29.853 20.057 1.00 0.00 C ATOM 404 O TYR A 26 -14.952 30.185 20.464 1.00 0.00 O ATOM 405 CB TYR A 26 -18.172 31.345 20.229 1.00 0.00 C ATOM 406 CG TYR A 26 -19.705 31.209 20.479 1.00 0.00 C ATOM 407 CD1 TYR A 26 -20.213 30.756 21.724 1.00 0.00 C ATOM 408 CD2 TYR A 26 -20.660 31.523 19.474 1.00 0.00 C ATOM 409 CE1 TYR A 26 -21.593 30.628 21.955 1.00 0.00 C ATOM 410 CE2 TYR A 26 -22.039 31.396 19.710 1.00 0.00 C ATOM 411 CZ TYR A 26 -22.509 30.950 20.950 1.00 0.00 C ATOM 412 OH TYR A 26 -23.847 30.823 21.180 1.00 0.00 O ATOM 0 HA TYR A 26 -18.015 29.368 20.833 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -17.833 32.301 20.628 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -17.990 31.366 19.154 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -19.521 30.503 22.514 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -20.318 31.866 18.509 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -21.947 30.279 22.914 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -22.742 31.645 18.928 1.00 0.00 H new ATOM 0 HH TYR A 26 -24.343 31.089 20.378 1.00 0.00 H new ATOM 422 N VAL A 27 -16.251 29.120 18.954 1.00 0.00 N ATOM 423 CA VAL A 27 -15.181 28.575 18.125 1.00 0.00 C ATOM 424 C VAL A 27 -15.441 28.942 16.669 1.00 0.00 C ATOM 425 O VAL A 27 -16.400 29.666 16.412 1.00 0.00 O ATOM 426 CB VAL A 27 -15.142 27.048 18.385 1.00 0.00 C ATOM 427 CG1 VAL A 27 -15.205 26.742 19.889 1.00 0.00 C ATOM 428 CG2 VAL A 27 -16.275 26.289 17.696 1.00 0.00 C ATOM 0 H VAL A 27 -17.180 28.884 18.606 1.00 0.00 H new ATOM 0 HA VAL A 27 -14.202 28.988 18.369 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.196 26.709 17.963 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -15.176 25.663 20.042 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.354 27.203 20.390 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -16.130 27.143 20.303 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -16.189 25.226 17.919 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -17.234 26.659 18.058 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -16.212 26.440 16.618 1.00 0.00 H new ATOM 438 N TYR A 28 -14.613 28.467 15.726 1.00 0.00 N ATOM 439 CA TYR A 28 -14.769 28.734 14.315 1.00 0.00 C ATOM 440 C TYR A 28 -15.014 27.516 13.437 1.00 0.00 C ATOM 441 O TYR A 28 -14.396 26.465 13.625 1.00 0.00 O ATOM 442 CB TYR A 28 -13.622 29.583 13.760 1.00 0.00 C ATOM 443 CG TYR A 28 -12.431 29.791 14.658 1.00 0.00 C ATOM 444 CD1 TYR A 28 -11.603 28.712 14.982 1.00 0.00 C ATOM 445 CD2 TYR A 28 -12.149 31.069 15.169 1.00 0.00 C ATOM 446 CE1 TYR A 28 -10.521 28.906 15.846 1.00 0.00 C ATOM 447 CE2 TYR A 28 -11.054 31.270 16.020 1.00 0.00 C ATOM 448 CZ TYR A 28 -10.243 30.184 16.365 1.00 0.00 C ATOM 449 OH TYR A 28 -9.180 30.398 17.182 1.00 0.00 O ATOM 0 H TYR A 28 -13.808 27.879 15.941 1.00 0.00 H new ATOM 0 HA TYR A 28 -15.695 29.307 14.266 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -13.274 29.120 12.837 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -14.022 30.562 13.495 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -11.798 27.734 14.567 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -12.781 31.903 14.904 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -9.894 28.069 16.117 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -10.838 32.255 16.406 1.00 0.00 H new ATOM 0 HH TYR A 28 -9.005 31.360 17.246 1.00 0.00 H new ATOM 459 N MET A 29 -15.912 27.702 12.455 1.00 0.00 N ATOM 460 CA MET A 29 -16.253 26.685 11.468 1.00 0.00 C ATOM 461 C MET A 29 -15.178 26.782 10.373 1.00 0.00 C ATOM 462 O MET A 29 -15.088 27.795 9.673 1.00 0.00 O ATOM 463 CB MET A 29 -17.676 26.945 10.964 1.00 0.00 C ATOM 464 CG MET A 29 -18.442 25.849 10.216 1.00 0.00 C ATOM 465 SD MET A 29 -17.612 25.028 8.847 1.00 0.00 S ATOM 466 CE MET A 29 -16.980 23.610 9.750 1.00 0.00 C ATOM 0 H MET A 29 -16.423 28.576 12.330 1.00 0.00 H new ATOM 0 HA MET A 29 -16.258 25.670 11.865 1.00 0.00 H new ATOM 0 HB2 MET A 29 -18.278 27.228 11.828 1.00 0.00 H new ATOM 0 HB3 MET A 29 -17.632 27.814 10.308 1.00 0.00 H new ATOM 0 HG2 MET A 29 -18.727 25.086 10.940 1.00 0.00 H new ATOM 0 HG3 MET A 29 -19.364 26.287 9.834 1.00 0.00 H new ATOM 0 HE1 MET A 29 -16.191 23.131 9.170 1.00 0.00 H new ATOM 0 HE2 MET A 29 -16.577 23.939 10.708 1.00 0.00 H new ATOM 0 HE3 MET A 29 -17.788 22.898 9.921 1.00 0.00 H new ATOM 476 N PHE A 30 -14.331 25.750 10.275 1.00 0.00 N ATOM 477 CA PHE A 30 -13.171 25.630 9.439 1.00 0.00 C ATOM 478 C PHE A 30 -13.412 24.671 8.262 1.00 0.00 C ATOM 479 O PHE A 30 -13.943 23.580 8.469 1.00 0.00 O ATOM 480 CB PHE A 30 -12.064 25.069 10.364 1.00 0.00 C ATOM 481 CG PHE A 30 -10.706 25.801 10.244 1.00 0.00 C ATOM 482 CD1 PHE A 30 -10.504 27.168 10.590 1.00 0.00 C ATOM 483 CD2 PHE A 30 -9.597 25.081 9.759 1.00 0.00 C ATOM 484 CE1 PHE A 30 -9.228 27.749 10.427 1.00 0.00 C ATOM 485 CE2 PHE A 30 -8.333 25.669 9.612 1.00 0.00 C ATOM 486 CZ PHE A 30 -8.146 27.010 9.944 1.00 0.00 C ATOM 0 H PHE A 30 -14.469 24.911 10.838 1.00 0.00 H new ATOM 0 HA PHE A 30 -12.905 26.591 8.998 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -12.405 25.128 11.397 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -11.916 24.013 10.136 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -11.323 27.757 10.975 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -9.725 24.042 9.492 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -9.085 28.789 10.682 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -7.504 25.083 9.242 1.00 0.00 H new ATOM 0 HZ PHE A 30 -7.176 27.472 9.829 1.00 0.00 H new ATOM 496 N LEU A 31 -13.021 25.046 7.036 1.00 0.00 N ATOM 497 CA LEU A 31 -13.180 24.234 5.841 1.00 0.00 C ATOM 498 C LEU A 31 -11.857 23.644 5.382 1.00 0.00 C ATOM 499 O LEU A 31 -10.945 24.406 5.067 1.00 0.00 O ATOM 500 CB LEU A 31 -13.799 25.059 4.703 1.00 0.00 C ATOM 501 CG LEU A 31 -15.329 25.085 4.713 1.00 0.00 C ATOM 502 CD1 LEU A 31 -15.923 23.765 4.233 1.00 0.00 C ATOM 503 CD2 LEU A 31 -15.868 25.390 6.105 1.00 0.00 C ATOM 0 H LEU A 31 -12.576 25.945 6.853 1.00 0.00 H new ATOM 0 HA LEU A 31 -13.850 23.413 6.097 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -13.428 26.082 4.767 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -13.459 24.655 3.749 1.00 0.00 H new ATOM 0 HG LEU A 31 -15.627 25.877 4.026 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -17.011 23.826 4.256 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -15.592 23.566 3.214 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -15.591 22.958 4.886 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -16.958 25.401 6.079 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -15.530 24.623 6.802 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -15.503 26.364 6.431 1.00 0.00 H new ATOM 515 N VAL A 32 -11.753 22.304 5.307 1.00 0.00 N ATOM 516 CA VAL A 32 -10.553 21.669 4.807 1.00 0.00 C ATOM 517 C VAL A 32 -10.875 21.154 3.405 1.00 0.00 C ATOM 518 O VAL A 32 -11.935 20.560 3.189 1.00 0.00 O ATOM 519 CB VAL A 32 -9.995 20.600 5.753 1.00 0.00 C ATOM 520 CG1 VAL A 32 -11.051 19.814 6.523 1.00 0.00 C ATOM 521 CG2 VAL A 32 -9.085 19.624 5.001 1.00 0.00 C ATOM 0 H VAL A 32 -12.489 21.657 5.588 1.00 0.00 H new ATOM 0 HA VAL A 32 -9.736 22.389 4.752 1.00 0.00 H new ATOM 0 HB VAL A 32 -9.426 21.160 6.495 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -10.563 19.082 7.166 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -11.640 20.498 7.134 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -11.706 19.300 5.820 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -8.702 18.876 5.695 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -9.653 19.131 4.212 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -8.251 20.170 4.560 1.00 0.00 H new ATOM 531 N LYS A 33 -9.964 21.380 2.452 1.00 0.00 N ATOM 532 CA LYS A 33 -10.138 20.944 1.084 1.00 0.00 C ATOM 533 C LYS A 33 -9.106 19.866 0.797 1.00 0.00 C ATOM 534 O LYS A 33 -7.920 20.192 0.707 1.00 0.00 O ATOM 535 CB LYS A 33 -10.012 22.125 0.114 1.00 0.00 C ATOM 536 CG LYS A 33 -10.398 21.742 -1.325 1.00 0.00 C ATOM 537 CD LYS A 33 -11.920 21.650 -1.517 1.00 0.00 C ATOM 538 CE LYS A 33 -12.287 21.053 -2.882 1.00 0.00 C ATOM 539 NZ LYS A 33 -11.996 19.607 -2.954 1.00 0.00 N ATOM 0 H LYS A 33 -9.087 21.873 2.620 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.138 20.533 0.943 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -10.650 22.941 0.454 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -8.987 22.495 0.127 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -9.991 22.480 -2.016 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.944 20.784 -1.578 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -12.350 21.037 -0.725 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -12.359 22.644 -1.425 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.347 21.219 -3.076 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -11.734 21.573 -3.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.396 19.216 -3.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -10.967 19.459 -2.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -12.420 19.126 -2.135 1.00 0.00 H new ATOM 553 N TRP A 34 -9.524 18.599 0.640 1.00 0.00 N ATOM 554 CA TRP A 34 -8.553 17.576 0.329 1.00 0.00 C ATOM 555 C TRP A 34 -8.487 17.442 -1.192 1.00 0.00 C ATOM 556 O TRP A 34 -9.486 17.692 -1.870 1.00 0.00 O ATOM 557 CB TRP A 34 -8.878 16.253 1.009 1.00 0.00 C ATOM 558 CG TRP A 34 -8.806 16.183 2.498 1.00 0.00 C ATOM 559 CD1 TRP A 34 -9.714 16.666 3.369 1.00 0.00 C ATOM 560 CD2 TRP A 34 -7.768 15.568 3.309 1.00 0.00 C ATOM 561 NE1 TRP A 34 -9.308 16.402 4.665 1.00 0.00 N ATOM 562 CE2 TRP A 34 -8.104 15.722 4.684 1.00 0.00 C ATOM 563 CE3 TRP A 34 -6.570 14.893 3.009 1.00 0.00 C ATOM 564 CZ2 TRP A 34 -7.284 15.226 5.713 1.00 0.00 C ATOM 565 CZ3 TRP A 34 -5.747 14.391 4.026 1.00 0.00 C ATOM 566 CH2 TRP A 34 -6.097 14.555 5.375 1.00 0.00 C ATOM 0 H TRP A 34 -10.490 18.282 0.722 1.00 0.00 H new ATOM 0 HA TRP A 34 -7.575 17.864 0.716 1.00 0.00 H new ATOM 0 HB2 TRP A 34 -9.887 15.966 0.712 1.00 0.00 H new ATOM 0 HB3 TRP A 34 -8.201 15.499 0.608 1.00 0.00 H new ATOM 0 HD1 TRP A 34 -10.623 17.182 3.096 1.00 0.00 H new ATOM 0 HE1 TRP A 34 -9.829 16.674 5.499 1.00 0.00 H new ATOM 0 HE3 TRP A 34 -6.280 14.760 1.977 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 -7.563 15.359 6.748 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 -4.835 13.873 3.769 1.00 0.00 H new ATOM 0 HH2 TRP A 34 -5.455 14.166 6.152 1.00 0.00 H new ATOM 577 N GLN A 35 -7.322 17.047 -1.725 1.00 0.00 N ATOM 578 CA GLN A 35 -7.132 16.851 -3.170 1.00 0.00 C ATOM 579 C GLN A 35 -7.468 15.404 -3.568 1.00 0.00 C ATOM 580 O GLN A 35 -7.297 15.031 -4.725 1.00 0.00 O ATOM 581 CB GLN A 35 -5.679 17.263 -3.602 1.00 0.00 C ATOM 582 CG GLN A 35 -4.549 16.670 -2.749 1.00 0.00 C ATOM 583 CD GLN A 35 -4.415 15.156 -2.875 1.00 0.00 C ATOM 584 OE1 GLN A 35 -4.052 14.648 -3.931 1.00 0.00 O ATOM 585 NE2 GLN A 35 -4.686 14.433 -1.793 1.00 0.00 N ATOM 0 H GLN A 35 -6.488 16.855 -1.170 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.822 17.503 -3.706 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -5.526 16.962 -4.638 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -5.603 18.350 -3.572 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -3.606 17.134 -3.037 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.723 16.925 -1.704 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -4.985 14.894 -0.934 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -4.595 13.418 -1.822 1.00 0.00 H new ATOM 594 N ASP A 36 -7.949 14.609 -2.604 1.00 0.00 N ATOM 595 CA ASP A 36 -8.340 13.219 -2.730 1.00 0.00 C ATOM 596 C ASP A 36 -9.697 13.057 -2.044 1.00 0.00 C ATOM 597 O ASP A 36 -10.721 12.902 -2.709 1.00 0.00 O ATOM 598 CB ASP