USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1166 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 9 MET CE :methyl -134:sc= -1.77 (180deg=-2.26) USER MOD Set 1.2: A 118 CYS SG : rot -171:sc= -0.24 USER MOD Set 2.1: A 83 HIS : no HE2:sc= 1.19 K(o=-1.3,f=-6.8!) USER MOD Set 2.2: A 86 THR OG1 : rot 180:sc= -2.45! USER MOD Single : A 1 MET CE :methyl -140:sc= 0 (180deg=-1.26!) USER MOD Single : A 1 MET N :NH3+ -169:sc= 1.25 (180deg=0.846) USER MOD Single : A 3 THR OG1 : rot 100:sc= 0.11 USER MOD Single : A 5 THR OG1 : rot -169:sc= -3.08! USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 147:sc= 1.19 (180deg=0.487) USER MOD Single : A 8 GLN : amide:sc= -1.92 X(o=-1.9,f=-1.5) USER MOD Single : A 12 MET CE :methyl -175:sc= -1.51 (180deg=-1.71) USER MOD Single : A 15 HIS : no HD1:sc= -3.98! C(o=-4!,f=-6.2!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= -1.89! X(o=-1.9!,f=-2.4) USER MOD Single : A 25 CYS SG : rot -109:sc= -0.311 USER MOD Single : A 43 TYR OH : rot 17:sc= 0.995 USER MOD Single : A 46 ASN : amide:sc= -0.459 X(o=-0.46,f=-0.091) USER MOD Single : A 47 ASN : amide:sc= -0.153! C(o=-0.15!,f=-12!) USER MOD Single : A 50 GLN : amide:sc=-0.00331 K(o=-0.0033,f=-0.89) USER MOD Single : A 51 SER OG : rot 95:sc= 1.25 USER MOD Single : A 54 HIS : +bothHN:sc= 0.27 K(o=0.27,f=-5.7!) USER MOD Single : A 56 SER OG : rot 180:sc=-0.00794 USER MOD Single : A 57 MET CE :methyl -106:sc= -2.27 (180deg=-4.21!) USER MOD Single : A 62 GLN : amide:sc= -0.946 K(o=-0.95,f=-1.8) USER MOD Single : A 64 THR OG1 : rot 76:sc= 0.987 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl 147:sc= -0.331 (180deg=-1.92) USER MOD Single : A 71 LYS NZ :NH3+ 153:sc= 1.31 (180deg=1.13) USER MOD Single : A 72 ASN : amide:sc=-0.000508 X(o=-0.00051,f=-0.0074) USER MOD Single : A 76 MET CE :methyl -140:sc= -0.1 (180deg=-0.69) USER MOD Single : A 79 ASN : amide:sc= 0.00235 K(o=0.0023,f=-3!) USER MOD Single : A 81 HIS : no HD1:sc= -0.163 K(o=-0.16,f=-5.9!) USER MOD Single : A 82 SER OG : rot 19:sc= -0.0469 USER MOD Single : A 91 SER OG : rot 180:sc= -0.0849 USER MOD Single : A 95 LYS NZ :NH3+ -174:sc= 0.796 (180deg=0.755) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot -129:sc= 0.801 USER MOD Single : A 105 TYR OH : rot 60:sc= 0.683 USER MOD Single : A 109 SER OG : rot 65:sc= 1.01 USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0313) USER MOD Single : A 119 LYS NZ :NH3+ 169:sc= 0.834! (180deg=0.642!) USER MOD Single : A 120 SER OG : rot 180:sc= -0.632 USER MOD Single : A 124 LYS NZ :NH3+ 156:sc= 0.597 (180deg=0.162) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 HIS : +bothHN:sc= 2.18 K(o=2.2,f=-7.3!) USER MOD Single : A 142 HIS : no HD1:sc= -0.25 X(o=-0.25,f=0) USER MOD Single : A 143 HIS : no HD1:sc= -0.0414 X(o=-0.041,f=0) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 145 HIS : no HD1:sc= -0.0269 X(o=-0.027,f=-0.031) USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=-0.33) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.455 -3.138 5.183 1.00 0.00 N ATOM 2 CA MET A 1 -13.006 -3.341 3.784 1.00 0.00 C ATOM 3 C MET A 1 -12.132 -2.178 3.330 1.00 0.00 C ATOM 4 O MET A 1 -12.131 -1.114 3.950 1.00 0.00 O ATOM 5 CB MET A 1 -14.205 -3.499 2.835 1.00 0.00 C ATOM 6 CG MET A 1 -14.995 -2.217 2.594 1.00 0.00 C ATOM 7 SD MET A 1 -15.808 -1.591 4.079 1.00 0.00 S ATOM 8 CE MET A 1 -16.565 -0.100 3.443 1.00 0.00 C ATOM 0 H1 MET A 1 -13.888 -4.014 5.539 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.638 -2.889 5.777 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.154 -2.368 5.215 1.00 0.00 H new ATOM 0 HA MET A 1 -12.420 -4.259 3.752 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.847 -3.875 1.877 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.878 -4.254 3.242 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.323 -1.452 2.206 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.747 -2.400 1.826 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.472 0.698 4.180 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.065 0.197 2.521 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.620 -0.286 3.240 1.00 0.00 H new ATOM 20 N ILE A 2 -11.383 -2.387 2.253 1.00 0.00 N ATOM 21 CA ILE A 2 -10.526 -1.347 1.706 1.00 0.00 C ATOM 22 C ILE A 2 -11.002 -0.936 0.316 1.00 0.00 C ATOM 23 O ILE A 2 -11.301 -1.779 -0.532 1.00 0.00 O ATOM 24 CB ILE