USER MOD reduce.3.24.130724 H: found=0, std=0, add=891, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 892 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 NoAdj-H: B 219 HIS HD1 : B 219 HIS ND1 : B 301 ZNZN :(H bumps) USER MOD Set 1.1: A 7 THR OG1 : rot 136:sc= 0.329 USER MOD Set 1.2: A 9 THR OG1 : rot 180:sc= 0.992 USER MOD Set 2.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A -1 SER OG : rot 170:sc= 0 USER MOD Single : A 0 HIS : no HD1:sc= -0.0632 X(o=-0.063,f=0.0077) USER MOD Single : A 2 GLN : amide:sc= -0.238 K(o=-0.24,f=-4.2!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -2 GLY N :NH3+ 175:sc= 0 (180deg=-0.0223) USER MOD Single : A 11 LYS NZ :NH3+ 155:sc= -0.813 (180deg=-2.2!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -86:sc= 0.518 USER MOD Single : A 20 SER OG : rot -40:sc= 0.528 USER MOD Single : A 22 THR OG1 : rot 36:sc= 0.445 USER MOD Single : A 25 ASN : amide:sc= -0.133 K(o=-0.13,f=-3.2!) USER MOD Single : A 27 LYS NZ :NH3+ 148:sc= 0.7 (180deg=0.378) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.532 X(o=-0.53,f=-0.11) USER MOD Single : A 33 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.361) USER MOD Single : A 40 GLN : amide:sc= -1.02 K(o=-1,f=-1.7) USER MOD Single : A 41 GLN : amide:sc= -3.73! K(o=-3.7!,f=-2.6) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.318 K(o=-0.32,f=-1.8!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -75:sc= 0.191 USER MOD Single : A 60 ASN : amide:sc= -0.0735 X(o=-0.073,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.149 X(o=0.15,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 155:sc= 1.4 (180deg=1.07) USER MOD Single : A 65 SER OG : rot -130:sc= 0.278 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.11 X(o=-0.11,f=-0.57) USER MOD Single : B 196 SER OG : rot 180:sc= 0 USER MOD Single : B 198 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : B 200 THR OG1 : rot 124:sc= 0.186 USER MOD Single : B 201 LYS NZ :NH3+ -164:sc= 0.535 (180deg=0.392) USER MOD Single : B 210 ASN : amide:sc= -0.195 X(o=-0.2,f=0) USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 HIS : no HD1:sc= -0.253 K(o=-0.25,f=-0.88) USER MOD Single : B 217 ASN : amide:sc=-0.00613 K(o=-0.0061,f=-1.7) USER MOD Single : B 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 222 SER OG : rot 180:sc= 0 USER MOD Single : B 225 SER OG : rot 103:sc= 0.354 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 -1.182 2.900 -3.106 1.00 0.00 N ATOM 2 CA GLY A -2 -0.288 2.067 -2.267 1.00 0.00 C ATOM 3 C GLY A -2 1.184 2.328 -2.553 1.00 0.00 C ATOM 4 O GLY A -2 2.001 1.400 -2.549 1.00 0.00 O ATOM 0 H1 GLY A -2 -2.171 2.627 -2.936 1.00 0.00 H new ATOM 0 H2 GLY A -2 -1.053 3.903 -2.862 1.00 0.00 H new ATOM 0 H3 GLY A -2 -0.950 2.756 -4.110 1.00 0.00 H new ATOM 0 HA2 GLY A -2 -0.492 2.266 -1.215 1.00 0.00 H new ATOM 0 HA3 GLY A -2 -0.508 1.014 -2.441 1.00 0.00 H new ATOM 10 N SER A -1 1.531 3.605 -2.786 1.00 0.00 N ATOM 11 CA SER A -1 2.886 4.015 -3.202 1.00 0.00 C ATOM 12 C SER A -1 3.762 4.412 -1.993 1.00 0.00 C ATOM 13 O SER A -1 4.912 3.968 -1.904 1.00 0.00 O ATOM 14 CB SER A -1 2.785 5.182 -4.210 1.00 0.00 C ATOM 15 OG SER A -1 4.053 5.542 -4.735 1.00 0.00 O ATOM 0 H SER A -1 0.880 4.384 -2.691 1.00 0.00 H new ATOM 0 HA SER A -1 3.369 3.163 -3.680 1.00 0.00 H new ATOM 0 HB2 SER A -1 2.121 4.899 -5.027 1.00 0.00 H new ATOM 0 HB3 SER A -1 2.337 6.046 -3.720 1.00 0.00 H new ATOM 0 HG SER A -1 3.933 6.166 -5.481 1.00 0.00 H new ATOM 21 N HIS A 0 3.192 5.231 -1.074 1.00 0.00 N ATOM 22 CA HIS A 0 3.928 5.891 0.049 1.00 0.00 C ATOM 23 C HIS A 0 4.872 7.009 -0.465 1.00 0.00 C ATOM 24 O HIS A 0 5.637 6.810 -1.415 1.00 0.00 O ATOM 25 CB HIS A 0 4.699 4.882 0.972 1.00 0.00 C ATOM 26 CG HIS A 0 3.910 4.375 2.156 1.00 0.00 C ATOM 27 ND1 HIS A 0 2.655 3.815 2.054 1.00 0.00 N ATOM 28 CD2 HIS A 0 4.208 4.371 3.476 1.00 0.00 C ATOM 29 CE1 HIS A 0 2.222 3.497 3.262 1.00 0.00 C ATOM 30 NE2 HIS A 0 3.146 3.824 4.134 1.00 0.00 N ATOM 0 H HIS A 0 2.198 5.458 -1.086 1.00 0.00 H new ATOM 0 HA HIS A 0 3.161 6.349 0.673 1.00 0.00 H new ATOM 0 HB2 HIS A 0 5.013 4.029 0.371 1.00 0.00 H new ATOM 0 HB3 HIS A 0 5.605 5.365 1.337 1.00 0.00 H new ATOM 0 HD2 HIS A 0 5.120 4.734 3.926 1.00 0.00 H new ATOM 0 HE1 HIS A 0 1.269 3.045 3.492 1.00 0.00 H new ATOM 0 HE2 HIS A 0 3.081 3.690 5.143 1.00 0.00 H new ATOM 39 N MET A 1 4.805 8.185 0.196 1.00 0.00 N ATOM 40 CA MET A 1 5.570 9.404 -0.169 1.00 0.00 C ATOM 41 C MET A 1 6.240 9.996 1.089 1.00 0.00 C ATOM 42 O MET A 1 6.206 9.388 2.165 1.00 0.00 O ATOM 43 CB MET A 1 4.621 10.455 -0.811 1.00 0.00 C ATOM 44 CG MET A 1 3.909 9.968 -2.072 1.00 0.00 C ATOM 45 SD MET A 1 5.065 9.519 -3.389 1.00 0.00 S ATOM 46 CE MET A 1 3.956 8.923 -4.667 1.00 0.00 C ATOM 0 H MET A 1 4.209 8.319 1.012 1.00 0.00 H new ATOM 0 HA MET A 1 6.341 9.138 -0.892 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.872 10.749 -0.075 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.197 11.348 -1.054 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.290 9.105 -1.826 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.239 10.749 -2.432 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.536 8.613 -5.537 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.388 8.073 -4.288 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.270 9.720 -4.954 1.00 0.00 H new ATOM 56 N GLN A 2 6.875 11.172 0.938 1.00 0.00 N ATOM 57 CA GLN A 2 7.472 11.923 2.057 1.00 0.00 C ATOM 58 C GLN A 2 6.699 13.227 2.292 1.00 0.00 C ATOM 59 O GLN A 2 6.031 13.712 1.386 1.00 0.00 O ATOM 60 CB GLN A 2 8.971 12.234 1.782 1.00 0.00 C ATOM 61 CG GLN A 2 9.909 11.002 1.792 1.00 0.00 C ATOM 62 CD GLN A 2 10.063 10.267 0.457 1.00 0.00 C ATOM 63 OE1 GLN A 2 9.166 10.244 -0.383 1.00 0.00 O ATOM 64 NE2 GLN A 2 11.215 9.649 0.265 1.00 0.00 N ATOM 0 H GLN A 2 6.989 11.630 0.034 1.00 0.00 H new ATOM 0 HA GLN A 2 7.409 11.305 2.952 1.00 0.00 H new ATOM 0 HB2 GLN A 2 9.052 12.725 0.813 1.00 0.00 H new ATOM 0 HB3 GLN A 2 9.322 12.945 2.530 1.00 0.00 H new ATOM 0 HG2 GLN A 2 10.896 11.324 2.123 1.00 0.00 H new ATOM 0 HG3 GLN A 2 9.539 10.294 2.534 1.00 0.00 H new ATOM 0 HE21 GLN A 2 11.940 9.687 0.982 1.00 0.00 H new ATOM 0 HE22 GLN A 2 11.380 9.134 -0.600 1.00 0.00 H new ATOM 73 N ILE A 3 6.777 13.750 3.533 1.00 0.00 N ATOM 74 CA ILE A 3 6.339 15.128 3.906 1.00 0.00 C ATOM 75 C ILE A 3 7.311 15.703 4.948 1.00 0.00 C ATOM 76 O ILE A 3 7.983 14.944 5.661 1.00 0.00 O ATOM 77 CB ILE A 3 4.852 15.247 4.468 1.00 0.00 C ATOM 78 CG1 ILE A 3 4.578 14.262 5.658 1.00 0.00 C ATOM 79 CG2 ILE A 3 3.803 15.087 3.342 1.00 0.00 C ATOM 80 CD1 ILE A 3 4.406 12.805 5.265 1.00 0.00 C ATOM 0 H ILE A 3 7.151 13.225 4.323 1.00 0.00 H new ATOM 0 HA ILE A 3 6.347 15.694 2.974 1.00 0.00 H new ATOM 0 HB ILE A 3 4.752 16.255 4.871 1.00 0.00 H new ATOM 0 HG12 ILE A 3 5.403 14.336 6.367 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.679 14.589 6.180 1.00 0.00 H new ATOM 0 HG21 ILE A 3 2.801 15.174 3.763 1.00 0.00 H new ATOM 0 HG22 ILE A 3 3.951 15.866 2.594 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.917 14.109 2.875 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.221 12.207 6.157 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.561 12.709 4.583 1.00 0.00 H new ATOM 0 HD13 ILE A 3 5.312 12.452 4.772 1.00 0.00 H new ATOM 92 N PHE A 4 7.366 17.048 5.042 1.00 0.00 N ATOM 93 CA PHE A 4 8.316 17.764 5.921 1.00 0.00 C ATOM 94 C PHE A 4 7.560 18.475 7.059 1.00 0.00 C ATOM 95 O PHE A 4 6.968 19.534 6.867 1.00 0.00 O ATOM 96 CB PHE A 4 9.166 18.772 5.093 1.00 0.00 C ATOM 97 CG PHE A 4 9.943 18.124 3.947 1.00 0.00 C ATOM 98 CD1 PHE A 4 10.849 17.093 4.201 1.00 0.00 C ATOM 99 CD2 PHE A 4 9.746 18.514 2.624 1.00 0.00 C ATOM 100 CE1 PHE A 4 11.547 16.494 3.171 1.00 0.00 C ATOM 101 CE2 PHE A 4 10.444 17.911 1.596 1.00 0.00 C ATOM 102 CZ PHE A 4 11.336 16.894 1.867 1.00 0.00 C ATOM 0 H PHE A 4 6.754 17.668 4.512 1.00 0.00 H new ATOM 0 HA PHE A 4 8.996 17.040 6.370 1.00 0.00 H new ATOM 0 HB2 PHE A 4 8.508 19.540 4.686 1.00 0.00 H new ATOM 0 HB3 PHE A 4 9.868 19.274 5.758 1.00 0.00 H new ATOM 0 HD1 PHE A 4 11.006 16.759 5.216 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.038 19.298 2.399 1.00 0.00 H new ATOM 0 HE1 PHE A 4 12.259 15.711 3.386 1.00 0.00 H new ATOM 0 HE2 PHE A 4 10.291 18.236 0.578 1.00 0.00 H new ATOM 0 HZ PHE A 4 11.868 16.412 1.060 1.00 0.00 H new ATOM 112 N VAL A 5 7.569 17.854 8.240 1.00 0.00 N ATOM 113 CA VAL A 5 6.942 18.387 9.455 1.00 0.00 C ATOM 114 C VAL A 5 8.051 18.980 10.335 1.00 0.00 C ATOM 115 O VAL A 5 8.821 18.244 10.925 1.00 0.00 O ATOM 116 CB VAL A 5 6.163 17.251 10.214 1.00 0.00 C ATOM 117 CG1 VAL A 5 5.583 17.762 11.541 1.00 0.00 C ATOM 118 CG2 VAL A 5 5.039 16.663 9.326 1.00 0.00 C ATOM 0 H VAL A 5 8.020 16.950 8.383 1.00 0.00 H new ATOM 0 HA VAL A 5 6.217 19.161 9.203 1.00 0.00 H new ATOM 0 HB VAL A 5 6.877 16.459 10.439 1.00 0.00 H new ATOM 0 HG11 VAL A 5 5.051 16.953 12.041 1.00 0.00 H new ATOM 0 HG12 VAL A 5 6.393 18.113 12.181 1.00 0.00 H new ATOM 0 HG13 VAL A 5 4.893 18.583 11.345 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.515 15.879 9.873 1.00 0.00 H new ATOM 0 HG22 VAL A 5 4.336 17.452 9.060 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.474 16.243 8.419 1.00 0.00 H new ATOM 128 N LYS A 6 8.144 20.310 10.373 1.00 0.00 N ATOM 129 CA LYS A 6 9.245 21.034 11.029 1.00 0.00 C ATOM 130 C LYS A 6 8.808 21.587 12.398 1.00 0.00 C ATOM 131 O LYS A 6 7.807 22.305 12.480 1.00 0.00 O ATOM 132 CB LYS A 6 9.701 22.186 10.103 1.00 0.00 C ATOM 133 CG LYS A 6 11.049 22.815 10.492 1.00 0.00 C ATOM 134 CD LYS A 6 11.563 23.804 9.428 1.00 0.00 C ATOM 135 CE LYS A 6 12.992 24.259 9.722 1.00 0.00 C ATOM 136 NZ LYS A 6 13.495 25.220 8.706 1.00 0.00 N ATOM 0 H LYS A 6 7.452 20.926 9.946 1.00 0.00 H new ATOM 0 HA LYS A 6 10.073 20.347 11.203 1.00 0.00 H new ATOM 0 HB2 LYS A 6 9.770 21.810 9.082 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.937 22.963 10.106 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.944 23.333 11.445 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.787 22.026 10.638 1.00 0.00 H new ATOM 0 HD2 LYS A 6 11.526 23.333 8.446 1.00 0.00 H new ATOM 0 HD3 LYS A 6 10.905 24.672 9.390 1.00 0.00 H new ATOM 0 HE2 LYS A 6 13.028 24.723 10.708 1.00 0.00 H new ATOM 0 HE3 LYS A 6 13.649 23.390 9.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 14.467 25.501 8.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 13.486 24.770 7.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 12.885 26.062 8.692 1.00 0.00 H new ATOM 150 N THR A 7 9.582 21.279 13.459 1.00 0.00 N ATOM 151 CA THR A 7 9.282 21.719 14.828 1.00 0.00 C ATOM 152 C THR A 7 9.497 23.229 15.029 1.00 0.00 C ATOM 153 O THR A 7 10.141 23.907 14.216 1.00 0.00 O ATOM 154 CB THR A 7 10.152 20.970 15.886 1.00 0.00 C ATOM 155 OG1 THR A 7 11.539 21.141 15.564 1.00 0.00 O ATOM 156 CG2 THR A 7 9.818 19.482 15.981 1.00 0.00 C ATOM 0 H THR A 7 10.431 20.718 13.386 1.00 0.00 H new ATOM 0 HA THR A 7 8.228 21.482 14.973 1.00 0.00 H new ATOM 0 HB THR A 7 9.930 21.405 16.861 1.00 0.00 H new ATOM 0 HG1 THR A 7 12.041 21.351 16.379 1.00 0.00 H new ATOM 0 HG21 THR A 7 10.454 19.014 16.732 1.00 0.00 H new ATOM 0 HG22 THR A 7 8.772 19.361 16.264 1.00 0.00 H new ATOM 0 HG23 THR A 7 9.989 19.008 15.014 1.00 0.00 H new ATOM 164 N LEU A 8 8.970 23.721 16.163 1.00 0.00 N ATOM 165 CA LEU A 8 9.200 25.090 16.647 1.00 0.00 C ATOM 166 C LEU A 8 10.667 25.293 17.077 1.00 0.00 C ATOM 167 O LEU A 8 11.157 26.425 17.108 1.00 0.00 O ATOM 168 CB LEU A 8 8.277 25.382 17.845 1.00 0.00 C ATOM 169 CG LEU A 8 6.757 25.160 17.629 1.00 0.00 C ATOM 170 CD1 LEU A 8 5.975 25.467 18.919 1.00 0.00 C ATOM 171 CD2 LEU A 8 6.223 25.975 16.433 1.00 0.00 C ATOM 0 H LEU A 8 8.366 23.172 16.775 1.00 0.00 H new ATOM 0 HA LEU A 8 8.980 25.776 15.829 1.00 0.00 H new ATOM 0 HB2 LEU A 8 8.596 24.757 18.679 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.429 26.418 18.146 1.00 0.00 H new ATOM 0 HG LEU A 8 6.605 24.109 17.385 1.00 0.00 H new ATOM 0 HD11 LEU A 8 4.911 25.305 18.747 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.317 24.809 19.717 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.142 26.505 19.208 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.155 25.792 16.316 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.391 27.037 16.612 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.745 25.673 15.525 1.00 0.00 H new ATOM 183 N THR A 9 11.345 24.176 17.420 1.00 0.00 N ATOM 184 CA THR A 9 12.772 24.175 17.778 1.00 0.00 C ATOM 185 C THR A 9 13.645 24.246 16.508 1.00 0.00 C ATOM 186 O THR A 9 14.839 24.551 16.581 1.00 0.00 O ATOM 187 CB THR A 9 13.138 22.917 18.639 1.00 0.00 C ATOM 188 OG1 THR A 9 12.804 21.714 17.930 1.00 0.00 O ATOM 189 CG2 THR A 9 12.411 22.915 19.995 1.00 0.00 C ATOM 0 H THR A 9 10.914 23.252 17.455 1.00 0.00 H new ATOM 0 HA THR A 9 12.972 25.059 18.383 1.00 0.00 H new ATOM 0 HB THR A 9 14.211 22.959 18.824 1.00 0.00 H new ATOM 0 HG1 THR A 9 13.039 20.936 18.477 1.00 0.00 H new ATOM 0 HG21 THR A 9 12.694 22.026 20.558 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.690 23.805 20.559 1.00 0.00 H new ATOM 0 HG23 THR A 9 11.334 22.912 19.830 1.00 0.00 H new ATOM 197 N GLY A 10 13.026 23.949 15.344 1.00 0.00 N ATOM 198 CA GLY A 10 13.629 24.216 14.038 1.00 0.00 C ATOM 199 C GLY A 10 14.154 22.988 13.314 1.00 0.00 C ATOM 200 O GLY A 10 14.771 23.132 12.252 1.00 0.00 O ATOM 0 H GLY A 10 12.102 23.521 15.293 1.00 0.00 H new ATOM 0 HA2 GLY A 10 12.888 24.704 13.405 1.00 0.00 H new ATOM 0 HA3 GLY A 10 14.450 24.921 14.170 1.00 0.00 H new ATOM 204 N LYS A 11 13.920 21.782 13.862 1.00 0.00 N ATOM 205 CA LYS A 11 14.347 20.524 13.215 1.00 0.00 C ATOM 206 C LYS A 11 13.272 20.108 12.193 1.00 0.00 C ATOM 207 O LYS A 11 12.098 20.424 12.377 1.00 0.00 O ATOM 208 CB LYS A 11 14.581 19.385 14.263 1.00 0.00 C ATOM 209 CG LYS A 11 13.322 18.579 14.635 1.00 0.00 C ATOM 210 CD LYS A 11 13.551 17.417 15.632 1.00 0.00 C ATOM 211 CE LYS A 11 14.127 16.144 14.979 1.00 0.00 C ATOM 212 NZ LYS A 11 15.476 16.335 14.392 1.00 0.00 N ATOM 0 H LYS A 11 13.438 21.650 14.751 1.00 0.00 H new ATOM 0 HA LYS A 11 15.299 20.690 12.710 1.00 0.00 H new ATOM 0 HB2 LYS A 11 15.332 18.699 13.871 1.00 0.00 H new ATOM 0 HB3 LYS A 11 14.994 19.825 15.170 1.00 0.00 H new ATOM 0 HG2 LYS A 11 12.586 19.261 15.061 1.00 0.00 H new ATOM 0 HG3 LYS A 11 12.888 18.172 13.722 1.00 0.00 H new ATOM 0 HD2 LYS A 11 14.230 17.751 16.416 1.00 0.00 H new ATOM 0 HD3 LYS A 11 12.604 17.171 16.113 1.00 0.00 H new ATOM 0 HE2 LYS A 11 14.174 15.352 15.726 1.00 0.00 H new ATOM 0 HE3 LYS A 11 13.445 15.806 14.