A 36 -7.214 12.376 -2.080 1.00 0.00 C ATOM 599 CG ASP A 36 -7.445 10.876 -2.035 1.00 0.00 C ATOM 600 OD1 ASP A 36 -8.509 10.418 -2.502 1.00 0.00 O ATOM 601 OD2 ASP A 36 -6.519 10.217 -1.512 1.00 0.00 O ATOM 0 H ASP A 36 -8.080 14.954 -1.653 1.00 0.00 H new ATOM 0 HA ASP A 36 -8.458 12.885 -3.761 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -6.287 12.564 -2.622 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.064 12.731 -1.060 1.00 0.00 H new ATOM 606 N LEU A 37 -9.711 13.132 -0.709 1.00 0.00 N ATOM 607 CA LEU A 37 -10.926 13.026 0.093 1.00 0.00 C ATOM 608 C LEU A 37 -11.954 14.122 -0.234 1.00 0.00 C ATOM 609 O LEU A 37 -13.093 14.023 0.223 1.00 0.00 O ATOM 610 CB LEU A 37 -10.611 13.014 1.587 1.00 0.00 C ATOM 611 CG LEU A 37 -9.956 11.728 2.168 1.00 0.00 C ATOM 612 CD1 LEU A 37 -8.510 11.576 1.703 1.00 0.00 C ATOM 613 CD2 LEU A 37 -10.003 11.805 3.684 1.00 0.00 C ATOM 0 H LEU A 37 -8.867 13.270 -0.152 1.00 0.00 H new ATOM 0 HA LEU A 37 -11.380 12.072 -0.173 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.950 13.854 1.799 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.539 13.194 2.129 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.509 10.859 1.810 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.085 10.667 2.128 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.482 11.515 0.615 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.929 12.437 2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -9.547 10.910 4.108 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.456 12.685 4.021 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -11.040 11.875 4.013 1.00 0.00 H new ATOM 625 N SER A 38 -11.583 15.147 -1.018 1.00 0.00 N ATOM 626 CA SER A 38 -12.478 16.227 -1.431 1.00 0.00 C ATOM 627 C SER A 38 -12.867 17.122 -0.241 1.00 0.00 C ATOM 628 O SER A 38 -12.156 17.171 0.763 1.00 0.00 O ATOM 629 CB SER A 38 -13.647 15.605 -2.255 1.00 0.00 C ATOM 630 OG SER A 38 -13.078 14.968 -3.384 1.00 0.00 O ATOM 0 H SER A 38 -10.637 15.245 -1.386 1.00 0.00 H new ATOM 0 HA SER A 38 -11.983 16.932 -2.100 1.00 0.00 H new ATOM 0 HB2 SER A 38 -14.204 14.889 -1.651 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.352 16.377 -2.565 1.00 0.00 H new ATOM 0 HG SER A 38 -13.789 14.564 -3.924 1.00 0.00 H new ATOM 636 N GLU A 39 -13.969 17.863 -0.369 1.00 0.00 N ATOM 637 CA GLU A 39 -14.498 18.804 0.604 1.00 0.00 C ATOM 638 C GLU A 39 -14.811 18.142 1.947 1.00 0.00 C ATOM 639 O GLU A 39 -15.570 17.182 1.971 1.00 0.00 O ATOM 640 CB GLU A 39 -15.808 19.462 0.049 1.00 0.00 C ATOM 641 CG GLU A 39 -16.598 18.629 -0.985 1.00 0.00 C ATOM 642 CD GLU A 39 -17.010 17.239 -0.492 1.00 0.00 C ATOM 643 OE1 GLU A 39 -18.088 17.149 0.130 1.00 0.00 O ATOM 644 OE2 GLU A 39 -16.233 16.286 -0.728 1.00 0.00 O ATOM 0 H GLU A 39 -14.547 17.815 -1.208 1.00 0.00 H new ATOM 0 HA GLU A 39 -13.727 19.557 0.770 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -16.466 19.680 0.890 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -15.547 20.417 -0.407 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -17.494 19.181 -1.271 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -15.992 18.518 -1.884 1.00 0.00 H new ATOM 651 N LYS A 40 -14.270 18.633 3.070 1.00 0.00 N ATOM 652 CA LYS A 40 -14.545 18.080 4.392 1.00 0.00 C ATOM 653 C LYS A 40 -14.608 19.280 5.333 1.00 0.00 C ATOM 654 O LYS A 40 -13.966 20.300 5.072 1.00 0.00 O ATOM 655 CB LYS A 40 -13.482 17.057 4.838 1.00 0.00 C ATOM 656 CG LYS A 40 -13.909 15.583 4.697 1.00 0.00 C ATOM 657 CD LYS A 40 -13.941 15.056 3.250 1.00 0.00 C ATOM 658 CE LYS A 40 -15.325 14.514 2.839 1.00 0.00 C ATOM 659 NZ LYS A 40 -15.534 14.560 1.375 1.00 0.00 N ATOM 0 H LYS A 40 -13.629 19.426 3.082 1.00 0.00 H new ATOM 0 HA LYS A 40 -15.480 17.520 4.392 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -12.576 17.216 4.253 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -13.227 17.249 5.880 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -13.226 14.964 5.279 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -14.900 15.463 5.135 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -13.654 15.858 2.570 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -13.199 14.265 3.140 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -15.428 13.486 3.186 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -16.102 15.097 3.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -16.425 14.079 1.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -15.581 15.551 1.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -14.744 14.083 0.896 1.00 0.00 H new ATOM 673 N VAL A 41 -15.396 19.188 6.409 1.00 0.00 N ATOM 674 CA VAL A 41 -15.588 20.284 7.327 1.00 0.00 C ATOM 675 C VAL A 41 -15.123 19.904 8.729 1.00 0.00 C ATOM 676 O VAL A 41 -15.247 18.740 9.100 1.00 0.00 O ATOM 677 CB VAL A 41 -17.050 20.738 7.230 1.00 0.00 C ATOM 678 CG1 VAL A 41 -17.582 20.611 5.789 1.00 0.00 C ATOM 679 CG2 VAL A 41 -17.961 20.022 8.229 1.00 0.00 C ATOM 0 H VAL A 41 -15.914 18.345 6.657 1.00 0.00 H new ATOM 0 HA VAL A 41 -14.969 21.141 7.063 1.00 0.00 H new ATOM 0 HB VAL A 41 -17.066 21.793 7.503 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -18.620 20.941 5.754 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -16.982 21.232 5.124 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -17.520 19.571 5.469 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -18.983 20.384 8.114 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -17.933 18.948 8.042 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -17.617 20.223 9.244 1.00 0.00 H new ATOM 689 N VAL A 42 -14.590 20.865 9.500 1.00 0.00 N ATOM 690 CA VAL A 42 -14.130 20.601 10.856 1.00 0.00 C ATOM 691 C VAL A 42 -14.333 21.844 11.714 1.00 0.00 C ATOM 692 O VAL A 42 -14.343 22.966 11.212 1.00 0.00 O ATOM 693 CB VAL A 42 -12.650 20.160 10.898 1.00 0.00 C ATOM 694 CG1 VAL A 42 -12.361 18.960 9.996 1.00 0.00 C ATOM 695 CG2 VAL A 42 -11.674 21.280 10.522 1.00 0.00 C ATOM 0 H VAL A 42 -14.470 21.832 9.198 1.00 0.00 H new ATOM 0 HA VAL A 42 -14.721 19.775 11.252 1.00 0.00 H new ATOM 0 HB VAL A 42 -12.491 19.881 11.939 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -11.306 18.697 10.068 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.969 18.112 10.312 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.602 19.214 8.964 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.652 20.904 10.572 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.886 21.623 9.509 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -11.789 22.111 11.218 1.00 0.00 H new ATOM 705 N TYR A 43 -14.497 21.640 13.018 1.00 0.00 N ATOM 706 CA TYR A 43 -14.729 22.672 13.993 1.00 0.00 C ATOM 707 C TYR A 43 -13.394 22.895 14.676 1.00 0.00 C ATOM 708 O TYR A 43 -12.714 21.909 14.964 1.00 0.00 O ATOM 709 CB TYR A 43 -15.798 22.186 14.967 1.00 0.00 C ATOM 710 CG TYR A 43 -16.968 21.451 14.226 1.00 0.00 C ATOM 711 CD1 TYR A 43 -16.832 20.140 13.687 1.00 0.00 C ATOM 712 CD2 TYR A 43 -18.222 22.072 14.025 1.00 0.00 C ATOM 713 CE1 TYR A 43 -17.883 19.508 13.006 1.00 0.00 C ATOM 714 CE2 TYR A 43 -19.271 21.437 13.345 1.00 0.00 C ATOM 715 CZ TYR A 43 -19.107 20.150 12.830 1.00 0.00 C ATOM 716 OH TYR A 43 -20.123 19.530 12.167 1.00 0.00 O ATOM 0 H TYR A 43 -14.469 20.707 13.430 1.00 0.00 H new ATOM 0 HA TYR A 43 -15.088 23.606 13.561 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.347 21.511 15.695 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -16.196 23.035 15.523 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -15.894 19.618 13.806 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -18.377 23.070 14.408 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -17.742 18.512 12.613 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -20.214 21.948 13.219 1.00 0.00 H new ATOM 0 HH TYR A 43 -20.904 20.122 12.138 1.00 0.00 H new ATOM 726 N ARG A 44 -13.005 24.148 14.916 1.00 0.00 N ATOM 727 CA ARG A 44 -11.716 24.434 15.544 1.00 0.00 C ATOM 728 C ARG A 44 -11.874 25.477 16.656 1.00 0.00 C ATOM 729 O ARG A 44 -12.526 26.490 16.435 1.00 0.00 O ATOM 730 CB ARG A 44 -10.708 24.941 14.491 1.00 0.00 C ATOM 731 CG ARG A 44 -10.238 23.965 13.398 1.00 0.00 C ATOM 732 CD ARG A 44 -9.294 22.854 13.877 1.00 0.00 C ATOM 733 NE ARG A 44 -10.054 21.797 14.547 1.00 0.00 N ATOM 734 CZ ARG A 44 -9.728 21.169 15.683 1.00 0.00 C ATOM 735 NH1 ARG A 44 -8.464 21.130 16.117 1.00 0.00 N ATOM 736 NH2 ARG A 44 -10.718 20.610 16.383 1.00 0.00 N ATOM 0 H ARG A 44 -13.559 24.974 14.687 1.00 0.00 H new ATOM 0 HA ARG A 44 -11.339 23.510 15.983 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -11.151 25.805 13.996 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -9.824 25.296 15.021 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -11.115 23.504 12.943 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -9.736 24.535 12.616 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -8.750 22.439 13.029 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -8.552 23.267 14.560 1.00 0.00 H new ATOM 0 HE ARG A 44 -10.925 21.509 14.100 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.726 21.585 15.579 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -8.238 20.646 16.986 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -11.679 20.671 16.046 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -10.514 20.121 17.255 1.00 0.00 H new ATOM 750 N ARG A 45 -11.273 25.257 17.837 1.00 0.00 N ATOM 751 CA ARG A 45 -11.285 26.176 18.969 1.00 0.00 C ATOM 752 C ARG A 45 -9.944 26.926 19.045 1.00 0.00 C ATOM 753 O ARG A 45 -8.930 26.461 18.521 1.00 0.00 O ATOM 754 CB ARG A 45 -11.421 25.380 20.278 1.00 0.00 C ATOM 755 CG ARG A 45 -12.752 24.641 20.445 1.00 0.00 C ATOM 756 CD ARG A 45 -12.592 23.175 20.854 1.00 0.00 C ATOM 757 NE ARG A 45 -11.741 22.998 22.040 1.00 0.00 N ATOM 758 CZ ARG A 45 -10.981 21.907 22.237 1.00 0.00 C ATOM 759 NH1 ARG A 45 -11.212 20.778 21.561 1.00 0.00 N ATOM 760 NH2 ARG A 45 -9.940 21.952 23.077 1.00 0.00 N ATOM 0 H ARG A 45 -10.750 24.403 18.028 1.00 0.00 H new ATOM 0 HA ARG A 45 -12.116 26.869 18.839 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -10.609 24.654 20.331 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -11.293 26.064 21.117 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -13.352 25.155 21.196 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -13.305 24.689 19.507 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -13.576 22.750 21.053 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -12.166 22.616 20.021 1.00 0.00 H new ATOM 0 HE ARG A 45 -11.727 23.736 22.744 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -11.974 20.736 20.884 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -10.626 19.958 21.722 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.720 22.817 23.571 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -9.366 21.121 23.223 1.00 0.00 H new ATOM 774 N PHE A 46 -9.908 28.076 19.731 1.00 0.00 N ATOM 775 CA PHE A 46 -8.669 28.825 19.891 1.00 0.00 C ATOM 776 C PHE A 46 -7.604 27.960 20.558 1.00 0.00 C ATOM 777 O PHE A 46 -6.498 27.808 20.046 1.00 0.00 O ATOM 778 CB PHE A 46 -8.919 30.165 20.585 1.00 0.00 C ATOM 779 CG PHE A 46 -9.721 30.184 21.870 1.00 0.00 C ATOM 780 CD1 PHE A 46 -9.101 29.915 23.106 1.00 0.00 C ATOM 781 CD2 PHE A 46 -11.095 30.491 21.832 1.00 0.00 C ATOM 782 CE1 PHE A 46 -9.848 29.951 24.294 1.00 0.00 C ATOM 783 CE2 PHE A 46 -11.840 30.530 23.021 1.00 0.00 C ATOM 784 CZ PHE A 46 -11.218 30.259 24.252 1.00 0.00 C ATOM 0 H PHE A 46 -10.720 28.500 20.179 1.00 0.00 H new ATOM 0 HA PHE A 46 -8.272 29.083 18.909 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -7.948 30.614 20.795 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -9.423 30.817 19.872 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -8.047 