A 2 -9.043 -1.795 1.649 1.00 0.00 C ATOM 25 CG1 ILE A 2 -8.210 -0.807 0.823 1.00 0.00 C ATOM 26 CG2 ILE A 2 -8.922 -3.203 1.089 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.756 -1.201 0.675 1.00 0.00 C ATOM 0 H ILE A 2 -11.353 -3.269 1.742 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.591 -0.488 2.374 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.653 -1.803 2.667 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.653 -0.714 -0.168 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.264 0.177 1.290 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -7.872 -3.494 1.059 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.473 -3.896 1.725 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -9.335 -3.230 0.080 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -6.235 -0.452 0.078 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.294 -1.265 1.660 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.690 -2.170 0.180 1.00 0.00 H new ATOM 39 N THR A 3 -11.091 0.363 0.096 1.00 0.00 N ATOM 40 CA THR A 3 -11.478 0.891 -1.196 1.00 0.00 C ATOM 41 C THR A 3 -10.411 1.844 -1.720 1.00 0.00 C ATOM 42 O THR A 3 -9.918 2.704 -0.986 1.00 0.00 O ATOM 43 CB THR A 3 -12.830 1.629 -1.119 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.798 0.808 -0.451 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.339 1.978 -2.509 1.00 0.00 C ATOM 0 H THR A 3 -10.899 1.074 0.801 1.00 0.00 H new ATOM 0 HA THR A 3 -11.582 0.047 -1.878 1.00 0.00 H new ATOM 0 HB THR A 3 -12.681 2.552 -0.559 1.00 0.00 H new ATOM 0 HG1 THR A 3 -13.881 1.094 0.483 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.294 2.498 -2.427 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.617 2.623 -3.010 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.472 1.064 -3.088 1.00 0.00 H new ATOM 53 N LEU A 4 -10.039 1.666 -2.975 1.00 0.00 N ATOM 54 CA LEU A 4 -9.120 2.569 -3.642 1.00 0.00 C ATOM 55 C LEU A 4 -9.536 2.727 -5.091 1.00 0.00 C ATOM 56 O LEU A 4 -10.323 1.937 -5.608 1.00 0.00 O ATOM 57 CB LEU A 4 -7.666 2.083 -3.517 1.00 0.00 C ATOM 58 CG LEU A 4 -7.410 0.612 -3.859 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.253 0.418 -5.359 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.180 0.106 -3.119 1.00 0.00 C ATOM 0 H LEU A 4 -10.364 0.895 -3.558 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.164 3.544 -3.157 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.043 2.698 -4.166 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.333 2.259 -2.494 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.274 0.031 -3.537 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.072 -0.635 -5.573 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.163 0.740 -5.865 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.411 1.010 -5.716 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.009 -0.941 -3.371 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.311 0.696 -3.411 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.338 0.200 -2.045 1.00 0.00 H new ATOM 72 N THR A 5 -9.020 3.743 -5.744 1.00 0.00 N ATOM 73 CA THR A 5 -9.470 4.072 -7.083 1.00 0.00 C ATOM 74 C THR A 5 -8.548 3.469 -8.130 1.00 0.00 C ATOM 75 O THR A 5 -7.456 2.994 -7.806 1.00 0.00 O ATOM 76 CB THR A 5 -9.547 5.597 -7.273 1.00 0.00 C ATOM 77 OG1 THR A 5 -8.229 6.158 -7.320 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.323 6.222 -6.126 1.00 0.00 C ATOM 0 H THR A 5 -8.292 4.355 -5.375 1.00 0.00 H new ATOM 0 HA THR A 5 -10.467 3.649 -7.210 1.00 0.00 H new ATOM 0 HB THR A 5 -10.057 5.806 -8.213 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.287 7.135 -7.266 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.374 7.302 -6.267 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.332 5.811 -6.103 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.820 6.002 -5.184 1.00 0.00 H new ATOM 86 N LYS A 6 -8.992 3.481 -9.381 1.00 0.00 N ATOM 87 CA LYS A 6 -8.162 3.024 -10.483 1.00 0.00 C ATOM 88 C LYS A 6 -6.913 3.881 -10.594 1.00 0.00 C ATOM 89 O LYS A 6 -5.847 3.388 -10.941 1.00 0.00 O ATOM 90 CB LYS A 6 -8.942 3.049 -11.793 1.00 0.00 C ATOM 91 CG LYS A 6 -9.922 1.896 -11.930 1.00 0.00 C ATOM 92 CD LYS A 6 -10.561 1.857 -13.307 1.00 0.00 C ATOM 93 CE LYS A 6 -11.467 0.647 -13.452 1.00 0.00 C ATOM 94 NZ LYS A 6 -12.108 0.585 -14.789 1.00 0.00 N ATOM 0 H LYS A 6 -9.921 3.802 -9.655 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.863 1.995 -10.283 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.487 3.990 -11.866 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.240 3.021 -12.627 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -9.404 0.955 -11.743 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.699 1.988 -11.171 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -11.136 2.768 -13.471 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -9.785 1.828 -14.072 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -10.887 -0.261 -13.286 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -12.238 0.678 -12.