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 15.973 15.422 14.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 15.385 16.714 13.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 16.018 17.003 14.977 1.00 0.00 H new ATOM 226 N THR A 12 13.670 19.405 11.132 1.00 0.00 N ATOM 227 CA THR A 12 12.737 18.895 10.110 1.00 0.00 C ATOM 228 C THR A 12 12.575 17.375 10.248 1.00 0.00 C ATOM 229 O THR A 12 13.563 16.630 10.247 1.00 0.00 O ATOM 230 CB THR A 12 13.248 19.232 8.683 1.00 0.00 C ATOM 231 OG1 THR A 12 13.431 20.656 8.563 1.00 0.00 O ATOM 232 CG2 THR A 12 12.283 18.735 7.571 1.00 0.00 C ATOM 0 H THR A 12 14.646 19.170 10.951 1.00 0.00 H new ATOM 0 HA THR A 12 11.772 19.377 10.264 1.00 0.00 H new ATOM 0 HB THR A 12 14.196 18.712 8.545 1.00 0.00 H new ATOM 0 HG1 THR A 12 13.755 20.869 7.663 1.00 0.00 H new ATOM 0 HG21 THR A 12 12.688 18.997 6.594 1.00 0.00 H new ATOM 0 HG22 THR A 12 12.174 17.653 7.641 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.308 19.206 7.698 1.00 0.00 H new ATOM 240 N ILE A 13 11.324 16.937 10.365 1.00 0.00 N ATOM 241 CA ILE A 13 10.961 15.515 10.467 1.00 0.00 C ATOM 242 C ILE A 13 10.317 15.067 9.146 1.00 0.00 C ATOM 243 O ILE A 13 9.225 15.518 8.802 1.00 0.00 O ATOM 244 CB ILE A 13 9.988 15.232 11.678 1.00 0.00 C ATOM 245 CG1 ILE A 13 10.593 15.741 13.028 1.00 0.00 C ATOM 246 CG2 ILE A 13 9.655 13.735 11.782 1.00 0.00 C ATOM 247 CD1 ILE A 13 10.352 17.205 13.320 1.00 0.00 C ATOM 0 H ILE A 13 10.519 17.563 10.393 1.00 0.00 H new ATOM 0 HA ILE A 13 11.870 14.943 10.654 1.00 0.00 H new ATOM 0 HB ILE A 13 9.067 15.782 11.486 1.00 0.00 H new ATOM 0 HG12 ILE A 13 10.176 15.149 13.843 1.00 0.00 H new ATOM 0 HG13 ILE A 13 11.668 15.559 13.020 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.983 13.569 12.624 1.00 0.00 H new ATOM 0 HG22 ILE A 13 9.172 13.405 10.862 1.00 0.00 H new ATOM 0 HG23 ILE A 13 10.573 13.168 11.933 1.00 0.00 H new ATOM 0 HD11 ILE A 13 10.808 17.465 14.275 1.00 0.00 H new ATOM 0 HD12 ILE A 13 10.795 17.811 12.530 1.00 0.00 H new ATOM 0 HD13 ILE A 13 9.280 17.395 13.366 1.00 0.00 H new ATOM 259 N THR A 14 11.027 14.216 8.396 1.00 0.00 N ATOM 260 CA THR A 14 10.525 13.632 7.146 1.00 0.00 C ATOM 261 C THR A 14 9.803 12.306 7.453 1.00 0.00 C ATOM 262 O THR A 14 10.407 11.396 8.027 1.00 0.00 O ATOM 263 CB THR A 14 11.699 13.397 6.142 1.00 0.00 C ATOM 264 OG1 THR A 14 12.382 14.641 5.911 1.00 0.00 O ATOM 265 CG2 THR A 14 11.212 12.818 4.799 1.00 0.00 C ATOM 0 H THR A 14 11.970 13.912 8.640 1.00 0.00 H new ATOM 0 HA THR A 14 9.820 14.324 6.685 1.00 0.00 H new ATOM 0 HB THR A 14 12.375 12.667 6.586 1.00 0.00 H new ATOM 0 HG1 THR A 14 11.934 15.131 5.190 1.00 0.00 H new ATOM 0 HG21 THR A 14 12.064 12.672 4.135 1.00 0.00 H new ATOM 0 HG22 THR A 14 10.720 11.861 4.972 1.00 0.00 H new ATOM 0 HG23 THR A 14 10.507 13.510 4.338 1.00 0.00 H new ATOM 273 N LEU A 15 8.505 12.216 7.103 1.00 0.00 N ATOM 274 CA LEU A 15 7.681 11.010 7.359 1.00 0.00 C ATOM 275 C LEU A 15 7.431 10.272 6.058 1.00 0.00 C ATOM 276 O LEU A 15 7.360 10.887 4.993 1.00 0.00 O ATOM 277 CB LEU A 15 6.311 11.348 8.015 1.00 0.00 C ATOM 278 CG LEU A 15 6.354 12.183 9.324 1.00 0.00 C ATOM 279 CD1 LEU A 15 7.398 11.641 10.302 1.00 0.00 C ATOM 280 CD2 LEU A 15 6.582 13.671 9.035 1.00 0.00 C ATOM 0 H LEU A 15 7.998 12.969 6.638 1.00 0.00 H new ATOM 0 HA LEU A 15 8.242 10.387 8.056 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.708 11.889 7.286 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.794 10.412 8.225 1.00 0.00 H new ATOM 0 HG LEU A 15 5.378 12.087 9.800 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.400 12.250 11.206 1.00 0.00 H new ATOM 0 HD12 LEU A 15 7.155 10.610 10.559 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.384 11.677 9.838 1.00 0.00 H new ATOM 0 HD21 LEU A 15 6.606 14.224 9.974 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.531 13.799 8.513 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.771 14.049 8.412 1.00 0.00 H new ATOM 292 N GLU A 16 7.247 8.954 6.178 1.00 0.00 N ATOM 293 CA GLU A 16 7.105 8.043 5.040 1.00 0.00 C ATOM 294 C GLU A 16 5.656 7.531 4.999 1.00 0.00 C ATOM 295 O GLU A 16 5.360 6.429 5.482 1.00 0.00 O ATOM 296 CB GLU A 16 8.121 6.870 5.180 1.00 0.00 C ATOM 297 CG GLU A 16 9.566 7.292 5.515 1.00 0.00 C ATOM 298 CD GLU A 16 10.195 8.257 4.496 1.00 0.00 C ATOM 299 OE1 GLU A 16 10.506 7.827 3.361 1.00 0.00 O ATOM 300 OE2 GLU A 16 10.419 9.441 4.838 1.00 0.00 O ATOM 0 H GLU A 16 7.192 8.484 7.082 1.00 0.00 H new ATOM 0 HA GLU A 16 7.320 8.559 4.105 1.00 0.00 H new ATOM 0 HB2 GLU A 16 7.767 6.194 5.958 1.00 0.00 H new ATOM 0 HB3 GLU A 16 8.131 6.305 4.248 1.00 0.00 H new ATOM 0 HG2 GLU A 16 9.576 7.763 6.498 1.00 0.00 H new ATOM 0 HG3 GLU A 16 10.187 6.399 5.583 1.00 0.00 H new ATOM 307 N VAL A 17 4.739 8.385 4.487 1.00 0.00 N ATOM 308 CA VAL A 17 3.284 8.092 4.425 1.00 0.00 C ATOM 309 C VAL A 17 2.704 8.706 3.138 1.00 0.00 C ATOM 310 O VAL A 17 3.377 9.479 2.448 1.00 0.00 O ATOM 311 CB VAL A 17 2.460 8.636 5.679 1.00 0.00 C ATOM 312 CG1 VAL A 17 3.136 8.324 7.031 1.00 0.00 C ATOM 313 CG2 VAL A 17 2.133 10.141 5.567 1.00 0.00 C ATOM 0 H VAL A 17 4.985 9.298 4.104 1.00 0.00 H new ATOM 0 HA VAL A 17 3.184 7.007 4.435 1.00 0.00 H new ATOM 0 HB VAL A 17 1.518 8.088 5.656 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.526 8.720 7.843 1.00 0.00 H new ATOM 0 HG12 VAL A 17 3.237 7.245 7.147 1.00 0.00 H new ATOM 0 HG13 VAL A 17 4.123 8.786 7.060 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.572 10.458 6.446 1.00 0.00 H new ATOM 0 HG22 VAL A 17 3.060 10.711 5.503 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.536 10.318 4.672 1.00 0.00 H new ATOM 323 N GLU A 18 1.441 8.396 2.846 1.00 0.00 N ATOM 324 CA GLU A 18 0.755 8.914 1.651 1.00 0.00 C ATOM 325 C GLU A 18 -0.014 10.209 2.004 1.00 0.00 C ATOM 326 O GLU A 18 -0.309 10.443 3.183 1.00 0.00 O ATOM 327 CB GLU A 18 -0.211 7.832 1.101 1.00 0.00 C ATOM 328 CG GLU A 18 0.353 6.406 1.177 1.00 0.00 C ATOM 329 CD GLU A 18 -0.405 5.403 0.307 1.00 0.00 C ATOM 330 OE1 GLU A 18 -1.428 4.853 0.764 1.00 0.00 O ATOM 331 OE2 GLU A 18 0.018 5.164 -0.841 1.00 0.00 O ATOM 0 H GLU A 18 0.864 7.784 3.423 1.00 0.00 H new ATOM 0 HA GLU A 18 1.489 9.152 0.881 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.146 7.874 1.660 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.450 8.064 0.063 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.399 6.421 0.872 1.00 0.00 H new ATOM 0 HG3 GLU A 18 0.327 6.068 2.213 1.00 0.00 H new ATOM 338 N PRO A 19 -0.336 11.094 1.004 1.00 0.00 N ATOM 339 CA PRO A 19 -1.268 12.224 1.222 1.00 0.00 C ATOM 340 C PRO A 19 -2.658 11.746 1.715 1.00 0.00 C ATOM 341 O PRO A 19 -3.288 12.395 2.541 1.00 0.00 O ATOM 342 CB PRO A 19 -1.341 12.928 -0.166 1.00 0.00 C ATOM 343 CG PRO A 19 -0.806 11.916 -1.139 1.00 0.00 C ATOM 344 CD PRO A 19 0.220 11.113 -0.373 1.00 0.00 C ATOM 0 HA PRO A 19 -0.926 12.899 2.007 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.364 13.211 -0.412 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.746 13.841 -0.178 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.603 11.275 -1.515 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.355 12.404 -2.003 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.331 10.107 -0.778 1.00 0.00 H new ATOM 0 HD3 PRO A 19 1.205 11.580 -0.405 1.00 0.00 H new ATOM 352 N SER A 20 -3.104 10.566 1.242 1.00 0.00 N ATOM 353 CA SER A 20 -4.424 10.003 1.603 1.00 0.00 C ATOM 354 C SER A 20 -4.269 8.890 2.668 1.00 0.00 C ATOM 355 O SER A 20 -5.173 8.068 2.851 1.00 0.00 O ATOM 356 CB SER A 20 -5.131 9.482 0.326 1.00 0.00 C ATOM 357 OG SER A 20 -6.460 9.039 0.579 1.00 0.00 O ATOM 0 H SER A 20 -2.566 9.979 0.604 1.00 0.00 H new ATOM 0 HA SER A 20 -5.044 10.784 2.043 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.152 10.274 -0.422 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.552 8.660 -0.096 1.00 0.00 H new ATOM 0 HG SER A 20 -6.487 8.557 1.432 1.00 0.00 H new ATOM 363 N ASP A 21 -3.132 8.903 3.407 1.00 0.00 N ATOM 364 CA ASP A 21 -2.870 7.919 4.477 1.00 0.00 C ATOM 365 C ASP A 21 -3.779 8.252 5.697 1.00 0.00 C ATOM 366 O ASP A 21 -4.898 7.739 5.781 1.00 0.00 O ATOM 367 CB ASP A 21 -1.350 7.904 4.829 1.00 0.00 C ATOM 368 CG ASP A 21 -0.871 6.603 5.499 1.00 0.00 C ATOM 369 OD1 ASP A 21 -1.294 6.317 6.633 1.00 0.00 O ATOM 370 OD2 ASP A 21 -0.048 5.871 4.889 1.00 0.00 O ATOM 0 H ASP A 21 -2.385 9.585 3.279 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.117 6.910 4.147 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -0.775 8.063 3.916 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -1.133 8.742 5.492 1.00 0.00 H new ATOM 375 N THR A 22 -3.295 9.145 6.599 1.00 0.00 N ATOM 376 CA THR A 22 -4.078 9.775 7.694 1.00 0.00 C ATOM 377 C THR A 22 -3.129 10.597 8.582 1.00 0.00 C ATOM 378 O THR A 22 -1.957 10.240 8.737 1.00 0.00 O ATOM 379 CB THR A 22 -4.916 8.778 8.593 1.00 0.00 C ATOM 380 OG1 THR A 22 -5.604 9.496 9.629 1.00 0.00 O ATOM 381 CG2 THR A 22 -4.064 7.678 9.232 1.00 0.00 C ATOM 0 H THR A 22 -2.323 9.455 6.584 1.00 0.00 H new ATOM 0 HA THR A 22 -4.820 10.402 7.200 1.00 0.00 H new ATOM 0 HB THR A 22 -5.628 8.295 7.924 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.902 10.363 9.283 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.700 7.029 9.835 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.583 7.090 8.450 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.302 8.130 9.866 1.00 0.00 H new ATOM 389 N ILE A 23 -3.661 11.691 9.166 1.00 0.00 N ATOM 390 CA ILE A 23 -2.910 12.619 10.037 1.00 0.00 C ATOM 391 C ILE A 23 -2.421 11.890 11.305 1.00 0.00 C ATOM 392 O ILE A 23 -1.297 12.128 11.776 1.00 0.00 O ATOM 393 CB ILE A 23 -3.801 13.863 10.443 1.00 0.00 C ATOM 394 CG1 ILE A 23 -4.209 14.723 9.198 1.00 0.00 C ATOM 395 CG2 ILE A 23 -3.128 14.748 11.519 1.00 0.00 C ATOM 396 CD1 ILE A 23 -3.050 15.351 8.441 1.00 0.00 C ATOM 0 H ILE A 23 -4.638 11.958 9.044 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.047 12.979 9.477 1.00 0.00 H new ATOM 0 HB ILE A 23 -4.710 13.450 10.881 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.774 14.094 8.510 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -4.880 15.516 9.528 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.781 15.586 11.761 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.949 14.156 12.417 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.179 15.125 11.138 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.434 15.925 7.598 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -2.496 16.012 9.107 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -2.388 14.567 8.074 1.00 0.00 H new ATOM 408 N GLU A 24 -3.282 10.996 11.833 1.00 0.00 N ATOM 409 CA GLU A 24 -2.980 10.185 13.033 1.00 0.00 C ATOM 410 C GLU A 24 -1.738 9.296 12.813 1.00 0.00 C ATOM 411 O GLU A 24 -0.953 9.049 13.744 1.00 0.00 O ATOM 412 CB GLU A 24 -4.214 9.327 13.408 1.00 0.00 C ATOM 413 CG GLU A 24 -4.130 8.620 14.778 1.00 0.00 C ATOM 414 CD GLU A 24 -5.468 7.997 15.213 1.00 0.00 C ATOM 415 OE1 GLU A 24 -6.304 8.708 15.809 1.00 0.00 O ATOM 416 OE2 GLU A 24 -5.702 6.800 14.941 1.00 0.00 O ATOM 0 H GLU A 24 -4.206 10.815 11.441 1.00 0.00 H new ATOM 0 HA GLU A 24 -2.753 10.860 13.858 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -5.097 9.966 13.400 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -4.360 8.572 12.636 