29.680 23.140 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.576 30.697 20.887 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -9.370 29.742 25.240 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -12.893 30.769 22.990 1.00 0.00 H new ATOM 0 HZ PHE A 46 -11.793 30.288 25.166 1.00 0.00 H new ATOM 794 N THR A 47 -7.981 27.364 21.684 1.00 0.00 N ATOM 795 CA THR A 47 -7.157 26.451 22.467 1.00 0.00 C ATOM 796 C THR A 47 -6.633 25.270 21.638 1.00 0.00 C ATOM 797 O THR A 47 -5.599 24.707 21.985 1.00 0.00 O ATOM 798 CB THR A 47 -7.932 25.999 23.722 1.00 0.00 C ATOM 799 OG1 THR A 47 -7.240 24.972 24.402 1.00 0.00 O ATOM 800 CG2 THR A 47 -9.341 25.487 23.411 1.00 0.00 C ATOM 0 H THR A 47 -8.905 27.509 22.092 1.00 0.00 H new ATOM 0 HA THR A 47 -6.265 26.987 22.791 1.00 0.00 H new ATOM 0 HB THR A 47 -8.015 26.891 24.343 1.00 0.00 H new ATOM 0 HG1 THR A 47 -7.750 24.703 25.195 1.00 0.00 H new ATOM 0 HG21 THR A 47 -9.831 25.185 24.337 1.00 0.00 H new ATOM 0 HG22 THR A 47 -9.919 26.279 22.936 1.00 0.00 H new ATOM 0 HG23 THR A 47 -9.277 24.631 22.739 1.00 0.00 H new ATOM 808 N GLU A 48 -7.311 24.898 20.546 1.00 0.00 N ATOM 809 CA GLU A 48 -6.902 23.818 19.674 1.00 0.00 C ATOM 810 C GLU A 48 -5.799 24.332 18.774 1.00 0.00 C ATOM 811 O GLU A 48 -4.764 23.682 18.654 1.00 0.00 O ATOM 812 CB GLU A 48 -8.058 23.342 18.804 1.00 0.00 C ATOM 813 CG GLU A 48 -9.040 22.434 19.546 1.00 0.00 C ATOM 814 CD GLU A 48 -8.505 21.016 19.728 1.00 0.00 C ATOM 815 OE1 GLU A 48 -8.033 20.463 18.711 1.00 0.00 O ATOM 816 OE2 GLU A 48 -8.606 20.506 20.867 1.00 0.00 O ATOM 0 H GLU A 48 -8.173 25.354 20.248 1.00 0.00 H new ATOM 0 HA GLU A 48 -6.563 22.981 20.284 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -8.595 24.209 18.420 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -7.659 22.807 17.943 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.259 22.864 20.523 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.980 22.396 18.996 1.00 0.00 H new ATOM 823 N ILE A 49 -6.009 25.501 18.154 1.00 0.00 N ATOM 824 CA ILE A 49 -4.956 26.071 17.321 1.00 0.00 C ATOM 825 C ILE A 49 -3.704 26.225 18.185 1.00 0.00 C ATOM 826 O ILE A 49 -2.602 25.906 17.752 1.00 0.00 O ATOM 827 CB ILE A 49 -5.348 27.423 16.698 1.00 0.00 C ATOM 828 CG1 ILE A 49 -6.250 27.243 15.470 1.00 0.00 C ATOM 829 CG2 ILE A 49 -4.080 28.153 16.239 1.00 0.00 C ATOM 830 CD1 ILE A 49 -7.720 27.078 15.815 1.00 0.00 C ATOM 0 H ILE A 49 -6.867 26.049 18.212 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.775 25.397 16.483 1.00 0.00 H new ATOM 0 HB ILE A 49 -5.887 27.990 17.457 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -6.134 28.106 14.814 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -5.917 26.370 14.909 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.352 29.111 15.797 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.427 28.321 17.095 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -3.559 27.546 15.498 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -8.297 26.956 14.899 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.849 26.198 16.445 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -8.070 27.962 16.349 1.00 0.00 H new ATOM 842 N TYR A 50 -3.880 26.720 19.410 1.00 0.00 N ATOM 843 CA TYR A 50 -2.784 26.935 20.334 1.00 0.00 C ATOM 844 C TYR A 50 -2.126 25.626 20.696 1.00 0.00 C ATOM 845 O TYR A 50 -0.910 25.551 20.640 1.00 0.00 O ATOM 846 CB TYR A 50 -3.292 27.658 21.581 1.00 0.00 C ATOM 847 CG TYR A 50 -4.029 28.973 21.249 1.00 0.00 C ATOM 848 CD1 TYR A 50 -3.843 29.623 20.000 1.00 0.00 C ATOM 849 CD2 TYR A 50 -4.922 29.561 22.170 1.00 0.00 C ATOM 850 CE1 TYR A 50 -4.512 30.812 19.693 1.00 0.00 C ATOM 851 CE2 TYR A 50 -5.586 30.759 21.861 1.00 0.00 C ATOM 852 CZ TYR A 50 -5.381 31.386 20.621 1.00 0.00 C ATOM 853 OH TYR A 50 -6.026 32.542 20.305 1.00 0.00 O ATOM 0 H TYR A 50 -4.792 26.982 19.784 1.00 0.00 H new ATOM 0 HA TYR A 50 -2.032 27.560 19.852 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -3.964 26.998 22.130 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -2.450 27.874 22.239 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -3.172 29.190 19.273 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -5.097 29.084 23.123 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -4.356 31.287 18.736 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.258 31.201 22.581 1.00 0.00 H new ATOM 0 HH TYR A 50 -6.596 32.814 21.054 1.00 0.00 H new ATOM 863 N GLU A 51 -2.907 24.610 21.054 1.00 0.00 N ATOM 864 CA GLU A 51 -2.338 23.309 21.394 1.00 0.00 C ATOM 865 C GLU A 51 -1.528 22.763 20.210 1.00 0.00 C ATOM 866 O GLU A 51 -0.407 22.295 20.395 1.00 0.00 O ATOM 867 CB GLU A 51 -3.411 22.328 21.886 1.00 0.00 C ATOM 868 CG GLU A 51 -2.775 21.028 22.392 1.00 0.00 C ATOM 869 CD GLU A 51 -3.810 20.125 23.053 1.00 0.00 C ATOM 870 OE1 GLU A 51 -4.259 20.496 24.159 1.00 0.00 O ATOM 871 OE2 GLU A 51 -4.129 19.080 22.445 1.00 0.00 O ATOM 0 H GLU A 51 -3.924 24.661 21.116 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.651 23.436 22.231 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -3.991 22.789 22.686 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.105 22.106 21.076 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.308 20.501 21.560 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.984 21.261 23.105 1.00 0.00 H new ATOM 878 N PHE A 52 -2.081 22.851 18.994 1.00 0.00 N ATOM 879 CA PHE A 52 -1.415 22.411 17.767 1.00 0.00 C ATOM 880 C PHE A 52 -0.080 23.107 17.649 1.00 0.00 C ATOM 881 O PHE A 52 0.980 22.487 17.625 1.00 0.00 O ATOM 882 CB PHE A 52 -2.218 22.777 16.501 1.00 0.00 C ATOM 883 CG PHE A 52 -1.402 22.647 15.180 1.00 0.00 C ATOM 884 CD1 PHE A 52 -0.562 23.657 14.609 1.00 0.00 C ATOM 885 CD2 PHE A 52 -1.488 21.428 14.488 1.00 0.00 C ATOM 886 CE1 PHE A 52 0.121 23.416 13.400 1.00 0.00 C ATOM 887 CE2 PHE A 52 -0.812 21.201 13.289 1.00 0.00 C ATOM 888 CZ PHE A 52 -0.008 22.197 12.731 1.00 0.00 C ATOM 0 H PHE A 52 -3.013 23.234 18.835 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.316 21.327 17.832 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -3.096 22.133 16.440 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.580 23.801 16.595 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -0.451 24.609 15.108 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.099 20.638 14.899 1.00 0.00 H new ATOM 0 HE1 PHE A 52 0.754 24.186 12.984 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.911 20.249 12.789 1.00 0.00 H new ATOM 0 HZ PHE A 52 0.506 22.027 11.797 1.00 0.00 H new ATOM 898 N HIS A 53 -0.172 24.425 17.536 1.00 0.00 N ATOM 899 CA HIS A 53 0.951 25.291 17.342 1.00 0.00 C ATOM 900 C HIS A 53 2.006 25.105 18.409 1.00 0.00 C ATOM 901 O HIS A 53 3.202 25.096 18.126 1.00 0.00 O ATOM 902 CB HIS A 53 0.430 26.722 17.225 1.00 0.00 C ATOM 903 CG HIS A 53 1.294 27.608 16.394 1.00 0.00 C ATOM 904 ND1 HIS A 53 2.185 27.053 15.511 1.00 0.00 N ATOM 905 CD2 HIS A 53 1.425 28.969 16.250 1.00 0.00 C ATOM 906 CE1 HIS A 53 2.775 28.048 14.866 1.00 0.00 C ATOM 907 NE2 HIS A 53 2.372 29.255 15.267 1.00 0.00 N ATOM 0 H HIS A 53 -1.062 24.922 17.580 1.00 0.00 H new ATOM 0 HA HIS A 53 1.469 25.038 16.417 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -0.572 26.701 16.796 1.00 0.00 H new ATOM 0 HB3 HIS A 53 0.340 27.149 18.224 1.00 0.00 H new ATOM 0 HD2 HIS A 53 0.876 29.708 16.815 1.00 0.00 H new ATOM 0 HE1 HIS A 53 3.511 27.897 14.090 1.00 0.00 H new ATOM 0 HE2 HIS A 53 2.682 30.168 14.934 1.00 0.00 H new ATOM 915 N LYS A 54 1.526 24.926 19.629 1.00 0.00 N ATOM 916 CA LYS A 54 2.386 24.676 20.770 1.00 0.00 C ATOM 917 C LYS A 54 3.125 23.360 20.567 1.00 0.00 C ATOM 918 O LYS A 54 4.315 23.267 20.847 1.00 0.00 O ATOM 919 CB LYS A 54 1.591 24.649 22.080 1.00 0.00 C ATOM 920 CG LYS A 54 1.385 26.056 22.657 1.00 0.00 C ATOM 921 CD LYS A 54 0.496 25.977 23.905 1.00 0.00 C ATOM 922 CE LYS A 54 0.483 27.289 24.702 1.00 0.00 C ATOM 923 NZ LYS A 54 -0.093 28.409 23.935 1.00 0.00 N ATOM 0 H LYS A 54 0.531 24.950 19.854 1.00 0.00 H new ATOM 0 HA LYS A 54 3.106 25.491 20.845 1.00 0.00 H new ATOM 0 HB2 LYS A 54 0.621 24.183 21.906 1.00 0.00 H new ATOM 0 HB3 LYS A 54 2.115 24.031 22.809 1.00 0.00 H new ATOM 0 HG2 LYS A 54 2.347 26.500 22.912 1.00 0.00 H new ATOM 0 HG3 LYS A 54 0.924 26.702 21.910 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -0.522 25.727 23.607 1.00 0.00 H new ATOM 0 HD3 LYS A 54 0.848 25.169 24.547 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -0.090 27.148 25.619 1.00 0.00 H new ATOM 0 HE3 LYS A 54 1.501 27.541 24.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 0.611 29.169 23.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -0.363 28.078 22.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -0.934 28.771 24.428 1.00 0.00 H new ATOM 937 N THR A 55 2.417 22.348 20.071 1.00 0.00 N ATOM 938 CA THR A 55 3.012 21.038 19.848 1.00 0.00 C ATOM 939 C THR A 55 4.051 21.130 18.752 1.00 0.00 C ATOM 940 O THR A 55 5.126 20.558 18.880 1.00 0.00 O ATOM 941 CB THR A 55 1.917 19.991 19.608 1.00 0.00 C ATOM 942 OG1 THR A 55 1.063 19.938 20.731 1.00 0.00 O ATOM 943 CG2 THR A 55 2.477 18.598 19.369 1.00 0.00 C ATOM 0 H THR A 55 1.431 22.413 19.817 1.00 0.00 H new ATOM 0 HA THR A 55 3.544 20.699 20.737 1.00 0.00 H new ATOM 0 HB THR A 55 1.378 20.297 18.711 1.00 0.00 H new ATOM 0 HG1 THR A 55 0.470 20.718 20.728 1.00 0.00 H new ATOM 0 HG21 THR A 55 1.657 17.899 19.205 1.00 0.00 H new ATOM 0 HG22 THR A 55 3.123 18.611 18.491 1.00 0.00 H new ATOM 0 HG23 THR A 55 3.053 18.283 20.239 1.00 0.00 H new ATOM 951 N LEU A 56 3.759 21.873 17.690 1.00 0.00 N ATOM 952 CA LEU A 56 4.715 22.061 16.617 1.00 0.00 C ATOM 953 C LEU A 56 5.978 22.668 17.189 1.00 0.00 C ATOM 954 O LEU A 56 7.064 22.165 16.949 1.00 0.00 O ATOM 955 CB LEU A 56 4.127 22.970 15.523 1.00 0.00 C ATOM 956 CG LEU A 56 4.825 23.075 14.163 1.00 0.00 C ATOM 957 CD1 LEU A 56 6.140 23.831 14.239 1.00 0.00 C ATOM 958 CD2 LEU A 56 5.145 21.751 13.449 1.00 0.00 C ATOM 0 H LEU A 56 2.869 22.352 17.554 1.00 0.00 H new ATOM 0 HA LEU A 56 4.946 21.098 16.162 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.105 22.638 15.339 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.066 23.977 15.935 1.00 0.00 H new ATOM 0 HG LEU A 56 4.068 23.603 13.584 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.592 23.876 13.248 1.00 0.00 H new ATOM 0 HD12 LEU A 56 5.958 24.843 14.600 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.816 23.318 14.923 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.637 21.960 12.499 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.805 21.150 14.075 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.220 21.204 13.266 1.00 0.00 H new ATOM 970 N LYS A 57 5.836 23.747 17.949 1.00 0.00 N ATOM 971 CA LYS A 57 6.973 24.434 18.524 1.00 0.00 C ATOM 972 C LYS A 57 7.724 23.603 19.564 1.00 0.00 C ATOM 973 O LYS A 57 8.917 23.818 19.770 1.00 0.00 O ATOM 974 CB LYS A 57 6.471 25.758 19.115 1.00 0.00 C ATOM 975 CG LYS A 57 5.960 26.715 18.022 1.00 0.00 C ATOM 976 CD LYS A 57 5.308 27.995 18.562 1.00 0.00 C ATOM 977 CE LYS A 57 5.143 28.999 17.406 1.00 0.00 C ATOM 978 NZ LYS A 57 4.225 30.114 17.723 1.00 0.00 N ATOM 0 H LYS A 57 4.934 24.164 18.180 1.00 0.00 H new ATOM 0 HA LYS A 57 7.705 24.617 17.737 1.00 0.00 H new ATOM 0 HB2 LYS A 57 5.670 25.558 19.826 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.278 26.237 19.670 1.00 0.00 H new ATOM 0 HG2 LYS A 57 6.794 26.990 17.376 1.00 0.00 H new ATOM 0 HG3 LYS A 57 5.237 26.186 17.401 1.00 0.00 H new ATOM 0 HD2 LYS A 57 4.338 27.766 19.003 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.923 28.427 19.351 1.00 0.00 H new ATOM 0 HE2 LYS A 57 6.120 29.406 17.146 1.00 0.00 H new ATOM 0 HE3 LYS A 57 4.772 28.472 16.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.604 30.295 16.