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -3.370 7.840 14.733 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -3.807 9.337 15.532 1.00 0.00 H new ATOM 423 N ASN A 25 -1.556 8.844 11.562 1.00 0.00 N ATOM 424 CA ASN A 25 -0.401 8.019 11.174 1.00 0.00 C ATOM 425 C ASN A 25 0.859 8.876 11.083 1.00 0.00 C ATOM 426 O ASN A 25 1.912 8.471 11.557 1.00 0.00 O ATOM 427 CB ASN A 25 -0.649 7.339 9.820 1.00 0.00 C ATOM 428 CG ASN A 25 0.374 6.253 9.498 1.00 0.00 C ATOM 429 OD1 ASN A 25 1.371 6.501 8.839 1.00 0.00 O ATOM 430 ND2 ASN A 25 0.149 5.053 10.000 1.00 0.00 N ATOM 0 H ASN A 25 -2.201 9.038 10.796 1.00 0.00 H new ATOM 0 HA ASN A 25 -0.265 7.254 11.938 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -1.647 6.901 9.818 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.630 8.093 9.033 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.819 4.300 9.841 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -0.694 4.879 10.547 1.00 0.00 H new ATOM 437 N VAL A 26 0.707 10.070 10.474 1.00 0.00 N ATOM 438 CA VAL A 26 1.825 11.021 10.256 1.00 0.00 C ATOM 439 C VAL A 26 2.498 11.362 11.597 1.00 0.00 C ATOM 440 O VAL A 26 3.718 11.296 11.724 1.00 0.00 O ATOM 441 CB VAL A 26 1.353 12.361 9.556 1.00 0.00 C ATOM 442 CG1 VAL A 26 2.534 13.340 9.304 1.00 0.00 C ATOM 443 CG2 VAL A 26 0.604 12.071 8.242 1.00 0.00 C ATOM 0 H VAL A 26 -0.189 10.404 10.120 1.00 0.00 H new ATOM 0 HA VAL A 26 2.534 10.528 9.591 1.00 0.00 H new ATOM 0 HB VAL A 26 0.665 12.848 10.247 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.161 14.244 8.822 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.999 13.601 10.254 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.271 12.863 8.658 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.293 13.011 7.785 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.263 11.536 7.558 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -0.275 11.461 8.451 1.00 0.00 H new ATOM 453 N LYS A 27 1.662 11.679 12.596 1.00 0.00 N ATOM 454 CA LYS A 27 2.121 12.064 13.941 1.00 0.00 C ATOM 455 C LYS A 27 2.638 10.860 14.751 1.00 0.00 C ATOM 456 O LYS A 27 3.463 11.025 15.666 1.00 0.00 O ATOM 457 CB LYS A 27 0.998 12.800 14.691 1.00 0.00 C ATOM 458 CG LYS A 27 -0.273 11.991 14.971 1.00 0.00 C ATOM 459 CD LYS A 27 -1.326 12.818 15.736 1.00 0.00 C ATOM 460 CE LYS A 27 -1.844 14.018 14.931 1.00 0.00 C ATOM 461 NZ LYS A 27 -2.677 14.930 15.763 1.00 0.00 N ATOM 0 H LYS A 27 0.647 11.676 12.495 1.00 0.00 H new ATOM 0 HA LYS A 27 2.967 12.740 13.821 1.00 0.00 H new ATOM 0 HB2 LYS A 27 1.396 13.153 15.642 1.00 0.00 H new ATOM 0 HB3 LYS A 27 0.722 13.683 14.114 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -0.698 11.645 14.029 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -0.018 11.104 15.550 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -2.165 12.174 15.999 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -0.892 13.174 16.670 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -0.999 14.572 14.521 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -2.432 13.661 14.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -2.561 15.908 15.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -3.677 14.654 15.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -2.375 14.866 16.756 1.00 0.00 H new ATOM 475 N ALA A 28 2.139 9.653 14.420 1.00 0.00 N ATOM 476 CA ALA A 28 2.701 8.395 14.946 1.00 0.00 C ATOM 477 C ALA A 28 4.127 8.177 14.400 1.00 0.00 C ATOM 478 O ALA A 28 4.993 7.636 15.097 1.00 0.00 O ATOM 479 CB ALA A 28 1.785 7.215 14.591 1.00 0.00 C ATOM 0 H ALA A 28 1.347 9.523 13.790 1.00 0.00 H new ATOM 0 HA ALA A 28 2.762 8.461 16.032 1.00 0.00 H new ATOM 0 HB1 ALA A 28 2.211 6.292 14.985 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.799 7.375 15.028 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.693 7.139 13.508 1.00 0.00 H new ATOM 485 N LYS A 29 4.353 8.615 13.142 1.00 0.00 N ATOM 486 CA LYS A 29 5.679 8.588 12.518 1.00 0.00 C ATOM 487 C LYS A 29 6.611 9.663 13.119 1.00 0.00 C ATOM 488 O LYS A 29 7.805 9.441 13.163 1.00 0.00 O ATOM 489 CB LYS A 29 5.584 8.745 10.981 1.00 0.00 C ATOM 490 CG LYS A 29 4.696 7.721 10.272 1.00 0.00 C ATOM 491 CD LYS A 29 5.074 6.264 10.595 1.00 0.00 C ATOM 492 CE LYS A 29 4.105 5.274 9.948 1.00 0.00 C ATOM 493 NZ LYS A 29 4.442 3.872 10.296 1.00 0.00 N ATOM 0 H LYS A 29 3.622 8.993 12.540 1.00 0.00 H new ATOM 0 HA LYS A 29 6.113 7.611 12.731 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.209 9.744 10.757 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.589 8.681 10.563 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.658 7.892 10.556 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.762 7.876 9.195 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.087 6.064 10.245 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.076 6.119 11.675 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.088 5.495 10.272 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.128 5.396 8.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.764 3.229 9.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.403 3.654 9.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.395 3.750 11.328 1.00 0.00 H new ATOM 507 N ILE A 30 6.074 10.839 13.548 1.00 0.00 N ATOM 508 CA ILE A 30 6.852 11.823 14.355 1.00 0.00 C ATOM 509 C ILE A 30 7.461 11.128 15.598 1.00 0.00 C ATOM 510 O ILE A 30 8.649 11.297 15.906 1.00 0.00 O ATOM 511 CB ILE A 30 5.975 13.096 14.771 1.00 0.00 C ATOM 512 CG1 ILE A 30 5.994 14.202 13.655 1.00 0.00 C ATOM 513 CG2 ILE A 30 6.390 13.705 16.136 1.00 0.00 C ATOM 514 CD1 ILE A 30 5.073 13.971 12.477 1.00 0.00 C ATOM 0 H ILE A 30 5.116 11.127 13.351 1.00 0.00 H new ATOM 0 HA ILE A 30 7.662 12.198 13.730 1.00 0.00 H new ATOM 0 HB ILE A 30 4.956 12.725 14.882 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.734 15.156 14.113 1.00 0.00 H new ATOM 0 HG13 ILE A 30 7.014 14.295 13.281 1.00 0.00 H new ATOM 0 HG21 ILE A 30 5.757 14.564 16.359 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.274 12.956 16.919 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.431 14.024 16.091 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.170 14.796 11.772 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.342 13.038 11.982 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.042 13.912 12.827 1.00 0.00 H new ATOM 526 N GLN A 31 6.634 10.315 16.270 1.00 0.00 N ATOM 527 CA GLN A 31 7.058 9.509 17.427 1.00 0.00 C ATOM 528 C GLN A 31 8.119 8.457 17.027 1.00 0.00 C ATOM 529 O GLN A 31 9.002 8.119 17.817 1.00 0.00 O ATOM 530 CB GLN A 31 5.823 8.826 18.059 1.00 0.00 C ATOM 531 CG GLN A 31 6.114 8.041 19.349 1.00 0.00 C ATOM 532 CD GLN A 31 4.875 7.373 19.972 1.00 0.00 C ATOM 533 OE1 GLN A 31 4.783 7.236 21.190 1.00 0.00 O ATOM 534 NE2 GLN A 31 3.934 6.921 19.149 1.00 0.00 N ATOM 0 H GLN A 31 5.650 10.196 16.027 1.00 0.00 H new ATOM 0 HA GLN A 31 7.520 10.171 18.160 1.00 0.00 H new ATOM 0 HB2 GLN A 31 5.074 9.588 18.274 1.00 0.00 H new ATOM 0 HB3 GLN A 31 5.386 8.147 17.327 1.00 0.00 H new ATOM 0 HG2 GLN A 31 6.858 7.274 19.134 1.00 0.00 H new ATOM 0 HG3 GLN A 31 6.556 8.717 20.081 1.00 0.00 H new ATOM 0 HE21 GLN A 31 4.034 7.047 18.142 1.00 0.00 H new ATOM 0 HE22 GLN A 31 3.112 6.448 19.525 1.00 0.00 H new ATOM 543 N ASP A 32 8.006 7.950 15.795 1.00 0.00 N ATOM 544 CA ASP A 32 8.966 6.979 15.231 1.00 0.00 C ATOM 545 C ASP A 32 10.312 7.658 14.878 1.00 0.00 C ATOM 546 O ASP A 32 11.372 7.049 15.033 1.00 0.00 O ATOM 547 CB ASP A 32 8.346 6.312 13.972 1.00 0.00 C ATOM 548 CG ASP A 32 9.263 5.267 13.303 1.00 0.00 C ATOM 549 OD1 ASP A 32 9.235 4.090 13.721 1.00 0.00 O ATOM 550 OD2 ASP A 32 10.007 5.618 12.356 1.00 0.00 O ATOM 0 H ASP A 32 7.250 8.197 15.157 1.00 0.00 H new ATOM 0 HA ASP A 32 9.171 6.216 15.982 1.00 0.00 H new ATOM 0 HB2 ASP A 32 7.408 5.832 14.252 1.00 0.00 H new ATOM 0 HB3 ASP A 32 8.103 7.087 13.245 1.00 0.00 H new ATOM 555 N LYS A 33 10.257 8.926 14.423 1.00 0.00 N ATOM 556 CA LYS A 33 11.432 9.638 13.875 1.00 0.00 C ATOM 557 C LYS A 33 12.165 10.426 14.981 1.00 0.00 C ATOM 558 O LYS A 33 13.280 10.055 15.370 1.00 0.00 O ATOM 559 CB LYS A 33 10.999 10.599 12.735 1.00 0.00 C ATOM 560 CG LYS A 33 10.337 9.935 11.506 1.00 0.00 C ATOM 561 CD LYS A 33 11.297 9.115 10.622 1.00 0.00 C ATOM 562 CE LYS A 33 10.571 8.481 9.418 1.00 0.00 C ATOM 563 NZ LYS A 33 11.506 7.697 8.564 1.00 0.00 N ATOM 0 H LYS A 33 9.403 9.484 14.424 1.00 0.00 H new ATOM 0 HA LYS A 33 12.118 8.894 13.470 1.00 0.00 H new ATOM 0 HB2 LYS A 33 10.303 11.330 13.147 1.00 0.00 H new ATOM 0 HB3 LYS A 33 11.877 11.149 12.397 1.00 0.00 H new ATOM 0 HG2 LYS A 33 9.535 9.282 11.851 1.00 0.00 H new ATOM 0 HG3 LYS A 33 9.876 10.711 10.895 1.00 0.00 H new ATOM 0 HD2 LYS A 33 12.100 9.759 10.264 1.00 0.00 H new ATOM 0 HD3 LYS A 33 11.761 8.331 11.220 1.00 0.00 H new ATOM 0 HE2 LYS A 33 9.772 7.831 9.775 1.00 0.00 H new ATOM 0 HE3 LYS A 33 10.102 9.264 8.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 10.967 7.013 7.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 12.022 8.342 7.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 12.183 7.188 9.167 1.00 0.00 H new ATOM 577 N GLU A 34 11.526 11.503 15.511 1.00 0.00 N ATOM 578 CA GLU A 34 12.154 12.369 16.538 1.00 0.00 C ATOM 579 C GLU A 34 11.991 11.781 17.954 1.00 0.00 C ATOM 580 O GLU A 34 12.750 12.130 18.865 1.00 0.00 O ATOM 581 CB GLU A 34 11.628 13.837 16.480 1.00 0.00 C ATOM 582 CG GLU A 34 10.133 14.034 16.802 1.00 0.00 C ATOM 583 CD GLU A 34 9.696 15.518 16.814 1.00 0.00 C ATOM 584 OE1 GLU A 34 10.235 16.298 17.634 1.00 0.00 O ATOM 585 OE2 GLU A 34 8.815 15.903 16.020 1.00 0.00 O ATOM 0 H GLU A 34 10.584 11.788 15.245 1.00 0.00 H new ATOM 0 HA GLU A 34 13.219 12.399 16.306 1.00 0.00 H new ATOM 0 HB2 GLU A 34 12.211 14.438 17.177 1.00 0.00 H new ATOM 0 HB3 GLU A 34 11.819 14.231 15.482 1.00 0.00 H new ATOM 0 HG2 GLU A 34 9.537 13.494 16.067 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.917 13.592 17.775 1.00 0.00 H new ATOM 592 N GLY A 35 10.988 10.901 18.133 1.00 0.00 N ATOM 593 CA GLY A 35 10.802 10.175 19.394 1.00 0.00 C ATOM 594 C GLY A 35 9.875 10.890 20.356 1.00 0.00 C ATOM 595 O GLY A 35 9.906 10.630 21.566 1.00 0.00 O ATOM 0 H GLY A 35 10.296 10.679 17.417 1.00 0.00 H new ATOM 0 HA2 GLY A 35 10.402 9.184 19.181 1.00 0.00 H new ATOM 0 HA3 GLY A 35 11.772 10.031 19.871 1.00 0.00 H new ATOM 599 N ILE A 36 9.039 11.795 19.817 1.00 0.00 N ATOM 600 CA ILE A 36 8.068 12.575 20.605 1.00 0.00 C ATOM 601 C ILE A 36 6.650 12.038 20.293 1.00 0.00 C ATOM 602 O ILE A 36 6.250 12.036 19.125 1.00 0.00 O ATOM 603 CB ILE A 36 8.166 14.139 20.326 1.00 0.00 C ATOM 604 CG1 ILE A 36 9.411 14.787 21.039 1.00 0.00 C ATOM 605 CG2 ILE A 36 6.872 14.876 20.762 1.00 0.00 C ATOM 606 CD1 ILE A 36 10.780 14.393 20.509 1.00 0.00 C ATOM 0 H ILE A 36 9.018 12.007 18.819 1.00 0.00 H new ATOM 0 HA ILE A 36 8.295 12.451 21.664 1.00 0.00 H new ATOM 0 HB ILE A 36 8.290 14.253 19.249 1.00 0.00 H new ATOM 0 HG12 ILE A 36 9.318 15.871 20.969 1.00 0.00 H new ATOM 0 HG13 ILE A 36 9.369 14.531 22.098 1.00 0.00 H new ATOM 0 HG21 ILE A 36 6.974 15.942 20.557 1.00 0.00 H new ATOM 0 HG22 ILE A 36 6.022 14.479 20.206 1.00 0.00 H new ATOM 0 HG23 ILE A 36 6.710 14.726 21.829 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.553 14.905 21.082 1.00 0.00 H new ATOM 0 HD12 ILE A 36 10.911 13.315 20.605 1.00 0.00 H new ATOM 0 HD13 ILE A 36 10.859 14.676 19.459 1.00 0.00 H new ATOM 618 N PRO A 37 5.872 11.581 21.331 1.00 0.00 N ATOM 619 CA PRO A 37 4.558 10.925 21.118 1.00 0.00 C ATOM 620 C PRO A 37 3.509 11.891 20.511 1.00 0.00 C ATOM 621 O PRO A 37 3.614 13.106 20.723 1.00 0.00 O ATOM 622 CB PRO A 37 4.158 10.443 22.543 1.00 0.00 C ATOM 623 CG PRO A 37 4.886 11.363 23.475 1.00 0.00 C ATOM 624 CD PRO A 37 6.193 11.701 22.785 1.00 0.00 C ATOM 0 HA PRO A 37 4.610 10.109 20.397 1.00 0.00 H new ATOM 0 HB2 PRO A 37 3.080 10.500 22.692 1.00 0.00 H new ATOM 0 HB3 PRO A 37 4.447 9.405 22.705 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.303 12.263 23.671 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.065 10.883 24.437 1.00 0.00 H new ATOM 0 HD2 PRO A 37 6.530 12.706 23.038 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.988 11.015 23.077 1.00 0.00 H new ATOM 632 N PRO A 38 2.477 11.360 19.758 1.00 0.00 N ATOM 633 CA PRO A 38 1.377 12.178 19.166 1.00 0.00 C ATOM 634 C PRO A 38 0.596 13.022 20.207 1.00 0.00 C ATOM 635 O PRO A 38 -0.166 13.923 19.840 1.00 0.00 O ATOM 636 CB PRO A 38 0.470 11.124 18.471 1.00 0.00 C ATOM 637 CG PRO A 38 0.847 9.815 19.084 1.00 0.00 C ATOM 638 CD PRO A 38 2.317 9.929 19.391 1.00 0.00 C ATOM 0 HA PRO A 38 1.764 12.932 18.480 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -0.585 11.345 18.633 1.00 0.00 H new ATOM 0 HB3 PRO A 38 0.632 11.115 17.393 1.00 0.00 H new ATOM 0 HG2 PRO A 38 0.270 9.624 19.989 1.00 0.00 H new ATOM 0 HG3 PRO A 38 0.651 8.989 18.400 1.00 0.00 H new ATOM 0 HD2 PRO A 38 2.610 9.269 20.207 1.00 0.00 H new ATOM 0 HD3 PRO A 38 2.930 9.663 18.530 1.00 0.00 H new ATOM 646 N ASP A 39 0.793 