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 3.647 29.863 18.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 4.778 30.969 17.934 1.00 0.00 H new ATOM 992 N GLU A 58 7.035 22.663 20.210 1.00 0.00 N ATOM 993 CA GLU A 58 7.614 21.804 21.225 1.00 0.00 C ATOM 994 C GLU A 58 8.421 20.714 20.539 1.00 0.00 C ATOM 995 O GLU A 58 9.609 20.559 20.815 1.00 0.00 O ATOM 996 CB GLU A 58 6.516 21.187 22.122 1.00 0.00 C ATOM 997 CG GLU A 58 6.001 22.277 23.113 1.00 0.00 C ATOM 998 CD GLU A 58 6.852 22.289 24.378 1.00 0.00 C ATOM 999 OE1 GLU A 58 6.731 21.311 25.149 1.00 0.00 O ATOM 1000 OE2 GLU A 58 7.608 23.269 24.552 1.00 0.00 O ATOM 0 H GLU A 58 6.047 22.480 20.036 1.00 0.00 H new ATOM 0 HA GLU A 58 8.266 22.395 21.869 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.694 20.815 21.510 1.00 0.00 H new ATOM 0 HB3 GLU A 58 6.914 20.335 22.673 1.00 0.00 H new ATOM 0 HG2 GLU A 58 6.034 23.256 22.636 1.00 0.00 H new ATOM 0 HG3 GLU A 58 4.960 22.082 23.369 1.00 0.00 H new ATOM 1007 N MET A 59 7.776 19.961 19.642 1.00 0.00 N ATOM 1008 CA MET A 59 8.447 18.898 18.929 1.00 0.00 C ATOM 1009 C MET A 59 9.550 19.477 18.048 1.00 0.00 C ATOM 1010 O MET A 59 10.692 19.026 18.112 1.00 0.00 O ATOM 1011 CB MET A 59 7.454 18.104 18.081 1.00 0.00 C ATOM 1012 CG MET A 59 6.213 17.499 18.763 1.00 0.00 C ATOM 1013 SD MET A 59 5.039 16.685 17.638 1.00 0.00 S ATOM 1014 CE MET A 59 4.681 18.011 16.450 1.00 0.00 C ATOM 0 H MET A 59 6.792 20.077 19.401 1.00 0.00 H new ATOM 0 HA MET A 59 8.893 18.220 19.657 1.00 0.00 H new ATOM 0 HB2 MET A 59 7.105 18.758 17.282 1.00 0.00 H new ATOM 0 HB3 MET A 59 8.002 17.288 17.609 1.00 0.00 H new ATOM 0 HG2 MET A 59 6.543 16.774 19.507 1.00 0.00 H new ATOM 0 HG3 MET A 59 5.690 18.290 19.300 1.00 0.00 H new ATOM 0 HE1 MET A 59 3.848 17.714 15.813 1.00 0.00 H new ATOM 0 HE2 MET A 59 4.419 18.921 16.989 1.00 0.00 H new ATOM 0 HE3 MET A 59 5.561 18.195 15.834 1.00 0.00 H new ATOM 1024 N PHE A 60 9.203 20.473 17.227 1.00 0.00 N ATOM 1025 CA PHE A 60 10.114 21.132 16.328 1.00 0.00 C ATOM 1026 C PHE A 60 10.561 22.499 16.898 1.00 0.00 C ATOM 1027 O PHE A 60 9.900 23.495 16.601 1.00 0.00 O ATOM 1028 CB PHE A 60 9.397 21.372 15.000 1.00 0.00 C ATOM 1029 CG PHE A 60 8.930 20.109 14.214 1.00 0.00 C ATOM 1030 CD1 PHE A 60 7.709 19.426 14.481 1.00 0.00 C ATOM 1031 CD2 PHE A 60 9.734 19.587 13.174 1.00 0.00 C ATOM 1032 CE1 PHE A 60 7.334 18.293 13.729 1.00 0.00 C ATOM 1033 CE2 PHE A 60 9.358 18.457 12.430 1.00 0.00 C ATOM 1034 CZ PHE A 60 8.153 17.807 12.705 1.00 0.00 C ATOM 0 H PHE A 60 8.253 20.842 17.179 1.00 0.00 H new ATOM 0 HA PHE A 60 10.993 20.502 16.194 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.523 21.994 15.194 1.00 0.00 H new ATOM 0 HB3 PHE A 60 10.061 21.947 14.355 1.00 0.00 H new ATOM 0 HD1 PHE A 60 7.062 19.780 15.270 1.00 0.00 H new ATOM 0 HD2 PHE A 60 10.670 20.075 12.944 1.00 0.00 H new ATOM 0 HE1 PHE A 60 6.401 17.794 13.947 1.00 0.00 H new ATOM 0 HE2 PHE A 60 10.002 18.090 11.644 1.00 0.00 H new ATOM 0 HZ PHE A 60 7.857 16.939 12.134 1.00 0.00 H new ATOM 1044 N PRO A 61 11.657 22.648 17.671 1.00 0.00 N ATOM 1045 CA PRO A 61 12.051 23.976 18.125 1.00 0.00 C ATOM 1046 C PRO A 61 12.709 24.740 16.970 1.00 0.00 C ATOM 1047 O PRO A 61 12.821 25.958 17.016 1.00 0.00 O ATOM 1048 CB PRO A 61 13.004 23.747 19.294 1.00 0.00 C ATOM 1049 CG PRO A 61 13.687 22.435 18.928 1.00 0.00 C ATOM 1050 CD PRO A 61 12.623 21.663 18.142 1.00 0.00 C ATOM 0 HA PRO A 61 11.205 24.583 18.447 1.00 0.00 H new ATOM 0 HB2 PRO A 61 13.722 24.561 19.395 1.00 0.00 H new ATOM 0 HB3 PRO A 61 12.470 23.673 20.241 1.00 0.00 H new ATOM 0 HG2 PRO A 61 14.580 22.605 18.327 1.00 0.00 H new ATOM 0 HG3 PRO A 61 14.000 21.888 19.817 1.00 0.00 H new ATOM 0 HD2 PRO A 61 13.072 21.129 17.304 1.00 0.00 H new ATOM 0 HD3 PRO A 61 12.140 20.917 18.773 1.00 0.00 H new ATOM 1058 N ILE A 62 13.120 24.021 15.921 1.00 0.00 N ATOM 1059 CA ILE A 62 13.725 24.541 14.713 1.00 0.00 C ATOM 1060 C ILE A 62 12.666 25.322 13.955 1.00 0.00 C ATOM 1061 O ILE A 62 12.923 26.437 13.503 1.00 0.00 O ATOM 1062 CB ILE A 62 14.236 23.386 13.848 1.00 0.00 C ATOM 1063 CG1 ILE A 62 15.196 22.423 14.573 1.00 0.00 C ATOM 1064 CG2 ILE A 62 14.803 23.875 12.526 1.00 0.00 C ATOM 1065 CD1 ILE A 62 16.420 23.112 15.184 1.00 0.00 C ATOM 0 H ILE A 62 13.030 23.005 15.901 1.00 0.00 H new ATOM 0 HA ILE A 62 14.567 25.187 14.961 1.00 0.00 H new ATOM 0 HB ILE A 62 13.354 22.785 13.628 1.00 0.00 H new ATOM 0 HG12 ILE A 62 14.650 21.907 15.362 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.533 21.662 13.869 1.00 0.00 H new ATOM 0 HG21 ILE A 62 15.154 23.023 11.943 1.00 0.00 H new ATOM 0 HG22 ILE A 62 14.027 24.400 11.969 1.00 0.00 H new ATOM 0 HG23 ILE A 62 15.635 24.553 12.716 1.00 0.00 H new ATOM 0 HD11 ILE A 62 17.048 22.369 15.676 1.00 0.00 H new ATOM 0 HD12 ILE A 62 16.991 23.605 14.397 1.00 0.00 H new ATOM 0 HD13 ILE A 62 16.094 23.853 15.914 1.00 0.00 H new ATOM 1077 N GLU A 63 11.458 24.749 13.851 1.00 0.00 N ATOM 1078 CA GLU A 63 10.348 25.427 13.200 1.00 0.00 C ATOM 1079 C GLU A 63 10.010 26.712 13.968 1.00 0.00 C ATOM 1080 O GLU A 63 9.213 27.519 13.489 1.00 0.00 O ATOM 1081 CB GLU A 63 9.110 24.530 13.150 1.00 0.00 C ATOM 1082 CG GLU A 63 9.238 23.251 12.303 1.00 0.00 C ATOM 1083 CD GLU A 63 8.834 23.421 10.842 1.00 0.00 C ATOM 1084 OE1 GLU A 63 7.678 23.841 10.601 1.00 0.00 O ATOM 1085 OE2 GLU A 63 9.676 23.085 9.982 1.00 0.00 O ATOM 0 H GLU A 63 11.234 23.821 14.211 1.00 0.00 H new ATOM 0 HA GLU A 63 10.645 25.667 12.179 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.852 24.243 14.169 1.00 0.00 H new ATOM 0 HB3 GLU A 63 8.276 25.116 12.764 1.00 0.00 H new ATOM 0 HG2 GLU A 63 10.271 22.904 12.344 1.00 0.00 H new ATOM 0 HG3 GLU A 63 8.622 22.471 12.750 1.00 0.00 H new ATOM 1092 N ALA A 64 10.612 26.902 15.154 1.00 0.00 N ATOM 1093 CA ALA A 64 10.420 28.053 16.001 1.00 0.00 C ATOM 1094 C ALA A 64 11.751 28.621 16.459 1.00 0.00 C ATOM 1095 O ALA A 64 11.854 29.173 17.553 1.00 0.00 O ATOM 1096 CB ALA A 64 9.555 27.638 17.184 1.00 0.00 C ATOM 0 H ALA A 64 11.265 26.225 15.548 1.00 0.00 H new ATOM 0 HA ALA A 64 9.918 28.844 15.444 1.00 0.00 H new ATOM 0 HB1 ALA A 64 9.398 28.496 17.838 1.00 0.00 H new ATOM 0 HB2 ALA A 64 8.593 27.276 16.822 1.00 0.00 H new ATOM 0 HB3 ALA A 64 10.055 26.845 17.740 1.00 0.00 H new ATOM 1102 N GLY A 65 12.771 28.479 15.611 1.00 0.00 N ATOM 1103 CA GLY A 65 14.097 28.948 15.914 1.00 0.00 C ATOM 1104 C GLY A 65 14.890 29.203 14.657 1.00 0.00 C ATOM 1105 O GLY A 65 15.382 30.312 14.463 1.00 0.00 O ATOM 0 H GLY A 65 12.687 28.033 14.697 1.00 0.00 H new ATOM 0 HA2 GLY A 65 14.035 29.865 16.500 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.614 28.211 16.529 1.00 0.00 H new ATOM 1109 N ALA A 66 14.999 28.191 13.794 1.00 0.00 N ATOM 1110 CA ALA A 66 15.703 28.361 12.543 1.00 0.00 C ATOM 1111 C ALA A 66 14.770 28.956 11.509 1.00 0.00 C ATOM 1112 O ALA A 66 15.222 29.543 10.531 1.00 0.00 O ATOM 1113 CB ALA A 66 16.315 27.052 12.052 1.00 0.00 C ATOM 0 H ALA A 66 14.611 27.260 13.945 1.00 0.00 H new ATOM 0 HA ALA A 66 16.532 29.049 12.707 1.00 0.00 H new ATOM 0 HB1 ALA A 66 16.835 27.224 11.109 1.00 0.00 H new ATOM 0 HB2 ALA A 66 17.022 26.680 12.794 1.00 0.00 H new ATOM 0 HB3 ALA A 66 15.526 26.315 11.902 1.00 0.00 H new ATOM 1119 N ILE A 67 13.469 28.790 11.753 1.00 0.00 N ATOM 1120 CA ILE A 67 12.417 29.279 10.876 1.00 0.00 C ATOM 1121 C ILE A 67 11.693 30.454 11.521 1.00 0.00 C ATOM 1122 O ILE A 67 10.704 30.943 10.996 1.00 0.00 O ATOM 1123 CB ILE A 67 11.514 28.098 10.480 1.00 0.00 C ATOM 1124 CG1 ILE A 67 12.434 26.913 10.091 1.00 0.00 C ATOM 1125 CG2 ILE A 67 10.606 28.462 9.300 1.00 0.00 C ATOM 1126 CD1 ILE A 67 11.750 25.743 9.391 1.00 0.00 C ATOM 0 H ILE A 67 13.117 28.305 12.578 1.00 0.00 H new ATOM 0 HA ILE A 67 12.826 29.680 9.949 1.00 0.00 H new ATOM 0 HB ILE A 67 10.869 27.834 11.318 1.00 0.00 H new ATOM 0 HG12 ILE A 67 13.224 27.289 9.441 1.00 0.00 H new ATOM 0 HG13 ILE A 67 12.916 26.540 10.995 1.00 0.00 H new ATOM 0 HG21 ILE A 67 9.981 27.607 9.045 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.973 29.305 9.575 1.00 0.00 H new ATOM 0 HG23 ILE A 67 11.218 28.733 8.440 1.00 0.00 H new ATOM 0 HD11 ILE A 67 12.487 24.972 9.166 1.00 0.00 H new ATOM 0 HD12 ILE A 67 10.980 25.329 10.042 1.00 0.00 H new ATOM 0 HD13 ILE A 67 11.293 26.090 8.464 1.00 0.00 H new ATOM 1138 N ASN A 68 12.200 30.953 12.646 1.00 0.00 N ATOM 1139 CA ASN A 68 11.569 32.084 13.318 1.00 0.00 C ATOM 1140 C ASN A 68 12.041 33.464 12.863 1.00 0.00 C ATOM 1141 O ASN A 68 11.181 34.289 12.585 1.00 0.00 O ATOM 1142 CB ASN A 68 11.563 31.923 14.845 1.00 0.00 C ATOM 1143 CG ASN A 68 10.134 31.898 15.387 1.00 0.00 C ATOM 1144 OD1 ASN A 68 9.807 32.608 16.334 1.00 0.00 O ATOM 1145 ND2 ASN A 68 9.268 31.090 14.770 1.00 0.00 N ATOM 0 H ASN A 68 13.037 30.596 13.107 1.00 0.00 H new ATOM 0 HA ASN A 68 10.531 32.051 12.986 1.00 0.00 H new ATOM 0 HB2 ASN A 68 12.076 31.001 15.119 1.00 0.00 H new ATOM 0 HB3 ASN A 68 12.115 32.744 15.303 1.00 0.00 H new ATOM 0 HD21 ASN A 68 8.298 31.048 15.082 1.00 0.00 H new ATOM 0 HD22 ASN A 68 9.577 30.515 13.986 1.00 0.00 H new ATOM 1152 N PRO A 69 13.336 33.782 12.766 1.00 0.00 N ATOM 1153 CA PRO A 69 13.769 35.103 12.344 1.00 0.00 C ATOM 1154 C PRO A 69 13.612 35.354 10.853 1.00 0.00 C ATOM 1155 O PRO A 69 13.077 36.383 10.442 1.00 0.00 O ATOM 1156 CB PRO A 69 15.218 35.216 12.817 1.00 0.00 C ATOM 1157 CG PRO A 69 15.716 33.767 12.812 1.00 0.00 C ATOM 1158 CD PRO A 69 14.460 32.933 13.085 1.00 0.00 C ATOM 0 HA PRO A 69 13.138 35.876 12.783 1.00 0.00 H new ATOM 0 HB2 PRO A 69 15.809 35.845 12.151 1.00 0.00 H new ATOM 0 HB3 PRO A 69 15.281 35.658 13.811 1.00 0.00 H new ATOM 0 HG2 PRO A 69 16.167 33.505 11.855 1.00 0.00 H new ATOM 0 HG3 PRO A 69 16.475 33.605 13.577 1.00 0.00 H new ATOM 0 HD2 PRO A 69 14.452 32.030 12.474 1.00 0.00 H new ATOM 0 HD3 PRO A 69 14.423 32.614 14.127 1.00 0.00 H new ATOM 1166 N GLU A 70 14.082 34.410 10.051 1.00 0.00 N ATOM 1167 CA GLU A 70 14.012 34.495 8.601 1.00 0.00 C ATOM 1168 C GLU A 70 12.557 34.500 8.152 1.00 0.00 C ATOM 1169 O GLU A 70 12.197 35.214 7.218 1.00 0.00 O ATOM 1170 CB GLU A 70 14.788 33.290 7.978 1.00 0.00 C ATOM 1171 CG GLU A 70 14.110 31.912 8.295 1.00 0.00 C ATOM 1172 CD GLU A 70 13.344 31.330 7.107 1.00 0.00 C ATOM 1173 OE1 GLU A 70 12.886 32.126 6.260 1.00 0.00 O ATOM 1174 OE2 GLU A 70 13.212 30.088 7.080 1.00 0.00 O ATOM 0 H GLU A 70 14.526 33.557 10.392 1.00 0.00 H new ATOM 0 HA GLU A 70 14.473 35.422 8.260 1.00 0.00 H new ATOM 0 HB2 GLU A 70 14.850 33.421 6.898 1.00 0.00 H new ATOM 0 HB3 GLU A 70 15.810 33.285 8.357 1.00 0.00 H new ATOM 0 HG2 GLU A 70 14.875 31.202 8.609 1.00 0.00 H new ATOM 0 HG3 GLU A 70 13.426 32.036 9.135 1.00 0.00 H new ATOM 1181 N ASN A 71 11.738 33.707 8.847 1.00 0.00 N ATOM 1182 CA ASN A 71 10.325 33.576 8.576 1.00 0.00 C ATOM 1183 C ASN A 71 9.534 34.174 9.734 1.00 0.00 C ATOM 1184 O ASN A 71 8.548 33.584 10.172 1.00 0.00 O ATOM 1185 CB ASN A 71 9.964 32.093 8.300 1.00 0.00 C ATOM 1186 CG ASN A 71 9.019 31.934 7.122 1.00 0.00 C ATOM 1187 OD1 ASN A 71 9.370 32.192 5.974 1.00 0.00 O ATOM 1188 ND2 ASN A 71 7.799 31.495 7.409 1.00 0.00 N ATOM 0 H ASN A 71 12.056 33.131 9.627 1.00 0.00 H new ATOM 0 HA ASN A 71 10.060 34.130 7.675 1.00 0.00 H new ATOM 0 HB2 ASN A 71 10.877 31.530 8.108 1.00 0.00 H new ATOM 0 HB3 ASN A 71 9.506 31.662 9.190 1.00 0.00 H new ATOM 0 HD21 ASN A 71 7.116 31.361 6.663 1.00 0.00 H new ATOM 0 HD22 ASN A 71 7.545 31.291 8.376 1.00 0.00 H new ATOM 1195 N ARG A 72 9.950 35.363 10.206 1.00 0.00 N ATOM 1196 CA ARG A 72 9.258 36.092 11.277 1.00 0.00 C ATOM 1197 C ARG A 72 7.899 36.681 10.841 1.00 0.00 C ATOM 1198 O ARG A 72 7.651 37.879 10.961 1.00 0.00 O ATOM 1199 CB ARG A 72 10.162 37.161 11.916 1.00 0.00 C ATOM 1200 CG ARG A 72 9.650 37.518 13.319 1.00 0.00 C ATOM 1201 CD ARG A 72 10.540 38.565 13.991 1.00 0.00 C ATOM 1202 NE ARG A 72 10.008 38.909 15.318 1.00 0.00 N ATOM 1203 CZ ARG A 72 10.572 39.775 16.174 1.00 0.00 C ATOM 1204 NH1 ARG A 72 11.714 40.398 15.850 1.00 0.00 N ATOM 1205 NH2 ARG A 72 9.990 40.014 17.356 1.00 0.00 N ATOM 0 H ARG A 72 10.777 35.844 9.853 1.00 0.00 H new ATOM 0 HA ARG A 72 9.029 35.349 12.041 1.00 0.00 H new ATOM 0 HB2 ARG A 72 11.186 36.792 11.977 1.00 0.00 H new ATOM 0 HB3 ARG A 72 10.181 38.053 11.290 1.00 0.00 H new ATOM 0 HG2 ARG A 72 8.630 37.896 13.250 1.00 0.00 H new ATOM 0 HG3 ARG A 72 9.616 36.619 13.935 1.00 0.00 H new ATOM 0 HD2 ARG A 72 11.556 38.182 14.087 1.00 0.00 H new ATOM 0 HD3 ARG A 72 10.594 39.459 13.370 1.00 0.00 H new ATOM 0 HE ARG A 72 9.143 38.454 15.611 1.00 0.00 H new ATOM 0 HH11 ARG A 72 12.157 40.214 14.950 1.00 0.00 H new ATOM 0 HH12 ARG A 72 12.139 41.056 16.504 1.00 0.00 H new ATOM 0 HH21 ARG A 72 9.122 39.539 17.602 1.00 0.00 H new ATOM 0 HH22 ARG A 72 10.415 40.671 18.010 1.00 0.00 H new ATOM 1219 N ILE A 73 7.009 35.809 10.365 1.00 0.00 N ATOM 1220 CA ILE A 73 5.638 36.046 9.947 1.00 0.00 C ATOM 1221 C ILE A 73 4.730 34.954 10.547 1.00 0.00 C ATOM 1222 O ILE A 73 3.510 35.056 10.447 1.00 0.00 O ATOM 1223 CB ILE A 73 5.512 36.156 8.413 1.00 0.00 C ATOM 1224 CG1 ILE A 73 6.180 35.002 7.639 1.00 0.00 C ATOM 1225 CG2 ILE A 73 5.982 37.533 7.924 1.00 0.00 C ATOM 1226 CD1 ILE A 73 7.624 35.270 7.194 1.00 0.00 C ATOM 0 H ILE A 73 7.260 34.827 10.254 1.00 0.00 H new ATOM 0 HA ILE A 73 5.308 37.012 10.330 1.00 0.00 H new ATOM 0 HB ILE A 73 4.450 36.056 8.189 1.00 0.00 H new ATOM 0 HG12 ILE A 73 6.168 34.110 8.265 1.00 0.00 H new ATOM 0 HG13 ILE A 73 5.579 34.780 6.757 1.00 0.00 H new ATOM 0 HG21 ILE A 73 5.884 37.587 6.840 1.00 0.00 H new ATOM 0 HG22 ILE A 73 5.371 38.310 8.383 1.00 0.00 H new ATOM 0 HG23 ILE A 73 7.026 37.681 8.202 1.00 0.00 H new ATOM 0 HD11 ILE A 73 8.007 34.401 6.658 1.00 0.00 H new ATOM 0 HD12 ILE A 73 7.647 36.140 6.538 1.00 0.00 H new ATOM 0 HD13 ILE A 73 8.245 35.459 8.069 1.00 0.00 H new ATOM 1238 N ILE A 74 5.301 33.917 11.191 1.00 0.00 N ATOM 1239 CA ILE A 74 4.558 32.850 11.850 1.00 0.00 C ATOM 1240 C ILE A 74 3.824 33.510 13.022 1.00 0.00 C ATOM 1241 O ILE A 74 4.439 34.313 13.723 1.00 0.00 O ATOM 1242 CB ILE A 74 5.520 31.762 12.366 1.00 0.00 C ATOM 1243 CG1 ILE A 74 6.384 31.141 11.253 1.00 0.00 C ATOM 1244 CG2 ILE A 74 4.721 30.639 13.044 1.00 0.00 C ATOM 1245 CD1 ILE A 74 7.719 30.656 11.825 1.00 0.00 C ATOM 0 H ILE A 74 6.312 33.805 11.263 1.00 0.00 H new ATOM 0 HA ILE A 74 3.864 32.366 11.163 1.00 0.00 H new ATOM 0 HB ILE A 74 6.189 32.253 13.073 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.853 30.307 10.794 1.00 0.00 H new ATOM 0 HG13 ILE A 74 6.562 31.876 10.469 1.00 0.00 H new ATOM 0 HG21 ILE A 74 5.406 29.873 13.407 1.00 0.00 H new ATOM 0 HG22 ILE A 74 4.158 31.048 13.883 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.031 30.198 12.325 1.00 0.00 H new ATOM 0 HD11 ILE A 74 8.320 30.219 11.027 1.00 0.00 H new ATOM 0 HD12 ILE A 74 8.255 31.498 12.263 1.00 0.00 H new ATOM 0 HD13 ILE A 74 7.534 29.905 12.593 1.00 0.00 H new ATOM 1257 N PRO A 75 2.537 33.221 13.263 1.00 0.00 N ATOM 1258 CA PRO A 75 1.819 33.868 14.341 1.00 0.00 C ATOM 1259 C PRO A 75 2.362 33.482 15.729 1.00 0.00 C ATOM 1260 O PRO A 75 2.776 32.341 15.952 1.00 0.00 O ATOM 1261 CB PRO A 75 0.356 33.451 14.185 1.00 0.00 C ATOM 1262 CG PRO A 75 0.460 32.114 13.464 1.00 0.00 C ATOM 1263 CD PRO A 75 1.661 32.316 12.541 1.00 0.00 C ATOM 0 HA PRO A 75 1.939 34.950 14.280 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -0.141 33.352 15.150 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -0.212 34.179 13.606 1.00 0.00 H new ATOM 0 HG2 PRO A 75 0.620 31.291 14.160 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.446 31.886 12.903 1.00 0.00 H new ATOM 0 HD2 PRO A 75 2.159 31.370 12.327 1.00 0.00 H new ATOM 0 HD3 PRO A 75 1.357 32.740 11.584 1.00 0.00 H new ATOM 1271 N HIS A 76 2.341 34.429 16.676 1.00 0.00 N ATOM 1272 CA HIS A 76 2.776 34.239 18.055 1.00 0.00 C ATOM 1273 C HIS A 76 1.992 35.205 18.956 1.00 0.00 C ATOM 1274 O HIS A 76 2.551 35.841 19.848 1.00 0.00 O ATOM 1275 CB HIS A 76 4.297 34.423 18.145 1.00 0.00 C ATOM 1276 CG HIS A 76 4.785 35.745 17.606 1.00 0.00 C ATOM 1277 ND1 HIS A 76 4.634 36.934 18.302 1.00 0.00 N ATOM 1278 CD2 HIS A 76 5.420 36.087 16.438 1.00 0.00 C ATOM 1279 CE1 HIS A 76 5.170 37.910 17.548 1.00 0.00 C ATOM 1280 NE2 HIS A 76 5.669 37.457 16.396 1.00 0.00 N ATOM 0 H HIS A 76 2.009 35.376 16.492 1.00 0.00 H new ATOM 0 HA HIS A 76 2.566 33.227 18.401 1.00 0.00 H new ATOM 0 HB2 HIS A 76 4.603 34.331 19.187 1.00 0.00 H new ATOM 0 HB3 HIS A 76 4.784 33.616 17.597 1.00 0.00 H new ATOM 0 HD1 HIS A 76 4.197 37.048 19.217 1.00 0.00 H new ATOM 0 HD2 HIS A 76 5.690 35.390 15.659 1.00 0.00 H new ATOM 0 HE1 HIS A 76 5.194 38.949 17.843 1.00 0.00 H new ATOM 1288 N LEU A 77 0.684 35.314 18.696 1.00 0.00 N ATOM 1289 CA LEU A 77 -0.245 36.189 19.404 1.00 0.00 C ATOM 1290 C LEU A 77 -0.844 35.459 20.617 1.00 0.00 C ATOM 1291 O LEU A 77 -0.899 34.228 20.618 1.00 0.00 O ATOM 1292 CB LEU A 77 -1.337 36.635 18.418 1.00 0.00 C ATOM 1293 CG LEU A 77 -0.913 37.805 17.507 1.00 0.00 C ATOM 1294 CD1 LEU A 77 0.276 37.470 16.597 1.00 0.00 C ATOM 1295 CD2 LEU A 77 -2.094 38.228 16.624 1.00 0.00 C ATOM 0 H LEU A 77 0.231 34.774 17.959 1.00 0.00 H new ATOM 0 HA LEU A 77 0.275 37.069 19.783 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.620 35.786 17.795 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.224 36.928 18.980 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.603 38.611 18.172 1.00 0.00 H new ATOM 0 HD11 LEU A 77 0.521 38.337 15.984 1.00 0.00 H new ATOM 0 HD12 LEU A 77 1.138 37.203 17.208 1.00 0.00 H new ATOM 0 HD13 LEU A 77 0.015 36.631 15.951 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.790 39.055 15.982 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.407 37.386 16.007 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.925 38.545 17.255 1.00 0.00 H new ATOM 1307 N PRO A 78 -1.288 36.193 21.654 1.00 0.00 N ATOM 1308 CA PRO A 78 -1.862 35.623 22.868 1.00 0.00 C ATOM 1309 C PRO A 78 -3.284 35.092 22.648 1.00 0.00 C ATOM 1310 O PRO A 78 -3.819 35.151 21.542 1.00 0.00 O ATOM 1311 CB PRO A 78 -1.836 36.769 23.886 1.00 0.00 C ATOM 1312 CG PRO A 78 -2.039 38.001 23.008 1.00 0.00 C ATOM 1313 CD PRO A 78 -1.254 37.645 21.747 1.00 0.00 C ATOM 0 HA PRO A 78 -1.296 34.756 23.209 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -2.626 36.668 24.630 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -0.891 36.809 24.427 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -3.093 38.176 22.793 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.656 38.904 23.482 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -1.702 38.104 20.865 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -0.228 38.009 21.809 1.00 0.00 H new ATOM 1321 N ALA A 79 -3.888 34.560 23.717 1.00 0.00 N ATOM 1322 CA ALA A 79 -5.236 34.006 23.736 1.00 0.00 C ATOM 1323 C ALA A 79 -6.272 35.079 24.098 1.00 0.00 C ATOM 1324 O ALA A 79 -5.936 36.028 24.806 1.00 0.00 O ATOM 1325 CB ALA A 79 -5.269 32.868 24.763 1.00 0.00 C ATOM 0 H ALA A 79 -3.428 34.504 24.626 1.00 0.00 H new ATOM 0 HA ALA A 79 -5.490 33.632 22.744 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -6.269 32.436 24.796 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -4.551 32.099 24.477 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.010 33.258 25.747 1.00 0.00 H new ATOM 1430 N GLN A 86 -13.892 43.769 22.478 1.00 0.00 N ATOM 1431 CA GLN A 86 -13.484 43.746 21.076 1.00 0.00 C ATOM 1432 C GLN A 86 -12.062 43.207 20.888 1.00 0.00 C ATOM 1433 O GLN A 86 -11.708 42.762 19.798 1.00 0.00 O ATOM 1434 CB GLN A 86 -13.615 45.146 20.464 1.00 0.00 C ATOM 1435 CG GLN A 86 -15.072 45.624 20.438 1.00 0.00 C ATOM 1436 CD GLN A 86 -15.192 46.981 19.752 1.00 0.00 C ATOM 1437 OE1 GLN A 86 -15.716 47.078 18.647 1.00 0.00 O ATOM 1438 NE2 GLN A 86 -14.700 48.036 20.400 1.00 0.00 N ATOM 0 HA GLN A 86 -14.153 43.061 20.555 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -13.012 45.851 21.037 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -13.217 45.137 19.449 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -15.689 44.893 19.915 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -15.454 45.693 21.457 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -14.271 47.916 21.318 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -14.752 48.963 19.978 1.00 0.00 H new ATOM 1447 N ARG A 87 -11.265 43.216 21.960 1.00 0.00 N ATOM 1448 CA ARG A 87 -9.889 42.741 21.966 1.00 0.00 C ATOM 1449 C ARG A 87 -9.835 41.249 22.290 1.00 0.00 C ATOM 1450 O ARG A 87 -8.768 40.651 22.212 1.00 0.00 O ATOM 1451 CB ARG A 87 -9.112 43.529 23.048 1.00 0.00 C ATOM 1452 CG ARG A 87 -8.822 44.973 22.624 1.00 0.00 C ATOM 1453 CD ARG A 87 -7.737 45.038 21.538 1.00 0.00 C ATOM 1454 NE ARG A 87 -8.191 45.816 20.373 1.00 0.00 N ATOM 1455 CZ ARG A 87 -8.154 45.433 19.082 1.00 0.00 C ATOM 1456 NH1 ARG A 87 -7.657 44.250 18.708 1.00 0.00 N ATOM 1457 NH2 ARG A 87 -8.625 46.252 18.134 1.00 0.00 N ATOM 0 H ARG A 87 -11.572 43.564 22.868 1.00 0.00 H new ATOM 0 HA ARG A 87 -9.446 42.894 20.982 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -9.688 43.534 23.974 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -8.172 43.020 23.260 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -9.737 45.434 22.253 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -8.504 45.550 23.492 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -6.834 45.489 21.950 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -7.474 44.028 21.223 1.00 0.00 H new ATOM 0 HE ARG A 87 -8.574 46.742 20.564 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -7.291 43.606 19.409 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -7.644 43.991 17.721 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -9.010 47.161 18.391 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -8.599 45.967 17.155 1.00 0.00 H new ATOM 1471 N ALA A 88 -10.980 40.637 22.603 1.00 0.00 N ATOM 1472 CA ALA A 88 -11.132 39.208 22.837 1.00 0.00 C ATOM 1473 C ALA A 88 -11.754 38.559 21.596 1.00 0.00 C ATOM 1474 O ALA A 88 -11.694 37.339 21.431 1.00 0.00 O ATOM 1475 CB ALA A 88 -11.950 38.949 24.100 1.00 0.00 C ATOM 0 H ALA A 88 -11.857 41.148 22.703 1.00 0.00 H new ATOM 0 HA ALA A 88 -10.155 38.755 23.004 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -12.050 37.875 24.255 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -11.445 39.393 24.958 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -12.939 39.394 23.990 1.00 0.00 H new ATOM 1481 N ALA A 89 -12.338 39.385 20.721 1.00 0.00 N ATOM 1482 CA ALA A 89 -12.941 38.988 19.464 1.00 0.00 C ATOM 1483 C ALA A 89 -11.866 39.052 18.385 1.00 0.00 C ATOM 1484 O ALA A 89 -11.517 38.040 17.787 1.00 0.00 O ATOM 1485 CB ALA A 89 -14.137 39.891 19.149 1.00 0.00 C ATOM 0 H ALA A 89 -12.401 40.390 20.886 1.00 0.00 H new ATOM 0 HA ALA A 89 -13.324 37.969 19.516 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.584 39.586 18.203 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -14.877 39.805 19.945 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.802 40.926 19.075 1.00 0.00 H new ATOM 1491 N GLU A 90 -11.335 40.254 18.157 1.00 0.00 N ATOM 1492 CA GLU A 90 -10.298 40.539 17.166 1.00 0.00 C ATOM 1493 C GLU A 90 -8.977 39.821 17.446 1.00 0.00 C ATOM 1494 O GLU A 90 -8.101 39.795 16.584 1.00 0.00 O ATOM 1495 CB GLU A 90 -10.138 42.063 17.068 1.00 0.00 C ATOM 1496 CG GLU A 90 -9.419 42.531 15.797 1.00 0.00 C ATOM 1497 CD GLU A 90 -9.297 44.048 15.783 1.00 0.00 C ATOM 1498 OE1 GLU A 90 -10.327 44.714 15.552 1.00 0.00 O