12.692 21.498 1.00 0.00 N ATOM 647 CA ASP A 39 0.262 13.459 22.633 1.00 0.00 C ATOM 648 C ASP A 39 1.073 14.762 22.838 1.00 0.00 C ATOM 649 O ASP A 39 0.501 15.848 22.941 1.00 0.00 O ATOM 650 CB ASP A 39 0.304 12.575 23.911 1.00 0.00 C ATOM 651 CG ASP A 39 -0.196 13.270 25.193 1.00 0.00 C ATOM 652 OD1 ASP A 39 -1.282 13.883 25.173 1.00 0.00 O ATOM 653 OD2 ASP A 39 0.491 13.198 26.232 1.00 0.00 O ATOM 0 H ASP A 39 1.333 11.874 21.782 1.00 0.00 H new ATOM 0 HA ASP A 39 -0.771 13.741 22.427 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -0.299 11.683 23.739 1.00 0.00 H new ATOM 0 HB3 ASP A 39 1.329 12.241 24.071 1.00 0.00 H new ATOM 658 N GLN A 40 2.413 14.630 22.860 1.00 0.00 N ATOM 659 CA GLN A 40 3.344 15.746 23.186 1.00 0.00 C ATOM 660 C GLN A 40 3.581 16.660 21.985 1.00 0.00 C ATOM 661 O GLN A 40 3.979 17.810 22.147 1.00 0.00 O ATOM 662 CB GLN A 40 4.696 15.188 23.740 1.00 0.00 C ATOM 663 CG GLN A 40 4.817 15.171 25.276 1.00 0.00 C ATOM 664 CD GLN A 40 3.563 14.674 25.982 1.00 0.00 C ATOM 665 OE1 GLN A 40 2.695 15.463 26.362 1.00 0.00 O ATOM 666 NE2 GLN A 40 3.449 13.371 26.148 1.00 0.00 N ATOM 0 H GLN A 40 2.888 13.751 22.654 1.00 0.00 H new ATOM 0 HA GLN A 40 2.874 16.351 23.961 1.00 0.00 H new ATOM 0 HB2 GLN A 40 4.831 14.172 23.369 1.00 0.00 H new ATOM 0 HB3 GLN A 40 5.512 15.786 23.334 1.00 0.00 H new ATOM 0 HG2 GLN A 40 5.658 14.538 25.559 1.00 0.00 H new ATOM 0 HG3 GLN A 40 5.045 16.178 25.625 1.00 0.00 H new ATOM 0 HE21 GLN A 40 4.188 12.749 25.821 1.00 0.00 H new ATOM 0 HE22 GLN A 40 2.622 12.985 26.604 1.00 0.00 H new ATOM 675 N GLN A 41 3.381 16.126 20.791 1.00 0.00 N ATOM 676 CA GLN A 41 3.460 16.910 19.562 1.00 0.00 C ATOM 677 C GLN A 41 2.059 17.418 19.182 1.00 0.00 C ATOM 678 O GLN A 41 1.045 16.811 19.559 1.00 0.00 O ATOM 679 CB GLN A 41 4.114 16.074 18.435 1.00 0.00 C ATOM 680 CG GLN A 41 3.305 14.871 17.906 1.00 0.00 C ATOM 681 CD GLN A 41 2.417 15.193 16.693 1.00 0.00 C ATOM 682 OE1 GLN A 41 1.232 15.519 16.811 1.00 0.00 O ATOM 683 NE2 GLN A 41 2.996 15.115 15.505 1.00 0.00 N ATOM 0 H GLN A 41 3.160 15.141 20.643 1.00 0.00 H new ATOM 0 HA GLN A 41 4.094 17.783 19.718 1.00 0.00 H new ATOM 0 HB2 GLN A 41 4.324 16.738 17.597 1.00 0.00 H new ATOM 0 HB3 GLN A 41 5.074 15.706 18.798 1.00 0.00 H new ATOM 0 HG2 GLN A 41 3.997 14.074 17.634 1.00 0.00 H new ATOM 0 HG3 GLN A 41 2.677 14.488 18.710 1.00 0.00 H new ATOM 0 HE21 GLN A 41 3.977 14.843 15.432 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.462 15.326 14.662 1.00 0.00 H new ATOM 692 N ARG A 42 2.011 18.542 18.454 1.00 0.00 N ATOM 693 CA ARG A 42 0.767 19.103 17.926 1.00 0.00 C ATOM 694 C ARG A 42 1.001 19.503 16.477 1.00 0.00 C ATOM 695 O ARG A 42 1.931 20.258 16.164 1.00 0.00 O ATOM 696 CB ARG A 42 0.319 20.315 18.785 1.00 0.00 C ATOM 697 CG ARG A 42 -1.189 20.628 18.734 1.00 0.00 C ATOM 698 CD ARG A 42 -1.604 21.664 19.793 1.00 0.00 C ATOM 699 NE ARG A 42 -3.072 21.723 19.949 1.00 0.00 N ATOM 700 CZ ARG A 42 -3.733 22.242 20.998 1.00 0.00 C ATOM 701 NH1 ARG A 42 -3.086 22.792 22.020 1.00 0.00 N ATOM 702 NH2 ARG A 42 -5.057 22.189 21.017 1.00 0.00 N ATOM 0 H ARG A 42 2.839 19.087 18.216 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.033 18.364 17.969 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.602 20.131 19.821 1.00 0.00 H new ATOM 0 HB3 ARG A 42 0.869 21.197 18.457 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -1.448 21.001 17.743 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -1.754 19.709 18.886 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -1.146 21.412 20.749 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -1.228 22.647 19.509 1.00 0.00 H new ATOM 0 HE ARG A 42 -3.635 21.335 19.192 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -2.067 22.827 22.019 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.609 23.180 22.805 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -5.561 21.758 20.242 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -5.572 22.579 21.807 1.00 0.00 H new ATOM 716 N LEU A 43 0.137 18.996 15.615 1.00 0.00 N ATOM 717 CA LEU A 43 0.332 19.009 14.178 1.00 0.00 C ATOM 718 C LEU A 43 -0.501 20.145 13.576 1.00 0.00 C ATOM 719 O LEU A 43 -1.702 20.207 13.817 1.00 0.00 O ATOM 720 CB LEU A 43 -0.070 17.599 13.650 1.00 0.00 C ATOM 721 CG LEU A 43 0.547 17.143 12.292 1.00 0.00 C ATOM 722 CD1 LEU A 43 2.017 17.585 12.163 1.00 0.00 C ATOM 723 CD2 LEU A 43 0.424 15.612 12.140 1.00 0.00 C ATOM 0 H LEU A 43 -0.737 18.555 15.902 1.00 0.00 H new ATOM 0 HA LEU A 43 1.366 19.199 13.892 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.202 16.864 14.408 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.155 17.571 13.554 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.012 17.624 11.489 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.415 17.250 11.205 1.00 0.00 H new ATOM 0 HD12 LEU A 43 2.077 18.672 12.221 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.601 17.146 12.972 1.00 0.00 H new ATOM 0 HD21 LEU A 43 0.858 15.305 11.188 1.00 0.00 H new ATOM 0 HD22 LEU A 43 0.955 15.122 12.956 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -0.628 15.327 12.168 1.00 0.00 H new ATOM 735 N ILE A 44 0.162 21.077 12.854 1.00 0.00 N ATOM 736 CA ILE A 44 -0.471 22.310 12.319 1.00 0.00 C ATOM 737 C ILE A 44 0.043 22.589 10.895 1.00 0.00 C ATOM 738 O ILE A 44 1.245 22.543 10.653 1.00 0.00 O ATOM 739 CB ILE A 44 -0.177 23.564 13.247 1.00 0.00 C ATOM 740 CG1 ILE A 44 -0.785 23.347 14.674 1.00 0.00 C ATOM 741 CG2 ILE A 44 -0.689 24.897 12.627 1.00 0.00 C ATOM 742 CD1 ILE A 44 -0.451 24.418 15.685 1.00 0.00 C ATOM 0 H ILE A 44 1.153 20.998 12.624 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.549 22.149 12.297 1.00 0.00 H new ATOM 0 HB ILE A 44 0.906 23.651 13.333 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.869 23.281 14.583 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.438 22.387 15.057 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.463 25.723 13.302 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.197 25.066 11.669 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -1.767 24.837 12.475 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -0.918 24.176 16.639 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.630 24.472 15.814 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.823 25.380 15.333 1.00 0.00 H new ATOM 754 N PHE A 45 -0.886 22.887 9.973 1.00 0.00 N ATOM 755 CA PHE A 45 -0.580 23.333 8.597 1.00 0.00 C ATOM 756 C PHE A 45 -1.501 24.514 8.280 1.00 0.00 C ATOM 757 O PHE A 45 -2.689 24.438 8.556 1.00 0.00 O ATOM 758 CB PHE A 45 -0.800 22.175 7.584 1.00 0.00 C ATOM 759 CG PHE A 45 -0.572 22.520 6.099 1.00 0.00 C ATOM 760 CD1 PHE A 45 0.703 22.474 5.533 1.00 0.00 C ATOM 761 CD2 PHE A 45 -1.641 22.869 5.267 1.00 0.00 C ATOM 762 CE1 PHE A 45 0.901 22.746 4.191 1.00 0.00 C ATOM 763 CE2 PHE A 45 -1.440 23.146 3.928 1.00 0.00 C ATOM 764 CZ PHE A 45 -0.168 23.092 3.391 1.00 0.00 C ATOM 0 H PHE A 45 -1.887 22.825 10.161 1.00 0.00 H new ATOM 0 HA PHE A 45 0.464 23.636 8.518 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.135 21.354 7.852 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.820 21.808 7.698 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.550 22.222 6.154 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.639 22.923 5.677 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.894 22.687 3.769 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.279 23.405 3.300 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.011 23.320 2.347 1.00 0.00 H new ATOM 774 N ALA A 46 -0.929 25.605 7.743 1.00 0.00 N ATOM 775 CA ALA A 46 -1.684 26.817 7.328 1.00 0.00 C ATOM 776 C ALA A 46 -2.351 27.539 8.527 1.00 0.00 C ATOM 777 O ALA A 46 -3.300 28.317 8.345 1.00 0.00 O ATOM 778 CB ALA A 46 -2.713 26.477 6.225 1.00 0.00 C ATOM 0 H ALA A 46 0.075 25.679 7.581 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.961 27.517 6.911 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -3.252 27.380 5.939 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -2.194 26.073 5.355 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.419 25.737 6.602 1.00 0.00 H new ATOM 784 N GLY A 47 -1.827 27.292 9.743 1.00 0.00 N ATOM 785 CA GLY A 47 -2.304 27.950 10.964 1.00 0.00 C ATOM 786 C GLY A 47 -3.519 27.270 11.598 1.00 0.00 C ATOM 787 O GLY A 47 -4.135 27.829 12.515 1.00 0.00 O ATOM 0 H GLY A 47 -1.065 26.633 9.901 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.493 27.976 11.692 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.558 28.984 10.733 1.00 0.00 H new ATOM 791 N LYS A 48 -3.869 26.064 11.114 1.00 0.00 N ATOM 792 CA LYS A 48 -4.994 25.266 11.655 1.00 0.00 C ATOM 793 C LYS A 48 -4.456 23.932 12.205 1.00 0.00 C ATOM 794 O LYS A 48 -3.470 23.387 11.685 1.00 0.00 O ATOM 795 CB LYS A 48 -6.064 25.022 10.545 1.00 0.00 C ATOM 796 CG LYS A 48 -5.631 24.015 9.450 1.00 0.00 C ATOM 797 CD LYS A 48 -6.467 24.088 8.163 1.00 0.00 C ATOM 798 CE LYS A 48 -6.349 25.434 7.445 1.00 0.00 C ATOM 799 NZ LYS A 48 -7.106 25.425 6.170 1.00 0.00 N ATOM 0 H LYS A 48 -3.384 25.613 10.339 1.00 0.00 H new ATOM 0 HA LYS A 48 -5.472 25.813 12.468 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.979 24.660 11.013 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.303 25.974 10.072 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.585 24.193 9.201 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -5.695 23.005 9.855 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.152 23.294 7.487 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.513 23.903 8.406 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.725 26.228 8.090 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.300 25.654 7.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.010 26.349 5.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -6.729 24.682 5.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.110 25.238 6.364 1.00 0.00 H new ATOM 813 N GLN A 49 -5.106 23.419 13.262 1.00 0.00 N ATOM 814 CA GLN A 49 -4.741 22.137 13.886 1.00 0.00 C ATOM 815 C GLN A 49 -5.230 20.972 13.007 1.00 0.00 C ATOM 816 O GLN A 49 -6.405 20.921 12.620 1.00 0.00 O ATOM 817 CB GLN A 49 -5.353 22.045 15.304 1.00 0.00 C ATOM 818 CG GLN A 49 -4.968 20.784 16.109 1.00 0.00 C ATOM 819 CD GLN A 49 -5.711 20.642 17.450 1.00 0.00 C ATOM 820 OE1 GLN A 49 -5.154 20.139 18.425 1.00 0.00 O ATOM 821 NE2 GLN A 49 -6.982 21.041 17.498 1.00 0.00 N ATOM 0 H GLN A 49 -5.899 23.881 13.708 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.656 22.075 13.975 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -5.049 22.925 15.871 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -6.439 22.082 15.216 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -5.168 19.902 15.500 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -3.895 20.802 16.301 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -7.418 21.455 16.674 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -7.518 20.933 18.359 1.00 0.00 H new ATOM 830 N LEU A 50 -4.313 20.057 12.673 1.00 0.00 N ATOM 831 CA LEU A 50 -4.614 18.895 11.843 1.00 0.00 C ATOM 832 C LEU A 50 -5.268 17.793 12.697 1.00 0.00 C ATOM 833 O LEU A 50 -4.696 17.352 13.706 1.00 0.00 O ATOM 834 CB LEU A 50 -3.332 18.391 11.155 1.00 0.00 C ATOM 835 CG LEU A 50 -2.517 19.461 10.357 1.00 0.00 C ATOM 836 CD1 LEU A 50 -1.410 18.801 9.538 1.00 0.00 C ATOM 837 CD2 LEU A 50 -3.422 20.351 9.471 1.00 0.00 C ATOM 0 H LEU A 50 -3.340 20.106 12.974 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.321 19.179 11.064 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.681 17.960 11.915 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.602 17.585 10.472 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.052 20.122 11.088 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.857 19.565 8.992 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.732 18.269 10.205 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.850 18.097 8.832 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.808 21.077 8.938 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.953 19.728 8.752 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.142 20.876 10.098 1.00 0.00 H new ATOM 849 N GLU A 51 -6.468 17.365 12.274 1.00 0.00 N ATOM 850 CA GLU A 51 -7.290 16.387 12.988 1.00 0.00 C ATOM 851 C GLU A 51 -6.870 14.972 12.590 1.00 0.00 C ATOM 852 O GLU A 51 -6.686 14.691 11.404 1.00 0.00 O ATOM 853 CB GLU A 51 -8.784 16.632 12.652 1.00 0.00 C ATOM 854 CG GLU A 51 -9.772 15.612 13.248 1.00 0.00 C ATOM 855 CD GLU A 51 -11.235 15.979 12.973 1.00 0.00 C ATOM 856 OE1 GLU A 51 -11.782 15.572 11.927 1.00 0.00 O ATOM 857 OE2 GLU A 51 -11.838 16.708 13.794 1.00 0.00 O ATOM 0 H GLU A 51 -6.898 17.697 11.411 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.149 16.498 14.063 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -9.059 17.627 13.003 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -8.899 16.633 11.568 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -9.565 