ATOM 1499 OE2 GLU A 90 -8.182 44.529 16.078 1.00 0.00 O ATOM 0 H GLU A 90 -11.625 41.083 18.675 1.00 0.00 H new ATOM 0 HA GLU A 90 -10.612 40.142 16.201 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -11.124 42.525 17.107 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -9.585 42.417 17.938 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -8.428 42.080 15.745 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.968 42.196 14.917 1.00 0.00 H new ATOM 1506 N ASN A 91 -8.822 39.213 18.626 1.00 0.00 N ATOM 1507 CA ASN A 91 -7.616 38.474 18.947 1.00 0.00 C ATOM 1508 C ASN A 91 -7.759 37.162 18.203 1.00 0.00 C ATOM 1509 O ASN A 91 -7.001 36.897 17.283 1.00 0.00 O ATOM 1510 CB ASN A 91 -7.482 38.244 20.473 1.00 0.00 C ATOM 1511 CG ASN A 91 -6.234 37.428 20.795 1.00 0.00 C ATOM 1512 OD1 ASN A 91 -5.206 37.985 21.166 1.00 0.00 O ATOM 1513 ND2 ASN A 91 -6.316 36.105 20.662 1.00 0.00 N ATOM 0 H ASN A 91 -9.521 39.223 19.369 1.00 0.00 H new ATOM 0 HA ASN A 91 -6.716 39.015 18.655 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -7.435 39.204 20.986 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -8.366 37.726 20.845 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -5.507 35.520 20.871 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.188 35.677 20.351 1.00 0.00 H new ATOM 1520 N ARG A 92 -8.744 36.340 18.575 1.00 0.00 N ATOM 1521 CA ARG A 92 -8.941 35.068 17.901 1.00 0.00 C ATOM 1522 C ARG A 92 -9.295 35.242 16.426 1.00 0.00 C ATOM 1523 O ARG A 92 -8.919 34.411 15.600 1.00 0.00 O ATOM 1524 CB ARG A 92 -9.947 34.197 18.670 1.00 0.00 C ATOM 1525 CG ARG A 92 -11.407 34.561 18.368 1.00 0.00 C ATOM 1526 CD ARG A 92 -12.371 33.899 19.355 1.00 0.00 C ATOM 1527 NE ARG A 92 -12.443 34.670 20.602 1.00 0.00 N ATOM 1528 CZ ARG A 92 -13.211 34.360 21.657 1.00 0.00 C ATOM 1529 NH1 ARG A 92 -13.900 33.211 21.691 1.00 0.00 N ATOM 1530 NH2 ARG A 92 -13.283 35.232 22.668 1.00 0.00 N ATOM 0 H ARG A 92 -9.404 36.534 19.328 1.00 0.00 H new ATOM 0 HA ARG A 92 -7.991 34.533 17.903 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -9.780 33.150 18.418 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -9.766 34.301 19.740 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -11.529 35.643 18.411 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.657 34.252 17.353 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -13.363 33.825 18.909 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -12.041 32.882 19.568 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.864 35.507 20.672 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -13.844 32.560 20.908 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -14.480 32.988 22.500 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -12.761 36.107 22.625 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -13.860 35.022 23.483 1.00 0.00 H new ATOM 1544 N GLN A 93 -10.006 36.327 16.099 1.00 0.00 N ATOM 1545 CA GLN A 93 -10.412 36.602 14.723 1.00 0.00 C ATOM 1546 C GLN A 93 -9.282 37.212 13.891 1.00 0.00 C ATOM 1547 O GLN A 93 -9.473 37.431 12.698 1.00 0.00 O ATOM 1548 CB GLN A 93 -11.702 37.432 14.665 1.00 0.00 C ATOM 1549 CG GLN A 93 -12.916 36.758 15.325 1.00 0.00 C ATOM 1550 CD GLN A 93 -13.527 35.654 14.465 1.00 0.00 C ATOM 1551 OE1 GLN A 93 -14.563 35.856 13.839 1.00 0.00 O ATOM 1552 NE2 GLN A 93 -12.907 34.476 14.440 1.00 0.00 N ATOM 0 H GLN A 93 -10.311 37.029 16.773 1.00 0.00 H new ATOM 0 HA GLN A 93 -10.637 35.641 14.262 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.525 38.392 15.150 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.939 37.641 13.622 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -12.614 36.338 16.285 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -13.675 37.512 15.532 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.047 34.341 14.972 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -13.292 33.709 13.889 1.00 0.00 H new ATOM 1561 N GLY A 94 -8.112 37.458 14.490 1.00 0.00 N ATOM 1562 CA GLY A 94 -6.931 37.970 13.803 1.00 0.00 C ATOM 1563 C GLY A 94 -5.884 36.862 13.780 1.00 0.00 C ATOM 1564 O GLY A 94 -5.300 36.571 12.741 1.00 0.00 O ATOM 0 H GLY A 94 -7.961 37.302 15.487 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -7.183 38.277 12.788 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -6.543 38.850 14.316 1.00 0.00 H new ATOM 1568 N THR A 95 -5.665 36.234 14.937 1.00 0.00 N ATOM 1569 CA THR A 95 -4.731 35.144 15.144 1.00 0.00 C ATOM 1570 C THR A 95 -5.093 33.970 14.271 1.00 0.00 C ATOM 1571 O THR A 95 -4.215 33.418 13.615 1.00 0.00 O ATOM 1572 CB THR A 95 -4.718 34.747 16.633 1.00 0.00 C ATOM 1573 OG1 THR A 95 -4.302 35.854 17.400 1.00 0.00 O ATOM 1574 CG2 THR A 95 -3.815 33.543 16.961 1.00 0.00 C ATOM 0 H THR A 95 -6.161 36.490 15.791 1.00 0.00 H new ATOM 0 HA THR A 95 -3.729 35.470 14.865 1.00 0.00 H new ATOM 0 HB THR A 95 -5.736 34.442 16.877 1.00 0.00 H new ATOM 0 HG1 THR A 95 -5.058 36.463 17.533 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.865 33.331 18.029 1.00 0.00 H new ATOM 0 HG22 THR A 95 -4.154 32.671 16.402 1.00 0.00 H new ATOM 0 HG23 THR A 95 -2.786 33.774 16.684 1.00 0.00 H new ATOM 1582 N LEU A 96 -6.370 33.585 14.241 1.00 0.00 N ATOM 1583 CA LEU A 96 -6.724 32.475 13.378 1.00 0.00 C ATOM 1584 C LEU A 96 -6.644 32.930 11.933 1.00 0.00 C ATOM 1585 O LEU A 96 -6.068 32.245 11.105 1.00 0.00 O ATOM 1586 CB LEU A 96 -8.116 31.936 13.643 1.00 0.00 C ATOM 1587 CG LEU A 96 -8.354 30.690 12.762 1.00 0.00 C ATOM 1588 CD1 LEU A 96 -7.753 29.448 13.399 1.00 0.00 C ATOM 1589 CD2 LEU A 96 -9.827 30.453 12.751 1.00 0.00 C ATOM 0 H LEU A 96 -7.133 34.002 14.774 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.019 31.670 13.585 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -8.224 31.678 14.696 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -8.862 32.699 13.424 1.00 0.00 H new ATOM 0 HG LEU A 96 -7.916 30.860 11.779 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -7.935 28.586 12.758 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -6.679 29.587 13.524 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -8.213 29.280 14.373 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -10.050 29.579 12.139 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -10.176 30.282 13.769 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -10.333 31.325 12.336 1.00 0.00 H new ATOM 1601 N THR A 97 -7.227 34.092 11.647 1.00 0.00 N ATOM 1602 CA THR A 97 -7.233 34.708 10.321 1.00 0.00 C ATOM 1603 C THR A 97 -5.838 34.724 9.708 1.00 0.00 C ATOM 1604 O THR A 97 -5.680 34.527 8.502 1.00 0.00 O ATOM 1605 CB THR A 97 -7.835 36.120 10.414 1.00 0.00 C ATOM 1606 OG1 THR A 97 -9.241 36.013 10.384 1.00 0.00 O ATOM 1607 CG2 THR A 97 -7.350 37.107 9.353 1.00 0.00 C ATOM 0 H THR A 97 -7.720 34.645 12.348 1.00 0.00 H new ATOM 0 HA THR A 97 -7.855 34.110 9.655 1.00 0.00 H new ATOM 0 HB THR A 97 -7.485 36.543 11.356 1.00 0.00 H new ATOM 0 HG1 THR A 97 -9.621 36.470 11.164 1.00 0.00 H new ATOM 0 HG21 THR A 97 -7.833 38.072 9.506 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.269 37.226 9.433 1.00 0.00 H new ATOM 0 HG23 THR A 97 -7.601 36.728 8.362 1.00 0.00 H new ATOM 1615 N GLU A 98 -4.830 34.935 10.553 1.00 0.00 N ATOM 1616 CA GLU A 98 -3.460 35.001 10.106 1.00 0.00 C ATOM 1617 C GLU A 98 -2.863 33.615 10.114 1.00 0.00 C ATOM 1618 O GLU A 98 -2.162 33.275 9.161 1.00 0.00 O ATOM 1619 CB GLU A 98 -2.685 35.984 10.996 1.00 0.00 C ATOM 1620 CG GLU A 98 -1.278 36.264 10.472 1.00 0.00 C ATOM 1621 CD GLU A 98 -0.505 37.125 11.466 1.00 0.00 C ATOM 1622 OE1 GLU A 98 -0.088 36.561 12.501 1.00 0.00 O ATOM 1623 OE2 GLU A 98 -0.374 38.335 11.189 1.00 0.00 O ATOM 0 H GLU A 98 -4.950 35.063 11.558 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.403 35.372 9.083 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -3.237 36.921 11.063 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.619 35.580 12.006 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -0.750 35.325 10.307 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -1.335 36.771 9.509 1.00 0.00 H new ATOM 1630 N TYR A 99 -3.146 32.795 11.131 1.00 0.00 N ATOM 1631 CA TYR A 99 -2.585 31.458 11.092 1.00 0.00 C ATOM 1632 C TYR A 99 -3.109 30.705 9.899 1.00 0.00 C ATOM 1633 O TYR A 99 -2.355 29.944 9.356 1.00 0.00 O ATOM 1634 CB TYR A 99 -2.775 30.524 12.305 1.00 0.00 C ATOM 1635 CG TYR A 99 -1.661 29.449 12.487 1.00 0.00 C ATOM 1636 CD1 TYR A 99 -0.440 29.427 11.751 1.00 0.00 C ATOM 1637 CD2 TYR A 99 -1.856 28.435 13.446 1.00 0.00 C ATOM 1638 CE1 TYR A 99 0.536 28.440 11.988 1.00 0.00 C ATOM 1639 CE2 TYR A 99 -0.881 27.444 13.684 1.00 0.00 C ATOM 1640 CZ TYR A 99 0.304 27.452 12.940 1.00 0.00 C ATOM 1641 OH TYR A 99 1.240 26.484 13.118 1.00 0.00 O ATOM 0 H TYR A 99 -3.724 33.020 11.941 1.00 0.00 H new ATOM 0 HA TYR A 99 -1.520 31.686 11.067 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.824 31.132 13.209 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.736 30.018 12.208 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.261 30.181 10.998 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -2.775 28.416 14.013 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.462 28.450 11.432 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -1.048 26.685 14.434 1.00 0.00 H new ATOM 0 HH TYR A 99 1.355 26.312 14.076 1.00 0.00 H new ATOM 1651 N CYS A 100 -4.357 30.870 9.476 1.00 0.00 N ATOM 1652 CA CYS A 100 -4.872 30.135 8.333 1.00 0.00 C ATOM 1653 C CYS A 100 -4.069 30.505 7.099 1.00 0.00 C ATOM 1654 O CYS A 100 -3.579 29.631 6.384 1.00 0.00 O ATOM 1655 CB CYS A 100 -6.370 30.401 8.137 1.00 0.00 C ATOM 1656 SG CYS A 100 -6.978 29.323 6.816 1.00 0.00 S ATOM 0 H CYS A 100 -5.028 31.505 9.908 1.00 0.00 H new ATOM 0 HA CYS A 100 -4.764 29.065 8.512 1.00 0.00 H new ATOM 0 HB2 CYS A 100 -6.913 30.209 9.062 1.00 0.00 H new ATOM 0 HB3 CYS A 100 -6.538 31.447 7.880 1.00 0.00 H new ATOM 0 HG CYS A 100 -8.248 29.532 6.635 1.00 0.00 H new ATOM 1662 N SER A 101 -3.920 31.812 6.874 1.00 0.00 N ATOM 1663 CA SER A 101 -3.166 32.317 5.744 1.00 0.00 C ATOM 1664 C SER A 101 -1.703 31.876 5.784 1.00 0.00 C ATOM 1665 O SER A 101 -1.097 31.641 4.744 1.00 0.00 O ATOM 1666 CB SER A 101 -3.271 33.848 5.725 1.00 0.00 C ATOM 1667 OG SER A 101 -4.623 34.259 5.810 1.00 0.00 O ATOM 0 H SER A 101 -4.318 32.538 7.469 1.00 0.00 H new ATOM 0 HA SER A 101 -3.590 31.902 4.830 1.00 0.00 H new ATOM 0 HB2 SER A 101 -2.706 34.266 6.558 1.00 0.00 H new ATOM 0 HB3 SER A 101 -2.825 34.237 4.810 1.00 0.00 H new ATOM 0 HG SER A 101 -4.888 34.319 6.752 1.00 0.00 H new ATOM 1673 N THR A 102 -1.142 31.785 6.988 1.00 0.00 N ATOM 1674 CA THR A 102 0.246 31.447 7.250 1.00 0.00 C ATOM 1675 C THR A 102 0.532 29.954 7.241 1.00 0.00 C ATOM 1676 O THR A 102 1.547 29.556 6.693 1.00 0.00 O ATOM 1677 CB THR A 102 0.684 32.192 8.521 1.00 0.00 C ATOM 1678 OG1 THR A 102 0.447 33.572 8.335 1.00 0.00 O ATOM 1679 CG2 THR A 102 2.154 32.028 8.865 1.00 0.00 C ATOM 0 H THR A 102 -1.671 31.954 7.843 1.00 0.00 H new ATOM 0 HA THR A 102 0.869 31.789 6.423 1.00 0.00 H new ATOM 0 HB THR A 102 0.108 31.762 9.340 1.00 0.00 H new ATOM 0 HG1 THR A 102 -0.482 33.779 8.569 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.379 32.585 9.774 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.375 30.972 9.022 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.764 32.409 8.046 1.00 0.00 H new ATOM 1687 N LEU A 103 -0.352 29.124 7.790 1.00 0.00 N ATOM 1688 CA LEU A 103 -0.240 27.660 7.805 1.00 0.00 C ATOM 1689 C LEU A 103 -0.209 27.245 6.330 1.00 0.00 C ATOM 1690 O LEU A 103 0.481 26.297 5.960 1.00 0.00 O ATOM 1691 CB LEU A 103 -1.410 27.009 8.616 1.00 0.00 C ATOM 1692 CG LEU A 103 -1.234 26.184 9.924 1.00 0.00 C ATOM 1693 CD1 LEU A 103 -2.506 26.241 10.781 1.00 0.00 C ATOM 1694 CD2 LEU A 103 -0.971 24.672 