14.626 12.833 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -9.614 15.545 14.324 1.00 0.00 H new ATOM 864 N ASP A 52 -6.809 14.092 13.592 1.00 0.00 N ATOM 865 CA ASP A 52 -6.278 12.725 13.473 1.00 0.00 C ATOM 866 C ASP A 52 -7.092 11.867 12.491 1.00 0.00 C ATOM 867 O ASP A 52 -6.516 11.080 11.730 1.00 0.00 O ATOM 868 CB ASP A 52 -6.271 12.061 14.874 1.00 0.00 C ATOM 869 CG ASP A 52 -5.309 12.718 15.878 1.00 0.00 C ATOM 870 OD1 ASP A 52 -5.416 13.944 16.118 1.00 0.00 O ATOM 871 OD2 ASP A 52 -4.444 12.020 16.441 1.00 0.00 O ATOM 0 H ASP A 52 -7.135 14.312 14.533 1.00 0.00 H new ATOM 0 HA ASP A 52 -5.264 12.791 13.077 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -7.281 12.091 15.283 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -6.002 11.010 14.764 1.00 0.00 H new ATOM 876 N GLY A 53 -8.427 12.044 12.529 1.00 0.00 N ATOM 877 CA GLY A 53 -9.360 11.273 11.696 1.00 0.00 C ATOM 878 C GLY A 53 -9.310 11.639 10.212 1.00 0.00 C ATOM 879 O GLY A 53 -9.784 10.877 9.357 1.00 0.00 O ATOM 0 H GLY A 53 -8.884 12.724 13.137 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -9.139 10.211 11.806 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.374 11.427 12.065 1.00 0.00 H new ATOM 883 N ARG A 54 -8.752 12.822 9.914 1.00 0.00 N ATOM 884 CA ARG A 54 -8.585 13.328 8.538 1.00 0.00 C ATOM 885 C ARG A 54 -7.262 12.866 7.926 1.00 0.00 C ATOM 886 O ARG A 54 -6.476 12.175 8.567 1.00 0.00 O ATOM 887 CB ARG A 54 -8.671 14.870 8.547 1.00 0.00 C ATOM 888 CG ARG A 54 -10.031 15.388 9.031 1.00 0.00 C ATOM 889 CD ARG A 54 -10.150 16.902 8.955 1.00 0.00 C ATOM 890 NE ARG A 54 -11.500 17.351 9.302 1.00 0.00 N ATOM 891 CZ ARG A 54 -12.232 18.218 8.589 1.00 0.00 C ATOM 892 NH1 ARG A 54 -11.749 18.777 7.484 1.00 0.00 N ATOM 893 NH2 ARG A 54 -13.454 18.506 8.970 1.00 0.00 N ATOM 0 H ARG A 54 -8.400 13.462 10.626 1.00 0.00 H new ATOM 0 HA ARG A 54 -9.385 12.922 7.919 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -7.886 15.269 9.189 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -8.482 15.246 7.541 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.821 14.936 8.431 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.190 15.068 10.061 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -9.428 17.359 9.631 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -9.901 17.238 7.948 1.00 0.00 H new ATOM 0 HE ARG A 54 -11.916 16.974 10.154 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -10.807 18.548 7.166 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -12.320 19.435 6.954 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -13.844 18.071 9.806 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -14.014 19.165 8.430 1.00 0.00 H new ATOM 907 N THR A 55 -7.045 13.247 6.662 1.00 0.00 N ATOM 908 CA THR A 55 -5.819 12.923 5.908 1.00 0.00 C ATOM 909 C THR A 55 -5.071 14.212 5.551 1.00 0.00 C ATOM 910 O THR A 55 -5.618 15.315 5.704 1.00 0.00 O ATOM 911 CB THR A 55 -6.147 12.128 4.602 1.00 0.00 C ATOM 912 OG1 THR A 55 -7.094 12.864 3.807 1.00 0.00 O ATOM 913 CG2 THR A 55 -6.700 10.724 4.897 1.00 0.00 C ATOM 0 H THR A 55 -7.718 13.794 6.125 1.00 0.00 H new ATOM 0 HA THR A 55 -5.191 12.296 6.541 1.00 0.00 H new ATOM 0 HB THR A 55 -5.213 12.005 4.054 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.295 12.362 2.989 1.00 0.00 H new ATOM 0 HG21 THR A 55 -6.912 10.212 3.958 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.963 10.154 5.463 1.00 0.00 H new ATOM 0 HG23 THR A 55 -7.617 10.809 5.479 1.00 0.00 H new ATOM 921 N LEU A 56 -3.822 14.062 5.072 1.00 0.00 N ATOM 922 CA LEU A 56 -3.019 15.196 4.580 1.00 0.00 C ATOM 923 C LEU A 56 -3.779 15.911 3.443 1.00 0.00 C ATOM 924 O LEU A 56 -4.025 17.114 3.508 1.00 0.00 O ATOM 925 CB LEU A 56 -1.624 14.708 4.082 1.00 0.00 C ATOM 926 CG LEU A 56 -0.650 14.129 5.160 1.00 0.00 C ATOM 927 CD1 LEU A 56 0.574 13.455 4.499 1.00 0.00 C ATOM 928 CD2 LEU A 56 -0.197 15.226 6.156 1.00 0.00 C ATOM 0 H LEU A 56 -3.346 13.162 5.015 1.00 0.00 H new ATOM 0 HA LEU A 56 -2.857 15.897 5.399 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.784 13.942 3.323 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -1.127 15.545 3.591 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.196 13.370 5.720 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.234 13.061 5.272 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.238 12.639 3.859 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.114 14.188 3.900 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.479 14.792 6.893 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.318 16.019 5.614 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.069 15.640 6.663 1.00 0.00 H new ATOM 940 N SER A 57 -4.228 15.113 2.464 1.00 0.00 N ATOM 941 CA SER A 57 -4.926 15.588 1.260 1.00 0.00 C ATOM 942 C SER A 57 -6.248 16.306 1.616 1.00 0.00 C ATOM 943 O SER A 57 -6.711 17.172 0.861 1.00 0.00 O ATOM 944 CB SER A 57 -5.199 14.387 0.330 1.00 0.00 C ATOM 945 OG SER A 57 -5.856 14.778 -0.866 1.00 0.00 O ATOM 0 H SER A 57 -4.114 14.100 2.487 1.00 0.00 H new ATOM 0 HA SER A 57 -4.291 16.313 0.751 1.00 0.00 H new ATOM 0 HB2 SER A 57 -4.256 13.899 0.083 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.810 13.653 0.856 1.00 0.00 H new ATOM 0 HG SER A 57 -6.009 13.990 -1.428 1.00 0.00 H new ATOM 951 N ASP A 58 -6.836 15.953 2.786 1.00 0.00 N ATOM 952 CA ASP A 58 -8.058 16.607 3.295 1.00 0.00 C ATOM 953 C ASP A 58 -7.764 18.079 3.608 1.00 0.00 C ATOM 954 O ASP A 58 -8.524 18.980 3.224 1.00 0.00 O ATOM 955 CB ASP A 58 -8.574 15.884 4.567 1.00 0.00 C ATOM 956 CG ASP A 58 -9.869 16.494 5.137 1.00 0.00 C ATOM 957 OD1 ASP A 58 -9.803 17.549 5.802 1.00 0.00 O ATOM 958 OD2 ASP A 58 -10.961 15.934 4.907 1.00 0.00 O ATOM 0 H ASP A 58 -6.479 15.216 3.394 1.00 0.00 H new ATOM 0 HA ASP A 58 -8.832 16.549 2.530 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -8.749 14.834 4.333 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.799 15.915 5.333 1.00 0.00 H new ATOM 963 N TYR A 59 -6.629 18.308 4.295 1.00 0.00 N ATOM 964 CA TYR A 59 -6.175 19.655 4.667 1.00 0.00 C ATOM 965 C TYR A 59 -5.362 20.313 3.528 1.00 0.00 C ATOM 966 O TYR A 59 -4.639 21.284 3.771 1.00 0.00 O ATOM 967 CB TYR A 59 -5.337 19.598 5.969 1.00 0.00 C ATOM 968 CG TYR A 59 -6.160 19.482 7.243 1.00 0.00 C ATOM 969 CD1 TYR A 59 -6.880 20.578 7.717 1.00 0.00 C ATOM 970 CD2 TYR A 59 -6.199 18.304 7.987 1.00 0.00 C ATOM 971 CE1 TYR A 59 -7.607 20.508 8.881 1.00 0.00 C ATOM 972 CE2 TYR A 59 -6.920 18.237 9.152 1.00 0.00 C ATOM 973 CZ TYR A 59 -7.622 19.345 9.596 1.00 0.00 C ATOM 974 OH TYR A 59 -8.333 19.282 10.768 1.00 0.00 O ATOM 0 H TYR A 59 -6.004 17.564 4.606 1.00 0.00 H new ATOM 0 HA TYR A 59 -7.058 20.270 4.841 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -4.657 18.748 5.912 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.721 20.495 6.030 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.866 21.502 7.157 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -5.656 17.436 7.643 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.163 21.367 9.228 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -6.940 17.320 9.723 1.00 0.00 H new ATOM 0 HH TYR A 59 -7.848 19.763 11.471 1.00 0.00 H new ATOM 984 N ASN A 60 -5.489 19.764 2.292 1.00 0.00 N ATOM 985 CA ASN A 60 -4.850 20.303 1.065 1.00 0.00 C ATOM 986 C ASN A 60 -3.306 20.203 1.130 1.00 0.00 C ATOM 987 O ASN A 60 -2.586 20.883 0.387 1.00 0.00 O ATOM 988 CB ASN A 60 -5.334 21.757 0.790 1.00 0.00 C ATOM 989 CG ASN A 60 -6.857 21.852 0.625 1.00 0.00 C ATOM 990 OD1 ASN A 60 -7.383 21.786 -0.485 1.00 0.00 O ATOM 991 ND2 ASN A 60 -7.574 21.991 1.732 1.00 0.00 N ATOM 0 H ASN A 60 -6.044 18.926 2.119 1.00 0.00 H new ATOM 0 HA ASN A 60 -5.162 19.686 0.222 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -5.021 22.402 1.611 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -4.851 22.132 -0.112 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.591 22.046 1.677 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -7.108 22.043 2.638 1.00 0.00 H new ATOM 998 N ILE A 61 -2.828 19.313 2.016 1.00 0.00 N ATOM 999 CA ILE A 61 -1.410 18.965 2.158 1.00 0.00 C ATOM 1000 C ILE A 61 -1.094 17.864 1.142 1.00 0.00 C ATOM 1001 O ILE A 61 -1.847 16.886 1.019 1.00 0.00 O ATOM 1002 CB ILE A 61 -1.098 18.421 3.603 1.00 0.00 C ATOM 1003 CG1 ILE A 61 -1.725 19.334 4.691 1.00 0.00 C ATOM 1004 CG2 ILE A 61 0.423 18.244 3.842 1.00 0.00 C ATOM 1005 CD1 ILE A 61 -1.858 18.684 6.055 1.00 0.00 C ATOM 0 H ILE A 61 -3.431 18.807 2.665 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.805 19.856 1.989 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.555 17.434 3.678 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.116 20.233 4.788 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.712 19.652 4.356 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.591 17.867 4.851 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.825 17.535 3.118 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.924 19.205 3.725 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -2.305 19.392 6.753 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.493 17.801 5.977 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.872 18.391 6.416 1.00 0.00 H new ATOM 1017 N GLN A 62 -0.006 18.026 0.412 1.00 0.00 N ATOM 1018 CA GLN A 62 0.455 17.030 -0.558 1.00 0.00 C ATOM 1019 C GLN A 62 1.812 16.474 -0.116 1.00 0.00 C ATOM 1020 O GLN A 62 2.310 16.812 0.978 1.00 0.00 O ATOM 1021 CB GLN A 62 0.554 17.663 -1.969 1.00 0.00 C ATOM 1022 CG GLN A 62 1.547 18.843 -2.080 1.00 0.00 C ATOM 1023 CD GLN A 62 2.013 19.112 -3.506 1.00 0.00 C ATOM 1024 OE1 GLN A 62 1.390 19.862 -4.254 1.00 0.00 O ATOM 1025 NE2 GLN A 62 3.130 18.514 -3.881 1.00 0.00 N ATOM 0 H GLN A 62 0.590 18.852 0.470 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.262 16.211 -0.604 1.00 0.00 H new ATOM 0 HB2 GLN A 62 0.848 16.890 -2.679 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.436 18.009 -2.267 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.076 19.743 -1.684 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.416 18.637 -1.455 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.621 17.898 -3.233 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.501 18.669 -4.818 1.00 0.00 H new ATOM 1034 N LYS A 63 2.404 15.621 -0.965 1.00 0.00 N ATOM 1035 CA LYS A 63 3.740 15.079 -0.723 1.00 0.00 C ATOM 1036 C LYS A 63 4.778 16.217 -0.685 1.00 0.00 C ATOM 1037 O LYS A 63 4.769 17.119 -1.537 1.00 0.00 O ATOM 1038 CB LYS A 63 4.119 14.018 -1.788 1.00 0.00 C ATOM 1039 CG LYS A 63 4.185 14.529 -3.248 1.00 0.00 C ATOM 1040 CD LYS A 63 4.650 13.440 -4.246 1.00 0.00 C ATOM 1041 CE LYS A 63 6.057 12.908 -3.927 1.00 0.00 C ATOM 1042 NZ LYS A 63 6.489 11.855 -4.884 1.00 0.00 N ATOM 0 H LYS A 63 1.972 15.293 -1.829 1.00 0.00 H new ATOM 0 HA LYS A 63 3.735 14.581 0.247 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.089 13.596 -1.525 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.394 13.205 -1.739 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.201 14.892 -3.546 1.00 0.00 H new ATOM 0 HG3 LYS A 63 4.867 15.378 -3.300 1.00 0.00 H new ATOM 0 HD2 LYS A 63 3.941 12.612 -4.232 1.00 0.00 H new ATOM 0 HD3 LYS A 63 4.641 13.850 -5.256 1.00 0.00 H new ATOM 0 HE2 LYS A 63 6.769 13.733 -3.951 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.070 12.504 -2.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.528 11.824 -4.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 6.126 10.932 -4.