9.798 1.00 0.00 C ATOM 0 H LEU A 103 -1.196 29.460 8.254 1.00 0.00 H new ATOM 0 HA LEU A 103 0.659 27.313 8.314 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.092 27.822 8.864 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.933 26.356 7.917 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.348 26.661 10.342 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.359 25.657 11.690 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -2.720 27.276 11.046 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -3.343 25.830 10.217 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.871 24.236 10.792 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.804 24.200 9.277 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.052 24.508 9.236 1.00 0.00 H new ATOM 1706 N MET A 104 -0.929 27.998 5.481 1.00 0.00 N ATOM 1707 CA MET A 104 -0.988 27.814 4.052 1.00 0.00 C ATOM 1708 C MET A 104 0.218 28.370 3.296 1.00 0.00 C ATOM 1709 O MET A 104 0.504 27.927 2.182 1.00 0.00 O ATOM 1710 CB MET A 104 -2.227 28.567 3.539 1.00 0.00 C ATOM 1711 CG MET A 104 -3.522 27.772 3.658 1.00 0.00 C ATOM 1712 SD MET A 104 -4.051 27.074 2.079 1.00 0.00 S ATOM 1713 CE MET A 104 -2.596 26.074 1.703 1.00 0.00 C ATOM 0 H MET A 104 -1.503 28.778 5.801 1.00 0.00 H new ATOM 0 HA MET A 104 -1.015 26.739 3.874 1.00 0.00 H new ATOM 0 HB2 MET A 104 -2.331 29.499 4.095 1.00 0.00 H new ATOM 0 HB3 MET A 104 -2.071 28.835 2.494 1.00 0.00 H new ATOM 0 HG2 MET A 104 -3.386 26.967 4.380 1.00 0.00 H new ATOM 0 HG3 MET A 104 -4.308 28.419 4.047 1.00 0.00 H new ATOM 0 HE1 MET A 104 -2.790 25.468 0.818 1.00 0.00 H new ATOM 0 HE2 MET A 104 -1.744 26.727 1.515 1.00 0.00 H new ATOM 0 HE3 MET A 104 -2.374 25.422 2.548 1.00 0.00 H new ATOM 1723 N SER A 105 0.888 29.354 3.885 1.00 0.00 N ATOM 1724 CA SER A 105 1.995 30.077 3.286 1.00 0.00 C ATOM 1725 C SER A 105 3.330 29.423 3.574 1.00 0.00 C ATOM 1726 O SER A 105 4.160 29.362 2.670 1.00 0.00 O ATOM 1727 CB SER A 105 2.039 31.541 3.798 1.00 0.00 C ATOM 1728 OG SER A 105 2.878 32.314 2.965 1.00 0.00 O ATOM 0 H SER A 105 0.665 29.679 4.826 1.00 0.00 H new ATOM 0 HA SER A 105 1.825 30.061 2.209 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.034 31.962 3.809 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.406 31.566 4.824 1.00 0.00 H new ATOM 0 HG SER A 105 2.901 33.238 3.291 1.00 0.00 H new ATOM 1734 N LEU A 106 3.542 28.965 4.813 1.00 0.00 N ATOM 1735 CA LEU A 106 4.768 28.389 5.260 1.00 0.00 C ATOM 1736 C LEU A 106 5.626 27.662 4.226 1.00 0.00 C ATOM 1737 O LEU A 106 5.105 26.844 3.468 1.00 0.00 O ATOM 1738 CB LEU A 106 4.545 27.587 6.535 1.00 0.00 C ATOM 1739 CG LEU A 106 4.089 28.331 7.801 1.00 0.00 C ATOM 1740 CD1 LEU A 106 4.668 27.602 9.004 1.00 0.00 C ATOM 1741 CD2 LEU A 106 4.532 29.795 7.886 1.00 0.00 C ATOM 0 H LEU A 106 2.827 28.997 5.539 1.00 0.00 H new ATOM 0 HA LEU A 106 5.404 29.246 5.479 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.803 26.818 6.317 1.00 0.00 H new ATOM 0 HB3 LEU A 106 5.477 27.073 6.770 1.00 0.00 H new ATOM 0 HG LEU A 106 2.999 28.339 7.775 1.00 0.00 H new ATOM 0 HD11 LEU A 106 4.361 28.108 9.919 1.00 0.00 H new ATOM 0 HD12 LEU A 106 4.303 26.575 9.017 1.00 0.00 H new ATOM 0 HD13 LEU A 106 5.756 27.599 8.939 1.00 0.00 H new ATOM 0 HD21 LEU A 106 4.163 30.234 8.813 1.00 0.00 H new ATOM 0 HD22 LEU A 106 5.621 29.847 7.868 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.128 30.347 7.037 1.00 0.00 H new ATOM 1753 N PRO A 107 6.949 27.952 4.185 1.00 0.00 N ATOM 1754 CA PRO A 107 7.826 27.307 3.226 1.00 0.00 C ATOM 1755 C PRO A 107 8.186 25.906 3.661 1.00 0.00 C ATOM 1756 O PRO A 107 8.742 25.121 2.894 1.00 0.00 O ATOM 1757 CB PRO A 107 9.062 28.171 3.124 1.00 0.00 C ATOM 1758 CG PRO A 107 9.180 28.764 4.531 1.00 0.00 C ATOM 1759 CD PRO A 107 7.733 28.851 5.038 1.00 0.00 C ATOM 0 HA PRO A 107 7.331 27.210 2.260 1.00 0.00 H new ATOM 0 HB2 PRO A 107 9.943 27.587 2.856 1.00 0.00 H new ATOM 0 HB3 PRO A 107 8.952 28.947 2.366 1.00 0.00 H new ATOM 0 HG2 PRO A 107 9.789 28.132 5.178 1.00 0.00 H new ATOM 0 HG3 PRO A 107 9.652 29.746 4.509 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.668 28.551 6.084 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.359 29.873 4.975 1.00 0.00 H new ATOM 1767 N THR A 108 7.808 25.584 4.889 1.00 0.00 N ATOM 1768 CA THR A 108 7.963 24.287 5.481 1.00 0.00 C ATOM 1769 C THR A 108 6.757 23.500 5.024 1.00 0.00 C ATOM 1770 O THR A 108 6.141 22.804 5.808 1.00 0.00 O ATOM 1771 CB THR A 108 7.903 24.464 6.998 1.00 0.00 C ATOM 1772 OG1 THR A 108 6.881 25.360 7.378 1.00 0.00 O ATOM 1773 CG2 THR A 108 9.214 24.959 7.560 1.00 0.00 C ATOM 0 H THR A 108 7.367 26.256 5.517 1.00 0.00 H new ATOM 0 HA THR A 108 8.896 23.794 5.207 1.00 0.00 H new ATOM 0 HB THR A 108 7.689 23.477 7.407 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.870 25.448 8.354 1.00 0.00 H new ATOM 0 HG21 THR A 108 9.127 25.071 8.641 1.00 0.00 H new ATOM 0 HG22 THR A 108 10.002 24.241 7.332 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.460 25.923 7.114 1.00 0.00 H new ATOM 1781 N LYS A 109 6.381 23.600 3.757 1.00 0.00 N ATOM 1782 CA LYS A 109 5.203 22.882 3.307 1.00 0.00 C ATOM 1783 C LYS A 109 5.419 21.373 3.263 1.00 0.00 C ATOM 1784 O LYS A 109 4.453 20.626 3.149 1.00 0.00 O ATOM 1785 CB LYS A 109 4.718 23.467 1.960 1.00 0.00 C ATOM 1786 CG LYS A 109 3.195 23.420 1.796 1.00 0.00 C ATOM 1787 CD LYS A 109 2.482 24.370 2.771 1.00 0.00 C ATOM 1788 CE LYS A 109 0.989 24.484 2.441 1.00 0.00 C ATOM 1789 NZ LYS A 109 0.748 25.327 1.254 1.00 0.00 N ATOM 0 H LYS A 109 6.858 24.153 3.045 1.00 0.00 H new ATOM 0 HA LYS A 109 4.409 23.027 4.039 1.00 0.00 H new ATOM 0 HB2 LYS A 109 5.054 24.501 1.878 1.00 0.00 H new ATOM 0 HB3 LYS A 109 5.182 22.915 1.143 1.00 0.00 H new ATOM 0 HG2 LYS A 109 2.932 23.687 0.772 1.00 0.00 H new ATOM 0 HG3 LYS A 109 2.844 22.401 1.960 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.605 24.008 3.792 1.00 0.00 H new ATOM 0 HD3 LYS A 109 2.944 25.356 2.725 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.579 23.489 2.268 1.00 0.00 H new ATOM 0 HE3 LYS A 109 0.460 24.903 3.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -0.039 24.931 0.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 0.508 26.292 1.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 1.606 25.352 0.666 1.00 0.00 H new ATOM 1803 N ILE A 110 6.674 20.937 3.391 1.00 0.00 N ATOM 1804 CA ILE A 110 7.051 19.537 3.437 1.00 0.00 C ATOM 1805 C ILE A 110 7.147 19.093 4.901 1.00 0.00 C ATOM 1806 O ILE A 110 6.793 17.962 5.229 1.00 0.00 O ATOM 1807 CB ILE A 110 8.371 19.303 2.668 1.00 0.00 C ATOM 1808 CG1 ILE A 110 8.267 19.648 1.168 1.00 0.00 C ATOM 1809 CG2 ILE A 110 8.793 17.828 2.777 1.00 0.00 C ATOM 1810 CD1 ILE A 110 8.326 21.147 0.845 1.00 0.00 C ATOM 0 H ILE A 110 7.470 21.570 3.467 1.00 0.00 H new ATOM 0 HA ILE A 110 6.291 18.931 2.944 1.00 0.00 H new ATOM 0 HB ILE A 110 9.105 19.966 3.126 1.00 0.00 H new ATOM 0 HG12 ILE A 110 9.075 19.145 0.637 1.00 0.00 H new ATOM 0 HG13 ILE A 110 7.331 19.244 0.781 1.00 0.00 H new ATOM 0 HG21 ILE A 110 9.724 17.675 2.232 1.00 0.00 H new ATOM 0 HG22 ILE A 110 8.940 17.568 3.825 1.00 0.00 H new ATOM 0 HG23 ILE A 110 8.015 17.194 2.351 1.00 0.00 H new ATOM 0 HD11 ILE A 110 8.245 21.290 -0.233 1.00 0.00 H new ATOM 0 HD12 ILE A 110 7.502 21.659 1.342 1.00 0.00 H new ATOM 0 HD13 ILE A 110 9.273 21.558 1.196 1.00 0.00 H new ATOM 1822 N SER A 111 7.630 19.980 5.776 1.00 0.00 N ATOM 1823 CA SER A 111 7.816 19.698 7.192 1.00 0.00 C ATOM 1824 C SER A 111 6.509 19.821 7.967 1.00 0.00 C ATOM 1825 O SER A 111 6.182 18.981 8.803 1.00 0.00 O ATOM 1826 CB SER A 111 8.921 20.590 7.772 1.00 0.00 C ATOM 1827 OG SER A 111 10.030 20.616 6.895 1.00 0.00 O ATOM 0 H SER A 111 7.905 20.926 5.511 1.00 0.00 H new ATOM 0 HA SER A 111 8.137 18.661 7.296 1.00 0.00 H new ATOM 0 HB2 SER A 111 8.542 21.601 7.923 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.228 20.215 8.749 1.00 0.00 H new ATOM 0 HG SER A 111 10.731 21.189 7.271 1.00 0.00 H new ATOM 1833 N ARG A 112 5.769 20.886 7.668 1.00 0.00 N ATOM 1834 CA ARG A 112 4.494 21.218 8.276 1.00 0.00 C ATOM 1835 C ARG A 112 3.352 20.375 7.721 1.00 0.00 C ATOM 1836 O ARG A 112 2.295 20.317 8.346 1.00 0.00 O ATOM 1837 CB ARG A 112 4.231 22.715 8.057 1.00 0.00 C ATOM 1838 CG ARG A 112 3.260 23.325 9.067 1.00 0.00 C ATOM 1839 CD ARG A 112 3.850 23.269 10.481 1.00 0.00 C ATOM 1840 NE ARG A 112 3.520 24.492 11.218 1.00 0.00 N ATOM 1841 CZ ARG A 112 4.348 25.523 11.461 1.00 0.00 C ATOM 1842 NH1 ARG A 112 5.657 25.495 11.184 1.00 0.00 N ATOM 1843 NH2 ARG A 112 3.833 26.635 11.987 1.00 0.00 N ATOM 0 H ARG A 112 6.058 21.566 6.965 1.00 0.00 H new ATOM 0 HA ARG A 112 4.542 20.996 9.342 1.00 0.00 H new ATOM 0 HB2 ARG A 112 5.178 23.252 8.108 1.00 0.00 H new ATOM 0 HB3 ARG A 112 3.835 22.862 7.052 1.00 0.00 H new ATOM 0 HG2 ARG A 112 3.047 24.359 8.796 1.00 0.00 H new ATOM 0 HG3 ARG A 112 2.313 22.787 9.040 1.00 0.00 H new ATOM 0 HD2 ARG A 112 3.460 22.400 11.011 1.00 0.00 H new ATOM 0 HD3 ARG A 112 4.932 23.150 10.427 1.00 0.00 H new ATOM 0 HE ARG A 112 2.570 24.568 11.582 1.00 0.00 H new ATOM 0 HH11 ARG A 112 6.072 24.662 10.767 1.00 0.00 H new ATOM 0 HH12 ARG A 112 6.239 26.307 11.389 1.00 0.00 H new ATOM 0 HH21 ARG A 112 2.836 26.687 12.194 1.00 0.00 H new ATOM 0 HH22 ARG A 112 4.437 27.434 12.182 1.00 0.00 H new ATOM 1857 N CYS A 113 3.554 19.734 6.562 1.00 0.00 N ATOM 1858 CA CYS A 113 2.537 18.910 5.920 1.00 0.00 C ATOM 1859 C CYS A 113 1.877 17.937 6.902 1.00 0.00 C ATOM 1860 O CYS A 113 0.695 18.110 7.187 1.00 0.00 O ATOM 1861 CB CYS A 113 3.068 18.203 4.659 1.00 0.00 C ATOM 1862 SG CYS A 113 1.955 18.505 3.259 1.00 0.00 S ATOM 0 H CYS A 113 4.433 19.777 6.046 1.00 0.00 H new ATOM 0 HA CYS A 113 1.753 19.588 5.583 1.00 0.00 H new ATOM 0 HB2 CYS A 113 4.068 18.566 4.423 1.00 0.00 H new ATOM 0 HB3 CYS A 113 3.153 17.132 4.842 1.00 0.00 H new ATOM 0 HG CYS A 113 2.415 17.905 2.201 1.00 0.00 H new ATOM 1868 N PRO A 114 2.587 16.929 7.443 1.00 0.00 N ATOM 1869 CA PRO A 114 2.002 15.972 8.371 1.00 0.00 C ATOM 1870 C PRO A 114 1.332 16.615 9.563 1.00 0.00 C ATOM 1871 O PRO A 114 0.339 16.080 10.041 1.00 0.00 O ATOM 1872 CB PRO A 114 3.115 14.997 8.759 1.00 0.00 C ATOM 1873 CG PRO A 114 4.389 15.789 8.466 1.00 0.00 C ATOM 1874 CD PRO A 114 3.991 16.604 7.236 1.00 0.00 C ATOM 0 HA PRO A 114 1.183 15.440 7.887 1.00 0.00 H new ATOM 0 HB2 PRO A 114 3.051 14.710 9.809 1.00 0.00 H new ATOM 0 HB3 PRO A 114 3.068 14.078 8.174 1.00 0.00 H new ATOM 0 HG2 PRO A 114 4.672 16.428 9.303 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.237 15.135 8.263 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.597 17.506 7.146 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.134 16.032 6.319 1.00 0.00 H new ATOM 1882 N HIS A 115 1.836 17.757 10.028 1.00 0.00 N ATOM 1883 CA HIS A 115 1.184 18.416 11.139 1.00 0.00 C ATOM 1884 C HIS A 115 -0.186 18.914 10.648 1.00 0.00 C ATOM 1885 O HIS A 115 -1.216 18.570 11.227 1.00 0.00 O ATOM 1886 CB HIS A 115 2.108 19.429 11.834 1.00 0.00 C ATOM 1887 CG HIS A 115 1.879 19.560 13.329 1.00 0.00 C ATOM 1888 ND1 HIS A 115 1.533 18.494 14.154 1.00 0.00 N ATOM 1889 CD2 HIS A 115 1.942 20.641 14.176 1.00 0.00 C ATOM 1890 CE1 HIS A 115 1.406 18.972 15.405 1.00 0.00 C ATOM 1891 NE2 HIS A 115 1.645 20.280 15.484 1.00 0.00 N ATOM 0 H HIS A 115 2.665 18.226 9.663 1.00 0.00 H new ATOM 0 HA HIS A 115 0.975 17.732 11.962 1.00 0.00 H new ATOM 0 HB2 HIS A 115 3.144 19.137 11.661 1.00 0.00 H new ATOM 0 HB3 HIS A 115 1.971 20.406 11.370 1.00 0.00 H new ATOM 0 HD2 HIS A 115 2.191 21.644 13.864 1.00 0.00 H new ATOM 0 HE1 HIS A 115 1.139 18.361 16.254 1.00 0.00 H new ATOM 0 HE2 HIS A 115 1.617 20.877 16.311 1.00 0.00 H new ATOM 1899 N LEU A 116 -0.247 19.693 9.558 1.00 0.00 N ATOM 1900 CA LEU A 116 -1.531 20.138 9.052 