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.116 12.072 -5.830 1.00 0.00 H new ATOM 1056 N GLU A 64 5.597 16.190 0.375 1.00 0.00 N ATOM 1057 CA GLU A 64 6.744 17.085 0.584 1.00 0.00 C ATOM 1058 C GLU A 64 6.302 18.511 0.941 1.00 0.00 C ATOM 1059 O GLU A 64 7.102 19.446 0.849 1.00 0.00 O ATOM 1060 CB GLU A 64 7.721 17.049 -0.628 1.00 0.00 C ATOM 1061 CG GLU A 64 8.308 15.652 -0.915 1.00 0.00 C ATOM 1062 CD GLU A 64 9.280 15.666 -2.096 1.00 0.00 C ATOM 1063 OE1 GLU A 64 8.822 15.681 -3.254 1.00 0.00 O ATOM 1064 OE2 GLU A 64 10.511 15.688 -1.874 1.00 0.00 O ATOM 0 H GLU A 64 5.475 15.522 1.136 1.00 0.00 H new ATOM 0 HA GLU A 64 7.297 16.713 1.447 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.196 17.401 -1.516 1.00 0.00 H new ATOM 0 HB3 GLU A 64 8.539 17.745 -0.444 1.00 0.00 H new ATOM 0 HG2 GLU A 64 8.823 15.287 -0.027 1.00 0.00 H new ATOM 0 HG3 GLU A 64 7.497 14.954 -1.122 1.00 0.00 H new ATOM 1071 N SER A 65 5.032 18.670 1.381 1.00 0.00 N ATOM 1072 CA SER A 65 4.558 19.940 1.952 1.00 0.00 C ATOM 1073 C SER A 65 5.188 20.170 3.334 1.00 0.00 C ATOM 1074 O SER A 65 5.347 19.219 4.114 1.00 0.00 O ATOM 1075 CB SER A 65 3.022 19.960 2.060 1.00 0.00 C ATOM 1076 OG SER A 65 2.414 19.839 0.789 1.00 0.00 O ATOM 0 H SER A 65 4.325 17.935 1.349 1.00 0.00 H new ATOM 0 HA SER A 65 4.863 20.745 1.284 1.00 0.00 H new ATOM 0 HB2 SER A 65 2.690 19.145 2.703 1.00 0.00 H new ATOM 0 HB3 SER A 65 2.701 20.889 2.532 1.00 0.00 H new ATOM 0 HG SER A 65 1.740 20.542 0.680 1.00 0.00 H new ATOM 1082 N THR A 66 5.570 21.428 3.612 1.00 0.00 N ATOM 1083 CA THR A 66 6.120 21.818 4.914 1.00 0.00 C ATOM 1084 C THR A 66 4.996 22.346 5.823 1.00 0.00 C ATOM 1085 O THR A 66 4.200 23.201 5.415 1.00 0.00 O ATOM 1086 CB THR A 66 7.252 22.884 4.779 1.00 0.00 C ATOM 1087 OG1 THR A 66 8.274 22.393 3.895 1.00 0.00 O ATOM 1088 CG2 THR A 66 7.891 23.230 6.145 1.00 0.00 C ATOM 0 H THR A 66 5.506 22.196 2.943 1.00 0.00 H new ATOM 0 HA THR A 66 6.564 20.930 5.363 1.00 0.00 H new ATOM 0 HB THR A 66 6.801 23.791 4.377 1.00 0.00 H new ATOM 0 HG1 THR A 66 8.983 23.064 3.810 1.00 0.00 H new ATOM 0 HG21 THR A 66 8.673 23.975 6.002 1.00 0.00 H new ATOM 0 HG22 THR A 66 7.128 23.628 6.813 1.00 0.00 H new ATOM 0 HG23 THR A 66 8.323 22.330 6.583 1.00 0.00 H new ATOM 1096 N LEU A 67 4.943 21.805 7.043 1.00 0.00 N ATOM 1097 CA LEU A 67 3.978 22.181 8.082 1.00 0.00 C ATOM 1098 C LEU A 67 4.706 22.266 9.428 1.00 0.00 C ATOM 1099 O LEU A 67 5.838 21.807 9.556 1.00 0.00 O ATOM 1100 CB LEU A 67 2.788 21.174 8.140 1.00 0.00 C ATOM 1101 CG LEU A 67 3.120 19.645 8.228 1.00 0.00 C ATOM 1102 CD1 LEU A 67 1.924 18.850 8.778 1.00 0.00 C ATOM 1103 CD2 LEU A 67 3.541 19.054 6.858 1.00 0.00 C ATOM 0 H LEU A 67 5.587 21.074 7.344 1.00 0.00 H new ATOM 0 HA LEU A 67 3.552 23.156 7.843 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.174 21.432 9.003 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.174 21.332 7.253 1.00 0.00 H new ATOM 0 HG LEU A 67 3.964 19.554 8.912 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.182 17.792 8.828 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.675 19.211 9.776 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.065 18.983 8.120 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.761 17.992 6.972 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.729 19.182 6.142 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.429 19.571 6.496 1.00 0.00 H new ATOM 1115 N HIS A 68 4.053 22.870 10.429 1.00 0.00 N ATOM 1116 CA HIS A 68 4.667 23.140 11.742 1.00 0.00 C ATOM 1117 C HIS A 68 4.309 22.048 12.759 1.00 0.00 C ATOM 1118 O HIS A 68 3.221 21.454 12.712 1.00 0.00 O ATOM 1119 CB HIS A 68 4.239 24.537 12.258 1.00 0.00 C ATOM 1120 CG HIS A 68 4.745 25.672 11.394 1.00 0.00 C ATOM 1121 ND1 HIS A 68 5.685 26.585 11.821 1.00 0.00 N ATOM 1122 CD2 HIS A 68 4.446 26.024 10.118 1.00 0.00 C ATOM 1123 CE1 HIS A 68 5.942 27.437 10.850 1.00 0.00 C ATOM 1124 NE2 HIS A 68 5.205 27.121 9.809 1.00 0.00 N ATOM 0 H HIS A 68 3.086 23.186 10.355 1.00 0.00 H new ATOM 0 HA HIS A 68 5.750 23.132 11.619 1.00 0.00 H new ATOM 0 HB2 HIS A 68 3.151 24.582 12.305 1.00 0.00 H new ATOM 0 HB3 HIS A 68 4.608 24.670 13.275 1.00 0.00 H new ATOM 0 HD2 HIS A 68 3.740 25.530 9.467 1.00 0.00 H new ATOM 0 HE1 HIS A 68 6.642 28.258 10.901 1.00 0.00 H new ATOM 0 HE2 HIS A 68 5.199 27.613 8.916 1.00 0.00 H new ATOM 1133 N LEU A 69 5.255 21.810 13.677 1.00 0.00 N ATOM 1134 CA LEU A 69 5.143 20.817 14.746 1.00 0.00 C ATOM 1135 C LEU A 69 5.435 21.527 16.066 1.00 0.00 C ATOM 1136 O LEU A 69 6.425 22.248 16.189 1.00 0.00 O ATOM 1137 CB LEU A 69 6.143 19.645 14.489 1.00 0.00 C ATOM 1138 CG LEU A 69 5.903 18.296 15.254 1.00 0.00 C ATOM 1139 CD1 LEU A 69 6.333 18.357 16.732 1.00 0.00 C ATOM 1140 CD2 LEU A 69 4.433 17.862 15.119 1.00 0.00 C ATOM 0 H LEU A 69 6.140 22.317 13.695 1.00 0.00 H new ATOM 0 HA LEU A 69 4.143 20.384 14.780 1.00 0.00 H new ATOM 0 HB2 LEU A 69 6.138 19.429 13.421 1.00 0.00 H new ATOM 0 HB3 LEU A 69 7.144 19.998 14.739 1.00 0.00 H new ATOM 0 HG LEU A 69 6.540 17.545 14.786 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.142 17.394 17.207 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.397 18.587 16.792 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.765 19.133 17.244 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.280 16.925 15.654 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.786 18.631 15.541 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.190 17.722 14.066 1.00 0.00 H new ATOM 1152 N VAL A 70 4.554 21.314 17.031 1.00 0.00 N ATOM 1153 CA VAL A 70 4.588 21.973 18.334 1.00 0.00 C ATOM 1154 C VAL A 70 4.869 20.949 19.427 1.00 0.00 C ATOM 1155 O VAL A 70 4.225 19.917 19.484 1.00 0.00 O ATOM 1156 CB VAL A 70 3.227 22.692 18.594 1.00 0.00 C ATOM 1157 CG1 VAL A 70 3.170 23.320 20.010 1.00 0.00 C ATOM 1158 CG2 VAL A 70 2.962 23.735 17.472 1.00 0.00 C ATOM 0 H VAL A 70 3.775 20.663 16.931 1.00 0.00 H new ATOM 0 HA VAL A 70 5.385 22.716 18.343 1.00 0.00 H new ATOM 0 HB VAL A 70 2.428 21.952 18.564 1.00 0.00 H new ATOM 0 HG11 VAL A 70 2.207 23.811 20.152 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.293 22.539 20.760 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.970 24.053 20.115 1.00 0.00 H new ATOM 0 HG21 VAL A 70 2.011 24.235 17.657 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.764 24.473 17.464 1.00 0.00 H new ATOM 0 HG23 VAL A 70 2.925 23.230 16.507 1.00 0.00 H new ATOM 1168 N LEU A 71 5.838 21.257 20.287 1.00 0.00 N ATOM 1169 CA LEU A 71 6.250 20.377 21.385 1.00 0.00 C ATOM 1170 C LEU A 71 5.592 20.806 22.712 1.00 0.00 C ATOM 1171 O LEU A 71 5.334 21.996 22.933 1.00 0.00 O ATOM 1172 CB LEU A 71 7.791 20.391 21.489 1.00 0.00 C ATOM 1173 CG LEU A 71 8.568 19.897 20.221 1.00 0.00 C ATOM 1174 CD1 LEU A 71 10.095 19.997 20.423 1.00 0.00 C ATOM 1175 CD2 LEU A 71 8.156 18.455 19.837 1.00 0.00 C ATOM 0 H LEU A 71 6.364 22.130 20.243 1.00 0.00 H new ATOM 0 HA LEU A 71 5.917 19.359 21.180 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.111 21.408 21.714 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.084 19.770 22.336 1.00 0.00 H new ATOM 0 HG LEU A 71 8.297 20.555 19.395 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.604 19.647 19.525 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.370 21.034 20.615 1.00 0.00 H new ATOM 0 HD13 LEU A 71 10.391 19.381 21.272 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.712 18.141 18.954 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.378 17.781 20.664 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.088 18.427 19.622 1.00 0.00 H new ATOM 1187 N ARG A 72 5.290 19.805 23.561 1.00 0.00 N ATOM 1188 CA ARG A 72 4.694 20.001 24.907 1.00 0.00 C ATOM 1189 C ARG A 72 5.653 19.498 26.004 1.00 0.00 C ATOM 1190 O ARG A 72 5.740 20.106 27.072 1.00 0.00 O ATOM 1191 CB ARG A 72 3.340 19.243 25.021 1.00 0.00 C ATOM 1192 CG ARG A 72 2.199 19.786 24.136 1.00 0.00 C ATOM 1193 CD ARG A 72 0.919 18.931 24.245 1.00 0.00 C ATOM 1194 NE ARG A 72 0.424 18.828 25.640 1.00 0.00 N ATOM 1195 CZ ARG A 72 -0.183 17.749 26.176 1.00 0.00 C ATOM 1196 NH1 ARG A 72 -0.393 16.654 25.460 1.00 0.00 N ATOM 1197 NH2 ARG A 72 -0.571 17.769 27.443 1.00 0.00 N ATOM 0 H ARG A 72 5.453 18.824 23.334 1.00 0.00 H new ATOM 0 HA ARG A 72 4.521 21.068 25.044 1.00 0.00 H new ATOM 0 HB2 ARG A 72 3.507 18.196 24.767 1.00 0.00 H new ATOM 0 HB3 ARG A 72 3.014 19.271 26.061 1.00 0.00 H new ATOM 0 HG2 ARG A 72 1.974 20.812 24.426 1.00 0.00 H new ATOM 0 HG3 ARG A 72 2.529 19.813 23.097 1.00 0.00 H new ATOM 0 HD2 ARG A 72 0.141 19.365 23.617 1.00 0.00 H new ATOM 0 HD3 ARG A 72 1.119 17.932 23.859 1.00 0.00 H new ATOM 0 HE ARG A 72 0.553 19.640 26.244 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -0.094 16.617 24.486 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -0.854 15.848 25.883 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -0.411 18.600 28.012 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -1.030 16.953 27.849 1.00 0.00 H new ATOM 1211 N LEU A 73 6.307 18.340 25.732 1.00 0.00 N ATOM 1212 CA LEU A 73 7.242 17.644 26.667 1.00 0.00 C ATOM 1213 C LEU A 73 6.669 17.486 28.097 1.00 0.00 C ATOM 1214 O LEU A 73 7.414 17.502 29.083 1.00 0.00 O ATOM 1215 CB LEU A 73 8.667 18.308 26.675 1.00 0.00 C ATOM 1216 CG LEU A 73 9.637 17.936 25.493 1.00 0.00 C ATOM 1217 CD1 LEU A 73 9.886 16.417 25.403 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.150 18.493 24.149 1.00 0.00 C ATOM 0 H LEU A 73 6.201 17.852 24.843 1.00 0.00 H new ATOM 0 HA LEU A 73 7.357 16.633 26.277 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.536 19.390 26.678 1.00 0.00 H new ATOM 0 HB3 LEU A 73 9.158 18.044 27.612 1.00 0.00 H new ATOM 0 HG LEU A 73 10.591 18.412 25.719 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.561 16.207 24.573 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.334 16.066 26.333 1.00 0.00 H new ATOM 0 HD13 LEU A 73 8.939 15.902 25.240 1.00 0.00 H new ATOM 0 HD21 LEU A 73 9.851 18.211 23.363 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.166 18.084 23.921 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.087 19.580 24.207 1.00 0.00 H new ATOM 1230 N ARG A 74 5.340 17.288 28.181 1.00 0.00 N ATOM 1231 CA ARG A 74 4.642 17.060 29.463 1.00 0.00 C ATOM 1232 C ARG A 74 4.945 15.635 29.960 1.00 0.00 C ATOM 1233 O ARG A 74 5.193 15.403 31.148 1.00 0.00 O ATOM 1234 CB ARG A 74 3.109 17.261 29.297 1.00 0.00 C ATOM 1235 CG ARG A 74 2.685 18.606 28.667 1.00 0.00 C ATOM 1236 CD ARG A 74 3.232 19.836 29.412 1.00 0.00 C ATOM 1237 NE ARG A 74 2.802 19.868 30.822 1.00 0.00 N ATOM 1238 CZ ARG A 74 3.505 20.399 31.838 1.00 0.00 C ATOM 1239 NH1 ARG A 74 4.704 20.938 31.636 1.00 0.00 N ATOM 1240 NH2 ARG A 74 3.014 20.344 33.065 1.00 0.00 N ATOM 0 H ARG A 74 4.723 17.281 27.369 1.00 0.00 H new ATOM 0 HA ARG A 74 4.998 17.783 30.197 1.00 0.00 H new ATOM 0 HB2 ARG A 74 2.717 16.451 28.682 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.639 17.173 30.277 1.00 0.00 H new ATOM 0 HG2 ARG A 74 3.027 18.637 27.633 1.00 0.00 H new ATOM 0 HG3 ARG A 74 1.597 18.660 28.645 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.321 19.832 29.366 1.00 0.00 H new ATOM 0 HD3 ARG A 74 2.895 20.743 28.910 1.00 0.00 H new ATOM 0 HE ARG A 74 1.897 19.453 31.045 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.105 20.953 30.698 1.00 0.00 H new ATOM 0 HH12 ARG A 74 5.223 21.336 32.419 1.00 0.00 H new ATOM 0 HH21 ARG A 74 2.110 19.902 33.233 1.00 0.00 H new ATOM 0 HH22 ARG A 74 3.539 20.744 33.843 1.00 0.00 H new ATOM 1254 N GLY A 75 4.909 14.695 29.005 1.00 0.00 N ATOM 1255 CA GLY A 75 5.294 13.303 29.213 1.00 0.00 C ATOM 1256 C GLY A 75 6.418 12.922 28.259 1.00 0.00 C ATOM 1257 O GLY A 75 6.222 12.113 27.338 1.00 0.00 O ATOM 0 H GLY A 75 4.605 14.890 28.051 1.00 0.00 H new ATOM 0 HA2 GLY A 75 5.617 13.157 30.244 1.00 0.00 H new ATOM 0 HA3 GLY A 75 4.434 12.652 29.053 1.00 0.00 H new ATOM 1261 N GLY A 76 7.581 13.572 28.442 1.00 0.00 N ATOM 1262 CA GLY A 76 8.791 13.270 27.681 1.00 0.00 C ATOM 1263 C GLY A 76 9.963 14.141 28.116 1.00 0.00 C ATOM 1264 O GLY A 76 9.752 15.228 28.677 1.00 0.00 O ATOM 0 H GLY A 76 7.701 14.321 29.124 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.050 12.219 27.812 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.600 13.421 26.619 1.00 0.00 H new TER 1268 GLY A 76 ATOM 1269 N GLY B 195 17.932 16.810 24.786 1.00 0.00 N ATOM 1270 CA GLY B 195 17.667 16.438 26.180 1.00 0.00 C ATOM 1271 C GLY B 195 16.957 17.539 26.953 1.00 0.00 C ATOM 1272 O GLY B 195 17.494 18.074 27.935 1.00 0.00 O ATOM 0 HA2 GLY B 195 17.059 15.533 26.202 1.00 0.00 H new ATOM 0 HA3 GLY B 195 18.609 16.201 26.675 1.00 0.00 H new ATOM 1276 N SER B 196 15.731 17.853 26.504 1.00 0.00 N ATOM 1277 CA SER B 196 14.898 18.918 27.080 1.00 0.00 C ATOM 1278 C SER B 196 14.404 18.543 28.497 1.00 0.00 C ATOM 1279 O SER B 196 14.159 17.360 28.795 1.00 0.00 O ATOM 1280 CB SER B 196 13.704 19.219 26.142 1.00 0.00 C ATOM 1281 OG SER B 196 14.155 19.534 24.829 1.00 0.00 O ATOM 0 H SER B 196 15.287 17.369 25.723 1.00 0.00 H new ATOM 0 HA SER B 196 15.507 19.817 27.175 1.00 0.00 H new ATOM 0 HB2 SER B 196 13.039 18.356 26.105 1.00 0.00 H new ATOM 0 HB3 SER B 196 13.124 20.051 26.541 1.00 0.00 H new ATOM 0 HG SER B 196 13.383 19.719 24.254 1.00 0.00 H new ATOM 1287 N ARG B 197 14.271 19.568 29.356 1.00 0.00 N ATOM 1288 CA ARG B 197 13.859 19.407 30.765 1.00 0.00 C ATOM 1289 C ARG B 197 13.388 20.759 31.328 1.00 0.00 C ATOM 1290 O ARG B 197 12.497 20.821 32.178 1.00 0.00 O ATOM 1291 CB ARG B 197 15.031 18.816 31.599 1.00 0.00 C ATOM 1292 CG ARG B 197 16.270 19.736 31.745 1.00 0.00 C ATOM 1293 CD ARG B 197 17.541 18.960 32.093 1.00 0.00 C ATOM 1294 NE ARG B 197 17.958 18.112 30.965 1.00 0.00 N ATOM 1295 CZ ARG B 197 18.712 17.013 31.046 1.00 0.00 C ATOM 1296 NH1 ARG B 197 19.135 16.547 32.215 1.00 0.00 N ATOM 1297 NH2 ARG B 197 19.044 16.380 29.940 1.00 0.00 N ATOM 0 H ARG B 197 14.447 20.538 29.093 1.00 0.00 H new ATOM 0 HA ARG B 197 13.024 18.709 30.825 1.00 0.00 H new ATOM 0 HB2 ARG B 197 14.660 18.573 32.595 1.00 0.00 H new ATOM 0 HB3 ARG B 197 15.347 17.880 31.139 1.00 0.00 H new ATOM 0 HG2 ARG B 197 16.425 20.281 30.814 1.00 0.00 H new ATOM 0 HG3 ARG B 197 16.078 20.478 32.520 1.00 0.00 H new ATOM 0 HD2 ARG B 197 18.340 19.656 32.346 1.00 0.00 H new ATOM 0 HD3 ARG B 197 17.366 18.342 32.974 1.00 0.00 H new ATOM 0 HE ARG B 197 17.642 18.389 30.036 1.00 0.00 H new ATOM 0 HH11 ARG B 197 18.885 17.031 33.078 1.00 0.00 H new ATOM 0 HH12 ARG B 197 19.710 15.705 32.251 1.00 0.00 H new ATOM 0 HH21 ARG B 197 18.726 16.731 29.037 1.00 0.00 H new ATOM 0 HH22 ARG B 197 19.620 15.539 29.987 1.00 0.00 H new ATOM 1311 N GLN B 198 14.025 21.839 30.849 1.00 0.00 N ATOM 1312 CA GLN B 198 13.603 23.223 31.115 1.00 0.00 C ATOM 1313 C GLN B 198 12.538 23.635 30.080 1.00 0.00 C ATOM 1314 O GLN B 198 12.474 23.044 28.989 1.00 0.00 O ATOM 1315 CB GLN B 198 14.833 24.168 31.046 1.00 0.00 C ATOM 1316 CG GLN B 198 15.950 23.826 32.061 1.00 0.00 C ATOM 1317 CD GLN B 198 17.181 24.736 31.963 1.00 0.00 C ATOM 1318 OE1 GLN B 198 17.088 25.906 31.601 1.00 0.00 O ATOM 1319 NE2 GLN B 198 18.345 24.205 32.296 1.00 0.00 N ATOM 0 H GLN B 198 14.856 21.775 30.260 1.00 0.00 H new ATOM 0 HA GLN B 198 13.171 23.295 32.113 1.00 0.00 H new ATOM 0 HB2 GLN B 198 15.249 24.133 30.039 1.00 0.00 H new ATOM 0 HB3 GLN B 198 14.501 25.192 31.218 1.00 0.00 H new ATOM 0 HG2 GLN B 198 15.542 23.891 33.070 1.00 0.00 H new ATOM 0 HG3 GLN B 198 16.262 22.793 31.909 1.00 0.00 H new ATOM 0 HE21 GLN B 198 18.395 23.231 32.593 1.00 0.00 H new ATOM 0 HE22 GLN B 198 19.193 24.770 32.256 1.00 0.00 H new ATOM 1328 N VAL B 199 11.706 24.636 30.427 1.00 0.00 N ATOM 1329 CA VAL B 199 10.616 25.103 29.551 1.00 0.00 C ATOM 1330 C VAL B 199 11.189 25.716 28.251 1.00 0.00 C ATOM 1331 O VAL B 199 11.948 26.695 28.282 1.00 0.00 O ATOM 1332 CB VAL B 199 9.643 26.099 30.295 1.00 0.00 C ATOM 1333 CG1 VAL B 199 10.382 27.322 30.889 1.00 0.00 C ATOM 1334 CG2 VAL B 199 8.465 26.521 29.381 1.00 0.00 C ATOM 0 H VAL B 199 11.770 25.138 31.312 1.00 0.00 H new ATOM 0 HA VAL B 199 10.014 24.237 29.276 1.00 0.00 H new ATOM 0 HB VAL B 199 9.225 25.558 31.144 1.00 0.00 H new ATOM 0 HG11 VAL B 199 9.665 27.973 31.389 1.00 0.00 H new ATOM 0 HG12 VAL B 199 11.127 26.983 31.609 1.00 0.00 H new ATOM 0 HG13 VAL B 199 10.876 27.873 30.088 1.00 0.00 H new ATOM 0 HG21 VAL B 199 7.813 27.207 29.922 1.00 0.00 H new ATOM 0 HG22 VAL B 199 8.854 27.016 28.491 1.00 0.00 H new ATOM 0 HG23 VAL B 199 7.898 25.638 29.086 1.00 0.00 H new ATOM 1344 N THR B 200 10.849 25.076 27.127 1.00 0.00 N ATOM 1345 CA THR B 200 11.392 25.401 25.808 1.00 0.00 C ATOM 1346 C THR B 200 10.814 26.739 25.281 1.00 0.00 C ATOM 1347 O THR B 200 9.606 26.973 25.350 1.00 0.00 O ATOM 1348 CB THR B 200 11.073 24.231 24.821 1.00 0.00 C ATOM 1349 OG1 THR B 200 11.520 22.981 25.380 1.00 0.00 O ATOM 1350 CG2 THR B 200 11.722 24.427 23.446 1.00 0.00 C ATOM 0 H THR B 200 10.179 24.307 27.110 1.00 0.00 H new ATOM 0 HA THR B 200 12.472 25.523 25.887 1.00 0.00 H new ATOM 0 HB THR B 200 9.992 24.221 24.680 1.00 0.00 H new ATOM 0 HG1 THR B 200 10.769 22.353 25.420 1.00 0.00 H new ATOM 0 HG21 THR B 200 11.468 23.586 22.801 1.00 0.00 H new ATOM 0 HG22 THR B 200 11.355 25.351 22.999 1.00 0.00 H new ATOM 0 HG23 THR B 200 12.805 24.483 23.559 1.00 0.00 H new ATOM 1358 N LYS B 201 11.702 27.624 24.794 1.00 0.00 N ATOM 1359 CA LYS B 201 11.315 28.895 24.158 1.00 0.00 C ATOM 1360 C LYS B 201 10.994 28.602 22.685 1.00 0.00 C ATOM 1361 O LYS B 201 11.845 28.089 21.950 1.00 0.00 O ATOM 1362 CB LYS B 201 12.456 29.957 24.269 1.00 0.00 C ATOM 1363 CG LYS B 201 12.771 30.483 25.695 1.00 0.00 C ATOM 1364 CD LYS B 201 13.366 29.414 26.635 1.00 0.00 C ATOM 1365 CE LYS B 201 13.626 29.946 28.050 1.00 0.00 C ATOM 1366 NZ LYS B 201 13.963 28.847 28.985 1.00 0.00 N ATOM 0 H LYS B 201 12.711 27.477 24.831 1.00 0.00 H new ATOM 0 HA LYS B 201 10.444 29.311 24.665 1.00 0.00 H new ATOM 0 HB2 LYS B 201 13.367 29.525 23.855 1.00 0.00 H new ATOM 0 HB3 LYS B 201 12.193 30.808 23.641 1.00 0.00 H new ATOM 0 HG2 LYS B 201 13.470 31.316 25.619 1.00 0.00 H new ATOM 0 HG3 LYS B 201 11.855 30.874 26.138 1.00 0.00 H new ATOM 0 HD2 LYS B 201 12.684 28.565 26.690 1.00 0.00 H new ATOM 0 HD3 LYS B 201 14.301 29.045 26.213 1.00 0.00 H new ATOM 0 HE2 LYS B 201 14.442 30.668 28.025 1.00 0.00 H new ATOM 0 HE3 LYS B 201 12.743 30.475 28.410 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 13.868 29.183 29.965 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 13.316 28.048 28.829 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 14.942 28.538 28.819 1.00 0.00 H new ATOM 1380 N VAL B 202 9.774 28.942 22.265 1.00 0.00 N ATOM 1381 CA VAL B 202 9.198 28.515 20.971 1.00 0.00 C ATOM 1382 C VAL B 202 8.297 29.627 20.397 1.00 0.00 C ATOM 1383 O VAL B 202 8.188 30.707 20.979 1.00 0.00 O ATOM 1384 CB VAL B 202 8.377 27.167 21.139 1.00 0.00 C ATOM 1385 CG1 VAL B 202 9.298 25.922 21.247 1.00 0.00 C ATOM 1386 CG2 VAL B 202 7.444 27.246 22.368 1.00 0.00 C ATOM 0 H VAL B 202 9.145 29.528 22.814 1.00 0.00 H new ATOM 0 HA VAL B 202 10.015 28.331 20.273 1.00 0.00 H new ATOM 0 HB VAL B 202 7.775 27.050 20.238 1.00 0.00 H new ATOM 0 HG11 VAL B 202 8.687 25.026 21.360 1.00 0.00 H new ATOM 0 HG12 VAL B 202 9.902 25.837 20.344 1.00 0.00 H new ATOM 0 HG13 VAL B 202 9.952 26.027 22.113 1.00 0.00 H new ATOM 0 HG21 VAL B 202 6.890 26.312 22.465 1.00 0.00 H new ATOM 0 HG22 VAL B 202 8.039 27.410 23.266 1.00 0.00 H new ATOM 0 HG23 VAL B 202 6.744 28.071 22.241 1.00 0.00 H new ATOM 1396 N ASP B 203 7.669 29.351 19.242 1.00 0.00 N ATOM 1397 CA ASP B 203 6.799 30.317 18.531 1.00 0.00 C ATOM 1398 C ASP B 203 5.417 29.714 18.264 1.00 0.00 C ATOM 1399 O ASP B 203 5.292 28.518 18.040 1.00 0.00 O ATOM 1400 CB ASP B 203 7.445 30.766 17.188 1.00 0.00 C ATOM 1401 CG ASP B 203 8.593 31.764 17.384 1.00 0.00 C ATOM 1402 OD1 ASP B 203 8.332 32.989 17.399 1.00 0.00 O ATOM 1403 OD2 ASP B 203 9.756 31.337 17.536 1.00 0.00 O ATOM 0 H ASP B 203 7.747 28.450 18.770 1.00 0.00 H new ATOM 0 HA ASP B 203 6.684 31.190 19.174 1.00 0.00 H new ATOM 0 HB2 ASP B 203 7.818 29.889 16.659 1.00 0.00 H new ATOM 0 HB3 ASP B 203 6.681 31.218 16.556 1.00 0.00 H new ATOM 1408 N CYS B 204 4.388 30.578 18.293 1.00 0.00 N ATOM 1409 CA CYS B 204 2.981 30.219 18.016 1.00 0.00 C ATOM 1410 C CYS B 204 2.713 30.466 16.523 1.00 0.00 C ATOM 1411 O CYS B 204 2.435 31.599 16.158 1.00 0.00 O ATOM 1412 CB CYS B 204 2.046 31.082 18.916 1.00 0.00 C ATOM 1413 SG CYS B 204 0.254 30.706 18.869 1.00 0.00 S ATOM 0 H CYS B 204 4.511 31.566 18.514 1.00 0.00 H new ATOM 0 HA CYS B 204 2.787 29.171 18.242 1.00 0.00 H new ATOM 0 HB2 CYS B 204 2.385 30.983 19.947 1.00 0.00 H new ATOM 0 HB3 CYS B 204 2.179 32.127 18.636 1.00 0.00 H new ATOM 1418 N PRO B 205 2.809 29.413 15.633 1.00 0.00 N ATOM 1419 CA PRO B 205 2.816 29.593 14.146 1.00 0.00 C ATOM 1420 C PRO B 205 1.550 30.275 13.577 1.00 0.00 C ATOM 1421 O PRO B 205 1.568 30.771 12.448 1.00 0.00 O ATOM 1422 CB PRO B 205 2.972 28.135 13.609 1.00 0.00 C ATOM 1423 CG PRO B 205 2.492 27.265 14.730 1.00 0.00 C ATOM 1424 CD PRO B 205 2.923 27.971 15.993 1.00 0.00 C ATOM 0 HA PRO B 205 3.613 30.269 13.836 1.00 0.00 H new ATOM 0 HB2 PRO B 205 2.381 27.980 12.706 1.00 0.00 H new ATOM 0 HB3 PRO B 205 4.009 27.916 13.353 1.00 0.00 H new ATOM 0 HG2 PRO B 205 1.409 27.143 14.697 1.00 0.00 H new ATOM 0 HG3 PRO B 205 2.927 26.268 14.668 1.00 0.00 H new ATOM 0 HD2 PRO B 205 2.282 27.715 16.836 1.00 0.00 H new ATOM 0 HD3 PRO B 205 3.942 27.706 16.275 1.00 0.00 H new ATOM 1432 N VAL B 206 0.465 30.302 14.370 1.00 0.00 N ATOM 1433 CA VAL B 206 -0.829 30.854 13.933 1.00 0.00 C ATOM 1434 C VAL B 206 -0.822 32.402 14.008 1.00 0.00 C ATOM 1435 O VAL B 206 -1.056 33.080 12.999 1.00 0.00 O ATOM 1436 CB VAL B 206 -2.020 30.275 14.784 1.00 0.00 C ATOM 1437 CG1 VAL B 206 -3.383 30.721 14.204 1.00 0.00 C ATOM 1438 CG2 VAL B 206 -1.934 28.729 14.894 1.00 0.00 C ATOM 0 H VAL B 206 0.460 29.945 15.325 1.00 0.00 H new ATOM 0 HA VAL B 206 -0.977 30.554 12.896 1.00 0.00 H new ATOM 0 HB VAL B 206 -1.938 30.681 15.792 1.00 0.00 H new ATOM 0 HG11 VAL B 206 -4.189 30.308 14.810 1.00 0.00 H new ATOM 0 HG12 VAL B 206 -3.444 31.809 14.213 1.00 0.00 H new ATOM 0 HG13 VAL B 206 -3.478 30.361 13.180 1.00 0.00 H new ATOM 0 HG21 VAL B 206 -2.770 28.359 15.488 1.00 0.00 H new ATOM 0 HG22 VAL B 206 -1.975 28.290 13.897 1.00 0.00 H new ATOM 0 HG23 VAL B 206 -0.996 28.450 15.375 1.00 0.00 H new ATOM 1448 N CYS B 207 -0.539 32.957 15.212 1.00 0.00 N ATOM 1449 CA CYS B 207 -0.567 34.431 15.440 1.00 0.00 C ATOM 1450 C CYS B 207 0.864 35.026 15.497 1.00 0.00 C ATOM 1451 O CYS B 207 1.030 36.231 15.697 1.00 0.00 O ATOM 1452 CB CYS B 207 -1.358 34.776 16.727 1.00 0.00 C ATOM 1453 SG CYS B 207 -0.481 34.406 18.276 1.00 0.00 S ATOM 0 H CYS B 207 -0.290 32.414 16.038 1.00 0.00 H new ATOM 0 HA CYS B 207 -1.079 34.884 14.591 1.00 0.00 H new ATOM 0 HB2 CYS B 207 -1.608 35.837 16.711 1.00 0.00 H new ATOM 0 HB3 CYS B 207 -2.299 34.227 16.718 1.00 0.00 H new ATOM 1458 N GLY B 208 1.884 34.156 15.352 1.00 0.00 N ATOM 1459 CA GLY B 208 3.282 34.575 15.147 1.00 0.00 C ATOM 1460 C GLY B 208 3.945 35.239 16.354 1.00 0.00 C ATOM 1461 O GLY B 208 4.676 36.224 16.193 1.00 0.00 O ATOM 0 H GLY B 208 1.760 33.144 15.374 1.00 0.00 H new ATOM 0 HA2 GLY B 208 3.869 33.701 14.865 1.00 0.00 H new ATOM 0 HA3 GLY B 208 3.318 35.268 14.306 1.00 0.00 H new ATOM 1465 N VAL B 209 3.716 34.692 17.564 1.00 0.00 N ATOM 1466 CA VAL B 209 4.264 35.267 18.822 1.00 0.00 C ATOM 1467 C VAL B 209 5.232 34.279 19.502 1.00 0.00 C ATOM 1468 O VAL B 209 4.962 33.075 19.558 1.00 0.00 O ATOM 1469 CB VAL B 209 3.117 35.699 19.819 1.00 0.00 C ATOM 1470 CG1 VAL B 209 2.160 36.713 19.151 1.00 0.00 C ATOM 1471 CG2 VAL B 209 2.329 34.489 20.373 1.00 0.00 C ATOM 0 H VAL B 209 3.155 33.851 17.703 1.00 0.00 H new ATOM 0 HA VAL B 209 4.819 36.165 18.552 1.00 0.00 H new ATOM 0 HB VAL B 209 3.602 36.181 20.668 1.00 0.00 H new ATOM 0 HG11 VAL B 209 1.379 36.995 19.857 1.00 0.00 H new ATOM 0 HG12 VAL B 209 2.719 37.600 18.854 1.00 0.00 H new ATOM 0 HG13 VAL B 209 1.706 36.259 18.270 1.00 0.00 H new ATOM 0 HG21 VAL B 209 1.553 34.841 21.053 1.00 0.00 H new ATOM 0 HG22 VAL B 209 1.869 33.945 19.548 1.00 0.00 H new ATOM 0 HG23 VAL B 209 3.009 33.827 20.910 1.00 0.00 H new ATOM 1481 N ASN B 210 6.367 34.802 20.004 1.00 0.00 N ATOM 1482 CA ASN B 210 7.390 33.997 20.696 1.00 0.00 C ATOM 1483 C ASN B 210 7.069 33.933 22.202 1.00 0.00 C ATOM 1484 O ASN B 210 6.954 34.973 22.859 1.00 0.00 O ATOM 1485 CB ASN B 210 8.802 34.583 20.444 1.00 0.00 C ATOM 1486 CG ASN B 210 9.909 33.690 21.002 1.00 0.00 C ATOM 1487 OD1 ASN B 210 10.356 33.862 22.134 1.00 0.00 O ATOM 1488 ND2 ASN B 210 10.340 32.708 20.221 1.00 0.00 N ATOM 0 H ASN B 210 6.600 35.793 19.941 1.00 0.00 H new ATOM 0 HA ASN B 210 7.380 32.982 20.299 1.00 0.00 H new ATOM 0 HB2 ASN B 210 8.952 34.717 19.373 1.00 0.00 H new ATOM 0 HB3 ASN B 210 8.870 35.570 20.901 1.00 0.00 H new ATOM 0 HD21 ASN B 210 11.062 32.070 20.555 1.00 0.00 H new ATOM 0 HD22 ASN B 210 9.949 32.591 19.286 1.00 0.00 H new ATOM 1495 N ILE B 211 6.942 32.701 22.730 1.00 0.00 N ATOM 1496 CA ILE B 211 6.398 32.409 24.078 1.00 0.00 C ATOM 1497 C ILE B 211 6.980 31.070 24.621 1.00 0.00 C ATOM 1498 O ILE B 211 7.495 30.265 23.836 1.00 0.00 O ATOM 1499 CB ILE B 211 4.812 32.323 24.045 1.00 0.00 C ATOM 1500 CG1 ILE B 211 4.346 31.440 22.841 1.00 0.00 C ATOM 1501 CG2 ILE B 211 4.151 33.727 24.018 1.00 0.00 C ATOM 1502 CD1 ILE B 211 2.846 31.355 22.651 1.00 0.00 C ATOM 0 H ILE B 211 7.220 31.860 22.224 1.00 0.00 H new ATOM 0 HA ILE B 211 6.691 33.224 24.739 1.00 0.00 H new ATOM 0 HB ILE B 211 4.481 31.848 24.969 1.00 0.00 H new ATOM 0 HG12 ILE B 211 4.791 31.834 21.927 1.00 0.00 H new ATOM 0 HG13 ILE B 211 4.737 30.432 22.977 1.00 0.00 H new ATOM 0 HG21 ILE B 211 3.067 33.618 23.996 1.00 0.00 H new ATOM 0 HG22 ILE B 211 4.442 34.283 24.909 1.00 0.00 H new ATOM 0 HG23 ILE B 211 4.480 34.267 23.130 1.00 0.00 H new ATOM 0 HD11 ILE B 211 2.623 30.721 21.793 1.00 0.00 H new ATOM 0 HD12 ILE B 211 2.390 30.929 23.545 1.00 0.00 H new ATOM 0 HD13 ILE B 211 2.444 32.353 22.479 1.00 0.00 H new ATOM 1514 N PRO B 212 6.938 30.828 25.981 1.00 0.00 N ATOM 1515 CA PRO B 212 7.290 29.511 26.587 1.00 0.00 C ATOM 1516 C PRO B 212 6.411 28.338 26.076 1.00 0.00 C ATOM 1517 O PRO B 212 5.313 28.546 25.563 1.00 0.00 O ATOM 1518 CB PRO B 212 7.094 29.741 28.118 1.00 0.00 C ATOM 1519 CG PRO B 212 6.279 30.990 28.231 1.00 0.00 C ATOM 1520 CD PRO B 212 6.647 31.833 27.035 1.00 0.00 C ATOM 0 HA PRO B 212 8.303 29.211 26.319 1.00 0.00 H new ATOM 0 HB2 PRO B 212 6.584 28.896 28.580 1.00 0.00 H new ATOM 0 HB3 PRO B 212 8.053 29.850 28.625 1.00 0.00 H new ATOM 0 HG2 PRO B 212 5.213 30.762 28.235 1.00 0.00 H new ATOM 0 HG3 PRO B 212 6.496 31.515 29.161 1.00 0.00 H new ATOM 0 HD2 PRO B 212 5.832 32.495 26.744 1.00 0.00 H new ATOM 0 HD3 PRO B 212 7.513 32.463 27.239 1.00 0.00 H new ATOM 1528 N GLU B 213 6.924 27.110 26.274 1.00 0.00 N ATOM 1529 CA GLU B 213 6.356 25.847 25.747 1.00 0.00 C ATOM 1530 C GLU B 213 4.938 25.540 26.299 1.00 0.00 C ATOM 1531 O GLU B 213 4.034 25.145 25.555 1.00 0.00 O ATOM 1532 CB GLU B 213 7.340 24.708 26.095 1.00 0.00 C ATOM 1533 CG GLU B 213 7.000 23.318 25.530 1.00 0.00 C ATOM 1534 CD GLU B 213 7.996 22.242 25.993 1.00 0.00 C ATOM 1535 OE1 GLU B 213 8.056 21.972 27.218 1.00 0.00 O ATOM 1536 OE2 GLU B 213 8.725 21.677 25.153 1.00 0.00 O ATOM 0 H GLU B 213 7.771 26.960 26.822 1.00 0.00 H new ATOM 0 