1.00 0.00 C ATOM 1901 C LEU A 116 -2.496 18.957 8.834 1.00 0.00 C ATOM 1902 O LEU A 116 -3.642 18.952 9.280 1.00 0.00 O ATOM 1903 CB LEU A 116 -1.427 20.966 7.762 1.00 0.00 C ATOM 1904 CG LEU A 116 -2.637 21.902 7.559 1.00 0.00 C ATOM 1905 CD1 LEU A 116 -3.251 21.846 6.142 1.00 0.00 C ATOM 1906 CD2 LEU A 116 -3.828 21.705 8.458 1.00 0.00 C ATOM 0 H LEU A 116 0.563 20.016 9.028 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.931 20.793 9.826 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -0.513 21.560 7.788 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -1.345 20.293 6.908 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.143 22.846 7.789 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -4.095 22.533 6.084 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.498 22.133 5.408 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -3.593 20.832 5.933 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -4.600 22.430 8.203 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.220 20.696 8.327 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.527 21.845 9.496 1.00 0.00 H new ATOM 1918 N LEU A 117 -2.016 17.914 8.163 1.00 0.00 N ATOM 1919 CA LEU A 117 -2.795 16.699 7.973 1.00 0.00 C ATOM 1920 C LEU A 117 -3.291 16.226 9.341 1.00 0.00 C ATOM 1921 O LEU A 117 -4.469 15.942 9.477 1.00 0.00 O ATOM 1922 CB LEU A 117 -2.029 15.628 7.191 1.00 0.00 C ATOM 1923 CG LEU A 117 -1.898 15.846 5.661 1.00 0.00 C ATOM 1924 CD1 LEU A 117 -0.588 16.462 5.176 1.00 0.00 C ATOM 1925 CD2 LEU A 117 -2.053 14.499 4.997 1.00 0.00 C ATOM 0 H LEU A 117 -1.088 17.888 7.741 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.662 16.911 7.347 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.026 15.551 7.611 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.519 14.669 7.358 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.669 16.570 5.398 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.614 16.565 4.091 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -0.457 17.444 5.631 1.00 0.00 H new ATOM 0 HD13 LEU A 117 0.244 15.817 5.459 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -1.966 14.614 3.917 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.274 13.826 5.354 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -3.031 14.084 5.240 1.00 0.00 H new ATOM 1937 N ASP A 118 -2.441 16.198 10.366 1.00 0.00 N ATOM 1938 CA ASP A 118 -2.829 15.851 11.739 1.00 0.00 C ATOM 1939 C ASP A 118 -3.710 16.913 12.443 1.00 0.00 C ATOM 1940 O ASP A 118 -4.163 16.696 13.564 1.00 0.00 O ATOM 1941 CB ASP A 118 -1.554 15.720 12.590 1.00 0.00 C ATOM 1942 CG ASP A 118 -0.750 14.440 12.384 1.00 0.00 C ATOM 1943 OD1 ASP A 118 -1.327 13.462 11.860 1.00 0.00 O ATOM 1944 OD2 ASP A 118 0.435 14.458 12.782 1.00 0.00 O ATOM 0 H ASP A 118 -1.450 16.418 10.269 1.00 0.00 H new ATOM 0 HA ASP A 118 -3.406 14.930 11.659 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -0.908 16.571 12.377 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -1.833 15.787 13.642 1.00 0.00 H new ATOM 1949 N PHE A 119 -3.955 18.064 11.818 1.00 0.00 N ATOM 1950 CA PHE A 119 -4.758 19.198 12.298 1.00 0.00 C ATOM 1951 C PHE A 119 -6.190 18.876 11.907 1.00 0.00 C ATOM 1952 O PHE A 119 -7.143 19.108 12.651 1.00 0.00 O ATOM 1953 CB PHE A 119 -4.272 20.492 11.550 1.00 0.00 C ATOM 1954 CG PHE A 119 -4.136 21.868 12.201 1.00 0.00 C ATOM 1955 CD1 PHE A 119 -5.172 22.334 13.009 1.00 0.00 C ATOM 1956 CD2 PHE A 119 -3.001 22.699 12.017 1.00 0.00 C ATOM 1957 CE1 PHE A 119 -5.118 23.566 13.675 1.00 0.00 C ATOM 1958 CE2 PHE A 119 -2.943 23.917 12.704 1.00 0.00 C ATOM 1959 CZ PHE A 119 -3.981 24.362 13.531 1.00 0.00 C ATOM 0 H PHE A 119 -3.570 18.246 10.891 1.00 0.00 H new ATOM 0 HA PHE A 119 -4.670 19.360 13.372 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -3.290 20.253 11.140 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -4.947 20.623 10.704 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -6.053 21.720 13.127 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -2.198 22.398 11.360 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -5.943 23.894 14.290 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -2.065 24.536 12.592 1.00 0.00 H new ATOM 0 HZ PHE A 119 -3.903 25.306 14.049 1.00 0.00 H new ATOM 1969 N PHE A 120 -6.291 18.345 10.693 1.00 0.00 N ATOM 1970 CA PHE A 120 -7.516 17.992 10.019 1.00 0.00 C ATOM 1971 C PHE A 120 -7.987 16.563 10.230 1.00 0.00 C ATOM 1972 O PHE A 120 -9.122 16.353 10.640 1.00 0.00 O ATOM 1973 CB PHE A 120 -7.197 18.214 8.539 1.00 0.00 C ATOM 1974 CG PHE A 120 -6.983 19.646 8.103 1.00 0.00 C ATOM 1975 CD1 PHE A 120 -7.239 20.729 8.968 1.00 0.00 C ATOM 1976 CD2 PHE A 120 -6.538 19.891 6.793 1.00 0.00 C ATOM 1977 CE1 PHE A 120 -7.105 22.041 8.508 1.00 0.00 C ATOM 1978 CE2 PHE A 120 -6.410 21.208 6.329 1.00 0.00 C ATOM 1979 CZ PHE A 120 -6.705 22.277 7.187 1.00 0.00 C ATOM 0 H PHE A 120 -5.467 18.141 10.128 1.00 0.00 H new ATOM 0 HA PHE A 120 -8.334 18.594 10.414 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -6.300 17.645 8.294 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -8.011 17.795 7.948 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -7.539 20.544 9.989 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -6.294 19.064 6.143 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -7.309 22.870 9.169 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -6.086 21.398 5.316 1.00 0.00 H new ATOM 0 HZ PHE A 120 -6.623 23.291 6.826 1.00 0.00 H new ATOM 1989 N LYS A 121 -7.143 15.577 9.932 1.00 0.00 N ATOM 1990 CA LYS A 121 -7.505 14.170 10.069 1.00 0.00 C ATOM 1991 C LYS A 121 -7.908 13.821 11.498 1.00 0.00 C ATOM 1992 O LYS A 121 -8.710 12.912 11.708 1.00 0.00 O ATOM 1993 CB LYS A 121 -6.448 13.236 9.463 1.00 0.00 C ATOM 1994 CG LYS A 121 -5.275 13.048 10.418 1.00 0.00 C ATOM 1995 CD LYS A 121 -3.979 12.622 9.720 1.00 0.00 C ATOM 1996 CE LYS A 121 -3.996 11.159 9.269 1.00 0.00 C ATOM 1997 NZ LYS A 121 -2.665 10.739 8.793 1.00 0.00 N ATOM 0 H LYS A 121 -6.194 15.731 9.591 1.00 0.00 H new ATOM 0 HA LYS A 121 -8.401 14.001 9.472 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -6.898 12.269 9.239 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -6.091 13.648 8.519 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -5.100 13.981 10.953 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -5.540 12.298 11.163 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.812 13.262 8.853 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -3.140 12.778 10.398 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -4.308 10.523 10.097 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -4.729 11.028 8.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -2.650 9.706 8.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -2.461 11.199 7.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -1.944 11.015 9.490 1.00 0.00 H new ATOM 2011 N VAL A 122 -7.352 14.554 12.466 1.00 0.00 N ATOM 2012 CA VAL A 122 -7.625 14.348 13.875 1.00 0.00 C ATOM 2013 C VAL A 122 -8.916 15.051 14.261 1.00 0.00 C ATOM 2014 O VAL A 122 -9.784 14.376 14.812 1.00 0.00 O ATOM 2015 CB VAL A 122 -6.399 14.680 14.726 1.00 0.00 C ATOM 2016 CG1 VAL A 122 -6.596 14.216 16.176 1.00 0.00 C ATOM 2017 CG2 VAL A 122 -5.215 13.918 14.116 1.00 0.00 C ATOM 0 H VAL A 122 -6.695 15.312 12.283 1.00 0.00 H new ATOM 0 HA VAL A 122 -7.806 13.293 14.082 1.00 0.00 H new ATOM 0 HB VAL A 122 -6.231 15.757 14.736 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -5.710 14.464 16.761 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -7.465 14.717 16.603 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -6.753 13.138 16.195 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.313 14.125 14.692 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -5.421 12.848 14.137 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -5.068 14.239 13.085 1.00 0.00 H new ATOM 2027 N ARG A 123 -9.068 16.355 13.945 1.00 0.00 N ATOM 2028 CA ARG A 123 -10.317 17.090 14.213 1.00 0.00 C ATOM 2029 C ARG A 123 -11.050 16.638 15.476 1.00 0.00 C ATOM 2030 O ARG A 123 -12.155 16.096 15.384 1.00 0.00 O ATOM 2031 CB ARG A 123 -11.246 17.022 12.987 1.00 0.00 C ATOM 2032 CG ARG A 123 -11.474 15.597 12.434 1.00 0.00 C ATOM 2033 CD ARG A 123 -12.151 15.564 11.062 1.00 0.00 C ATOM 2034 NE ARG A 123 -12.023 14.226 10.464 1.00 0.00 N ATOM 2035 CZ ARG A 123 -12.948 13.556 9.753 1.00 0.00 C ATOM 2036 NH1 ARG A 123 -14.220 13.964 9.685 1.00 0.00 N ATOM 2037 NH2 ARG A 123 -12.583 12.448 9.098 1.00 0.00 N ATOM 0 H ARG A 123 -8.340 16.918 13.504 1.00 0.00 H new ATOM 0 HA ARG A 123 -10.027 18.124 14.400 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -12.211 17.453 13.254 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -10.827 17.643 12.195 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -10.513 15.086 12.366 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -12.084 15.036 13.143 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -13.204 15.826 11.162 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -11.698 16.308 10.407 1.00 0.00 H new ATOM 0 HE ARG A 123 -11.131 13.752 10.605 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -14.513 14.806 10.181 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -14.897 13.433 9.137 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -11.617 12.124 9.143 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -13.271 11.927 8.554 1.00 0.00 H new ATOM 2051 N PRO A 124 -10.475 16.851 16.669 1.00 0.00 N ATOM 2052 CA PRO A 124 -11.096 16.426 17.907 1.00 0.00 C ATOM 2053 C PRO A 124 -12.309 17.244 18.333 1.00 0.00 C ATOM 2054 O PRO A 124 -12.614 17.325 19.520 1.00 0.00 O ATOM 2055 CB PRO A 124 -9.965 16.407 18.938 1.00 0.00 C ATOM 2056 CG PRO A 124 -9.128 17.594 18.467 1.00 0.00 C ATOM 2057 CD PRO A 124 -9.189 17.471 16.943 1.00 0.00 C ATOM 0 HA PRO A 124 -11.544 15.440 17.788 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -10.332 16.538 19.956 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -9.404 15.473 18.919 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -9.540 18.542 18.813 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -8.104 17.538 18.836 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -9.111 18.447 16.464 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -8.368 16.863 16.563 1.00 0.00 H new ATOM 2065 N ASP A 125 -13.031 17.803 17.359 1.00 0.00 N ATOM 2066 CA ASP A 125 -14.270 18.514 17.599 1.00 0.00 C ATOM 2067 C ASP A 125 -15.277 18.255 16.482 1.00 0.00 C ATOM 2068 O ASP A 125 -16.369 18.824 16.501 1.00 0.00 O ATOM 2069 CB ASP A 125 -14.024 20.008 17.826 1.00 0.00 C ATOM 2070 CG ASP A 125 -13.094 20.268 19.001 1.00 0.00 C ATOM 2071 OD1 ASP A 125 -13.601 20.362 20.139 1.00 0.00 O ATOM 2072 OD2 ASP A 125 -11.873 20.390 18.756 1.00 0.00 O ATOM 0 H ASP A 125 -12.762 17.770 16.376 1.00 0.00 H new ATOM 0 HA ASP A 125 -14.707 18.127 18.519 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -13.596 20.445 16.924 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -14.976 20.508 18.002 1.00 0.00 H new ATOM 2077 N ASP A 126 -14.924 17.379 15.533 1.00 0.00 N ATOM 2078 CA ASP A 126 -15.783 16.970 14.443 1.00 0.00 C ATOM 2079 C ASP A 126 -16.335 15.584 14.769 1.00 0.00 C ATOM 2080 O ASP A 126 -17.546 15.382 14.718 1.00 0.00 O ATOM 2081 CB ASP A 126 -14.969 16.910 13.146 1.00 0.00 C ATOM 2082 CG ASP A 126 -15.722 16.213 12.018 1.00 0.00 C ATOM 2083 OD1 ASP A 126 -16.533 16.884 11.351 1.00 0.00 O ATOM 2084 OD2 ASP A 126 -15.436 15.014 11.818 1.00 0.00 O ATOM 0 H ASP A 126 -14.008 16.931 15.512 1.00 0.00 H new ATOM 0 HA ASP A 126 -16.600 17.680 14.314 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -14.711 17.922 12.835 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -14.032 16.385 13.332 1.00 0.00 H new