HA GLU B 213 6.233 25.942 24.668 1.00 0.00 H new ATOM 0 HB2 GLU B 213 8.330 24.990 25.737 1.00 0.00 H new ATOM 0 HB3 GLU B 213 7.403 24.630 27.180 1.00 0.00 H new ATOM 0 HG2 GLU B 213 5.994 23.037 25.842 1.00 0.00 H new ATOM 0 HG3 GLU B 213 6.996 23.362 24.441 1.00 0.00 H new ATOM 1543 N SER B 214 4.754 25.715 27.613 1.00 0.00 N ATOM 1544 CA SER B 214 3.442 25.511 28.261 1.00 0.00 C ATOM 1545 C SER B 214 2.401 26.516 27.700 1.00 0.00 C ATOM 1546 O SER B 214 1.243 26.161 27.376 1.00 0.00 O ATOM 1547 CB SER B 214 3.601 25.658 29.790 1.00 0.00 C ATOM 1548 OG SER B 214 4.617 24.783 30.274 1.00 0.00 O ATOM 0 H SER B 214 5.495 25.998 28.254 1.00 0.00 H new ATOM 0 HA SER B 214 3.077 24.507 28.044 1.00 0.00 H new ATOM 0 HB2 SER B 214 3.853 26.689 30.038 1.00 0.00 H new ATOM 0 HB3 SER B 214 2.655 25.434 30.283 1.00 0.00 H new ATOM 0 HG SER B 214 4.706 24.890 31.244 1.00 0.00 H new ATOM 1554 N HIS B 215 2.876 27.758 27.516 1.00 0.00 N ATOM 1555 CA HIS B 215 2.060 28.867 27.014 1.00 0.00 C ATOM 1556 C HIS B 215 1.781 28.717 25.512 1.00 0.00 C ATOM 1557 O HIS B 215 0.778 29.237 25.027 1.00 0.00 O ATOM 1558 CB HIS B 215 2.767 30.213 27.313 1.00 0.00 C ATOM 1559 CG HIS B 215 1.919 31.444 27.092 1.00 0.00 C ATOM 1560 ND1 HIS B 215 2.456 32.701 26.932 1.00 0.00 N ATOM 1561 CD2 HIS B 215 0.571 31.609 27.043 1.00 0.00 C ATOM 1562 CE1 HIS B 215 1.480 33.575 26.796 1.00 0.00 C ATOM 1563 NE2 HIS B 215 0.333 32.938 26.861 1.00 0.00 N ATOM 0 H HIS B 215 3.842 28.019 27.713 1.00 0.00 H new ATOM 0 HA HIS B 215 1.098 28.851 27.527 1.00 0.00 H new ATOM 0 HB2 HIS B 215 3.106 30.205 28.349 1.00 0.00 H new ATOM 0 HB3 HIS B 215 3.656 30.286 26.687 1.00 0.00 H new ATOM 0 HD2 HIS B 215 -0.173 30.831 27.132 1.00 0.00 H new ATOM 0 HE1 HIS B 215 1.602 34.639 26.655 1.00 0.00 H new ATOM 0 HE2 HIS B 215 -0.588 33.369 26.787 1.00 0.00 H new ATOM 1572 N ILE B 216 2.676 28.018 24.783 1.00 0.00 N ATOM 1573 CA ILE B 216 2.539 27.840 23.330 1.00 0.00 C ATOM 1574 C ILE B 216 1.349 26.918 23.043 1.00 0.00 C ATOM 1575 O ILE B 216 0.519 27.235 22.190 1.00 0.00 O ATOM 1576 CB ILE B 216 3.894 27.342 22.638 1.00 0.00 C ATOM 1577 CG1 ILE B 216 4.062 27.943 21.201 1.00 0.00 C ATOM 1578 CG2 ILE B 216 4.041 25.795 22.569 1.00 0.00 C ATOM 1579 CD1 ILE B 216 3.126 27.380 20.156 1.00 0.00 C ATOM 0 H ILE B 216 3.501 27.569 25.181 1.00 0.00 H new ATOM 0 HA ILE B 216 2.339 28.811 22.878 1.00 0.00 H new ATOM 0 HB ILE B 216 4.687 27.711 23.289 1.00 0.00 H new ATOM 0 HG12 ILE B 216 3.914 29.021 21.256 1.00 0.00 H new ATOM 0 HG13 ILE B 216 5.088 27.779 20.873 1.00 0.00 H new ATOM 0 HG21 ILE B 216 4.985 25.540 22.087 1.00 0.00 H new ATOM 0 HG22 ILE B 216 4.026 25.383 23.578 1.00 0.00 H new ATOM 0 HG23 ILE B 216 3.215 25.376 21.994 1.00 0.00 H new ATOM 0 HD11 ILE B 216 3.321 27.859 19.197 1.00 0.00 H new ATOM 0 HD12 ILE B 216 3.287 26.306 20.064 1.00 0.00 H new ATOM 0 HD13 ILE B 216 2.094 27.568 20.453 1.00 0.00 H new ATOM 1591 N ASN B 217 1.234 25.823 23.818 1.00 0.00 N ATOM 1592 CA ASN B 217 0.155 24.843 23.634 1.00 0.00 C ATOM 1593 C ASN B 217 -1.210 25.470 23.995 1.00 0.00 C ATOM 1594 O ASN B 217 -2.213 25.211 23.312 1.00 0.00 O ATOM 1595 CB ASN B 217 0.438 23.554 24.448 1.00 0.00 C ATOM 1596 CG ASN B 217 -0.561 22.431 24.149 1.00 0.00 C ATOM 1597 OD1 ASN B 217 -0.461 21.757 23.123 1.00 0.00 O ATOM 1598 ND2 ASN B 217 -1.511 22.202 25.036 1.00 0.00 N ATOM 0 H ASN B 217 1.877 25.598 24.577 1.00 0.00 H new ATOM 0 HA ASN B 217 0.115 24.556 22.583 1.00 0.00 H new ATOM 0 HB2 ASN B 217 1.447 23.205 24.228 1.00 0.00 H new ATOM 0 HB3 ASN B 217 0.407 23.788 25.512 1.00 0.00 H new ATOM 0 HD21 ASN B 217 -2.184 21.452 24.880 1.00 0.00 H new ATOM 0 HD22 ASN B 217 -1.572 22.775 25.878 1.00 0.00 H new ATOM 1605 N LYS B 218 -1.228 26.325 25.046 1.00 0.00 N ATOM 1606 CA LYS B 218 -2.448 27.054 25.447 1.00 0.00 C ATOM 1607 C LYS B 218 -2.834 28.132 24.407 1.00 0.00 C ATOM 1608 O LYS B 218 -4.024 28.299 24.074 1.00 0.00 O ATOM 1609 CB LYS B 218 -2.258 27.691 26.849 1.00 0.00 C ATOM 1610 CG LYS B 218 -3.546 28.335 27.422 1.00 0.00 C ATOM 1611 CD LYS B 218 -3.377 28.924 28.843 1.00 0.00 C ATOM 1612 CE LYS B 218 -2.340 30.056 28.914 1.00 0.00 C ATOM 1613 NZ LYS B 218 -2.331 30.710 30.248 1.00 0.00 N ATOM 0 H LYS B 218 -0.413 26.524 25.627 1.00 0.00 H new ATOM 0 HA LYS B 218 -3.266 26.336 25.494 1.00 0.00 H new ATOM 0 HB2 LYS B 218 -1.906 26.926 27.541 1.00 0.00 H new ATOM 0 HB3 LYS B 218 -1.478 28.450 26.790 1.00 0.00 H new ATOM 0 HG2 LYS B 218 -3.875 29.127 26.749 1.00 0.00 H new ATOM 0 HG3 LYS B 218 -4.337 27.585 27.442 1.00 0.00 H new ATOM 0 HD2 LYS B 218 -4.340 29.301 29.189 1.00 0.00 H new ATOM 0 HD3 LYS B 218 -3.082 28.127 29.526 1.00 0.00 H new ATOM 0 HE2 LYS B 218 -1.349 29.656 28.698 1.00 0.00 H new ATOM 0 HE3 LYS B 218 -2.558 30.798 28.146 1.00 0.00 H new ATOM 0 HZ1 LYS B 218 -1.619 31.468 30.258 1.00 0.00 H new ATOM 0 HZ2 LYS B 218 -3.269 31.113 30.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 218 -2.098 30.007 30.978 1.00 0.00 H new ATOM 1627 N HIS B 219 -1.808 28.839 23.879 1.00 0.00 N ATOM 1628 CA HIS B 219 -2.006 29.939 22.910 1.00 0.00 C ATOM 1629 C HIS B 219 -2.654 29.392 21.647 1.00 0.00 C ATOM 1630 O HIS B 219 -3.594 29.974 21.134 1.00 0.00 O ATOM 1631 CB HIS B 219 -0.664 30.664 22.548 1.00 0.00 C ATOM 1632 CG HIS B 219 -0.737 32.171 22.637 1.00 0.00 C ATOM 1633 ND1 HIS B 219 -0.772 33.007 21.527 1.00 0.00 N ATOM 1634 CD2 HIS B 219 -0.773 32.943 23.755 1.00 0.00 C ATOM 1635 CE1 HIS B 219 -0.827 34.234 22.022 1.00 0.00 C ATOM 1636 NE2 HIS B 219 -0.829 34.239 23.352 1.00 0.00 N ATOM 0 H HIS B 219 -0.830 28.665 24.110 1.00 0.00 H new ATOM 0 HA HIS B 219 -2.656 30.678 23.378 1.00 0.00 H new ATOM 0 HB2 HIS B 219 0.121 30.308 23.216 1.00 0.00 H new ATOM 0 HB3 HIS B 219 -0.373 30.384 21.536 1.00 0.00 H new ATOM 0 HD2 HIS B 219 -0.760 32.591 24.776 1.00 0.00 H new ATOM 0 HE1 HIS B 219 -0.866 35.127 21.416 1.00 0.00 H new ATOM 0 HE2 HIS B 219 -0.866 35.061 23.955 1.00 0.00 H new ATOM 1644 N LEU B 220 -2.122 28.254 21.181 1.00 0.00 N ATOM 1645 CA LEU B 220 -2.648 27.542 20.017 1.00 0.00 C ATOM 1646 C LEU B 220 -4.066 27.086 20.253 1.00 0.00 C ATOM 1647 O LEU B 220 -4.888 27.236 19.383 1.00 0.00 O ATOM 1648 CB LEU B 220 -1.806 26.309 19.695 1.00 0.00 C ATOM 1649 CG LEU B 220 -0.364 26.595 19.260 1.00 0.00 C ATOM 1650 CD1 LEU B 220 0.402 25.288 19.140 1.00 0.00 C ATOM 1651 CD2 LEU B 220 -0.309 27.427 17.960 1.00 0.00 C ATOM 0 H LEU B 220 -1.312 27.803 21.605 1.00 0.00 H new ATOM 0 HA LEU B 220 -2.615 28.243 19.183 1.00 0.00 H new ATOM 0 HB2 LEU B 220 -1.782 25.666 20.575 1.00 0.00 H new ATOM 0 HB3 LEU B 220 -2.302 25.747 18.903 1.00 0.00 H new ATOM 0 HG LEU B 220 0.117 27.205 20.025 1.00 0.00 H new ATOM 0 HD11 LEU B 220 1.427 25.494 18.831 1.00 0.00 H new ATOM 0 HD12 LEU B 220 0.409 24.781 20.105 1.00 0.00 H new ATOM 0 HD13 LEU B 220 -0.080 24.651 18.398 1.00 0.00 H new ATOM 0 HD21 LEU B 220 0.731 27.607 17.687 1.00 0.00 H new ATOM 0 HD22 LEU B 220 -0.805 26.881 17.158 1.00 0.00 H new ATOM 0 HD23 LEU B 220 -0.813 28.380 18.117 1.00 0.00 H new ATOM 1663 N ASP B 221 -4.318 26.545 21.451 1.00 0.00 N ATOM 1664 CA ASP B 221 -5.625 25.971 21.820 1.00 0.00 C ATOM 1665 C ASP B 221 -6.757 27.020 21.643 1.00 0.00 C ATOM 1666 O ASP B 221 -7.908 26.667 21.395 1.00 0.00 O ATOM 1667 CB ASP B 221 -5.559 25.429 23.271 1.00 0.00 C ATOM 1668 CG ASP B 221 -6.672 24.421 23.601 1.00 0.00 C ATOM 1669 OD1 ASP B 221 -7.772 24.832 24.022 1.00 0.00 O ATOM 1670 OD2 ASP B 221 -6.448 23.206 23.424 1.00 0.00 O ATOM 0 H ASP B 221 -3.623 26.491 22.195 1.00 0.00 H new ATOM 0 HA ASP B 221 -5.858 25.139 21.155 1.00 0.00 H new ATOM 0 HB2 ASP B 221 -4.591 24.954 23.429 1.00 0.00 H new ATOM 0 HB3 ASP B 221 -5.620 26.266 23.966 1.00 0.00 H new ATOM 1675 N SER B 222 -6.387 28.311 21.764 1.00 0.00 N ATOM 1676 CA SER B 222 -7.281 29.451 21.466 1.00 0.00 C ATOM 1677 C SER B 222 -7.140 29.914 19.984 1.00 0.00 C ATOM 1678 O SER B 222 -8.136 30.226 19.324 1.00 0.00 O ATOM 1679 CB SER B 222 -6.945 30.612 22.431 1.00 0.00 C ATOM 1680 OG SER B 222 -7.828 31.712 22.271 1.00 0.00 O ATOM 0 H SER B 222 -5.457 28.594 22.072 1.00 0.00 H new ATOM 0 HA SER B 222 -8.315 29.137 21.608 1.00 0.00 H new ATOM 0 HB2 SER B 222 -6.995 30.254 23.459 1.00 0.00 H new ATOM 0 HB3 SER B 222 -5.921 30.942 22.258 1.00 0.00 H new ATOM 0 HG SER B 222 -7.583 32.423 22.900 1.00 0.00 H new ATOM 1686 N CYS B 223 -5.891 29.925 19.473 1.00 0.00 N ATOM 1687 CA CYS B 223 -5.530 30.509 18.157 1.00 0.00 C ATOM 1688 C CYS B 223 -5.971 29.627 16.966 1.00 0.00 C ATOM 1689 O CYS B 223 -6.150 30.130 15.854 1.00 0.00 O ATOM 1690 CB CYS B 223 -4.002 30.781 18.103 1.00 0.00 C ATOM 1691 SG CYS B 223 -3.451 32.084 19.260 1.00 0.00 S ATOM 0 H CYS B 223 -5.093 29.525 19.966 1.00 0.00 H new ATOM 0 HA CYS B 223 -6.073 31.449 18.060 1.00 0.00 H new ATOM 0 HB2 CYS B 223 -3.469 29.857 18.328 1.00 0.00 H new ATOM 0 HB3 CYS B 223 -3.728 31.068 17.088 1.00 0.00 H new ATOM 1696 N LEU B 224 -6.159 28.316 17.210 1.00 0.00 N ATOM 1697 CA LEU B 224 -6.568 27.351 16.163 1.00 0.00 C ATOM 1698 C LEU B 224 -8.093 27.356 16.045 1.00 0.00 C ATOM 1699 O LEU B 224 -8.650 26.981 15.004 1.00 0.00 O ATOM 1700 CB LEU B 224 -6.002 25.917 16.469 1.00 0.00 C ATOM 1701 CG LEU B 224 -6.495 25.179 17.780 1.00 0.00 C ATOM 1702 CD1 LEU B 224 -7.832 24.424 17.596 1.00 0.00 C ATOM 1703 CD2 LEU B 224 -5.402 24.231 18.326 1.00 0.00 C ATOM 0 H LEU B 224 -6.034 27.895 18.131 1.00 0.00 H new ATOM 0 HA LEU B 224 -6.148 27.651 15.203 1.00 0.00 H new ATOM 0 HB2 LEU B 224 -6.239 25.278 15.619 1.00 0.00 H new ATOM 0 HB3 LEU B 224 -4.916 25.992 16.518 1.00 0.00 H new ATOM 0 HG LEU B 224 -6.685 25.963 18.513 1.00 0.00 H new ATOM 0 HD11 LEU B 224 -8.110 23.942 18.533 1.00 0.00 H new ATOM 0 HD12 LEU B 224 -8.611 25.129 17.306 1.00 0.00 H new ATOM 0 HD13 LEU B 224 -7.719 23.668 16.819 1.00 0.00 H new ATOM 0 HD21 LEU B 224 -5.766 23.737 19.227 1.00 0.00 H new ATOM 0 HD22 LEU B 224 -5.161 23.481 17.572 1.00 0.00 H new ATOM 0 HD23 LEU B 224 -4.507 24.806 18.564 1.00 0.00 H new ATOM 1715 N SER B 225 -8.752 27.772 17.149 1.00 0.00 N ATOM 1716 CA SER B 225 -10.205 27.881 17.241 1.00 0.00 C ATOM 1717 C SER B 225 -10.692 29.072 16.390 1.00 0.00 C ATOM 1718 O SER B 225 -10.840 30.201 16.879 1.00 0.00 O ATOM 1719 CB SER B 225 -10.628 28.008 18.724 1.00 0.00 C ATOM 1720 OG SER B 225 -10.138 26.919 19.498 1.00 0.00 O ATOM 0 H SER B 225 -8.273 28.043 18.008 1.00 0.00 H new ATOM 0 HA SER B 225 -10.674 26.981 16.844 1.00 0.00 H new ATOM 0 HB2 SER B 225 -10.251 28.946 19.133 1.00 0.00 H new ATOM 0 HB3 SER B 225 -11.715 28.045 18.792 1.00 0.00 H new ATOM 0 HG SER B 225 -9.364 27.213 20.022 1.00 0.00 H new ATOM 1726 N ARG B 226 -10.872 28.797 15.091 1.00 0.00 N ATOM 1727 CA ARG B 226 -11.272 29.789 14.080 1.00 0.00 C ATOM 1728 C ARG B 226 -12.780 29.677 13.802 1.00 0.00 C ATOM 1729 O ARG B 226 -13.457 30.682 13.594 1.00 0.00 O ATOM 1730 CB ARG B 226 -10.423 29.578 12.785 1.00 0.00 C ATOM 1731 CG ARG B 226 -10.605 28.199 12.093 1.00 0.00 C ATOM 1732 CD ARG B 226 -9.600 27.946 10.954 1.00 0.00 C ATOM 1733 NE ARG B 226 -9.561 29.049 9.973 1.00 0.00 N ATOM 1734 CZ ARG B 226 -10.304 29.129 8.857 1.00 0.00 C ATOM 1735 NH1 ARG B 226 -11.249 28.240 8.588 1.00 0.00 N ATOM 1736 NH2 ARG B 226 -10.114 30.137 8.022 1.00 0.00 N ATOM 0 H ARG B 226 -10.742 27.862 14.705 1.00 0.00 H new ATOM 0 HA ARG B 226 -11.082 30.797 14.449 1.00 0.00 H new ATOM 0 HB2 ARG B 226 -10.678 30.361 12.071 1.00 0.00 H new ATOM 0 HB3 ARG B 226 -9.370 29.705 13.035 1.00 0.00 H new ATOM 0 HG2 ARG B 226 -10.503 27.411 12.839 1.00 0.00 H new ATOM 0 HG3 ARG B 226 -11.618 28.132 11.695 1.00 0.00 H new ATOM 0 HD2 ARG B 226 -8.605 27.806 11.377 1.00 0.00 H new ATOM 0 HD3 ARG B 226 -9.862 27.020 10.443 1.00 0.00 H new ATOM 0 HE ARG B 226 -8.914 29.816 10.159 1.00 0.00 H new ATOM 0 HH11 ARG B 226 -11.426 27.472 9.236 1.00 0.00 H new ATOM 0 HH12 ARG B 226 -11.799 28.324 7.733 1.00 0.00 H new ATOM 0 HH21 ARG B 226 -9.409 30.844 8.228 1.00 0.00 H new ATOM 0 HH22 ARG B 226 -10.673 30.207 7.172 1.00 0.00 H new ATOM 1750 N GLU B 227 -13.299 28.432 13.830 1.00 0.00 N ATOM 1751 CA GLU B 227 -14.714 28.120 13.549 1.00 0.00 C ATOM 1752 C GLU B 227 -15.237 27.178 14.656 1.00 0.00 C ATOM 1753 O GLU B 227 -16.023 27.616 15.516 1.00 0.00 O ATOM 1754 CB GLU B 227 -14.863 27.463 12.141 1.00 0.00 C ATOM 1755 CG GLU B 227 -14.326 28.315 10.976 1.00 0.00 C ATOM 1756 CD GLU B 227 -14.349 27.580 9.630 1.00 0.00 C ATOM 1757 OE1 GLU B 227 -13.489 26.690 9.424 1.00 0.00 O ATOM 1758 OE2 GLU B 227 -15.217 27.888 8.776 1.00 0.00 O ATOM 1759 OXT GLU B 227 -14.797 26.011 14.699 1.00 0.00 O ATOM 0 H GLU B 227 -12.741 27.607 14.051 1.00 0.00 H new ATOM 0 HA GLU B 227 -15.302 29.038 13.543 1.00 0.00 H new ATOM 0 HB2 GLU B 227 -14.342 26.506 12.144 1.00 0.00 H new ATOM 0 HB3 GLU B 227 -15.917 27.251 11.963 1.00 0.00 H new ATOM 0 HG2 GLU B 227 -14.920 29.225 10.896 1.00 0.00 H new ATOM 0 HG3 GLU B 227 -13.304 28.620 11.199 1.00 0.00 H new TER 1766 GLU B 227 HETATM 1767 ZN ZN B 301 -1.135 32.516 19.499 1.00 0.00 ZN