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -12.717 -0.256 -14.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -12.683 1.439 -14.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -11.374 0.529 -15.524 1.00 0.00 H new ATOM 108 N LYS A 7 -7.060 5.166 -10.291 1.00 0.00 N ATOM 109 CA LYS A 7 -5.941 6.085 -10.225 1.00 0.00 C ATOM 110 C LYS A 7 -4.910 5.609 -9.210 1.00 0.00 C ATOM 111 O LYS A 7 -3.721 5.541 -9.511 1.00 0.00 O ATOM 112 CB LYS A 7 -6.460 7.470 -9.846 1.00 0.00 C ATOM 113 CG LYS A 7 -5.371 8.448 -9.473 1.00 0.00 C ATOM 114 CD LYS A 7 -5.912 9.860 -9.326 1.00 0.00 C ATOM 115 CE LYS A 7 -4.945 10.764 -8.579 1.00 0.00 C ATOM 116 NZ LYS A 7 -3.544 10.631 -9.065 1.00 0.00 N ATOM 0 H LYS A 7 -7.962 5.596 -10.085 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.454 6.129 -11.199 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.029 7.876 -10.682 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -7.150 7.372 -9.008 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.907 8.137 -8.537 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -4.592 8.434 -10.235 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -6.110 10.277 -10.313 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -6.864 9.830 -8.796 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -5.266 11.800 -8.686 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -4.981 10.528 -7.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -3.060 11.548 -8.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -3.043 9.924 -8.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -3.549 10.328 -10.060 1.00 0.00 H new ATOM 130 N GLN A 8 -5.373 5.269 -8.014 1.00 0.00 N ATOM 131 CA GLN A 8 -4.486 4.761 -6.971 1.00 0.00 C ATOM 132 C GLN A 8 -3.841 3.453 -7.415 1.00 0.00 C ATOM 133 O GLN A 8 -2.650 3.231 -7.198 1.00 0.00 O ATOM 134 CB GLN A 8 -5.248 4.540 -5.662 1.00 0.00 C ATOM 135 CG GLN A 8 -6.068 5.739 -5.213 1.00 0.00 C ATOM 136 CD GLN A 8 -5.269 7.026 -5.175 1.00 0.00 C ATOM 137 OE1 GLN A 8 -5.232 7.777 -6.146 1.00 0.00 O ATOM 138 NE2 GLN A 8 -4.624 7.286 -4.055 1.00 0.00 N ATOM 0 H GLN A 8 -6.354 5.335 -7.741 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.709 5.506 -6.800 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.911 3.683 -5.780 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.535 4.286 -4.877 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.916 5.865 -5.887 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.475 5.542 -4.221 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.681 6.636 -3.271 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.068 8.137 -3.972 1.00 0.00 H new ATOM 147 N MET A 9 -4.635 2.594 -8.044 1.00 0.00 N ATOM 148 CA MET A 9 -4.122 1.349 -8.599 1.00 0.00 C ATOM 149 C MET A 9 -3.034 1.644 -9.623 1.00 0.00 C ATOM 150 O MET A 9 -1.957 1.059 -9.585 1.00 0.00 O ATOM 151 CB MET A 9 -5.255 0.554 -9.254 1.00 0.00 C ATOM 152 CG MET A 9 -4.817 -0.792 -9.805 1.00 0.00 C ATOM 153 SD MET A 9 -4.241 -1.912 -8.520 1.00 0.00 S ATOM 154 CE MET A 9 -5.743 -2.129 -7.567 1.00 0.00 C ATOM 0 H MET A 9 -5.635 2.737 -8.182 1.00 0.00 H new ATOM 0 HA MET A 9 -3.697 0.754 -7.791 1.00 0.00 H new ATOM 0 HB2 MET A 9 -6.047 0.397 -8.522 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.682 1.146 -10.063 1.00 0.00 H new ATOM 0 HG2 MET A 9 -5.651 -1.252 -10.336 1.00 0.00 H new ATOM 0 HG3 MET A 9 -4.020 -0.640 -10.533 1.00 0.00 H new ATOM 0 HE1 MET A 9 -5.518 -2.030 -6.505 1.00 0.00 H new ATOM 0 HE2 MET A 9 -6.470 -1.370 -7.856 1.00 0.00 H new ATOM 0 HE3 MET A 9 -6.156 -3.119 -7.760 1.00 0.00 H new ATOM 164 N GLU A 10 -3.325 2.580 -10.517 1.00 0.00 N ATOM 165 CA GLU A 10 -2.395 3.010 -11.541 1.00 0.00 C ATOM 166 C GLU A 10 -1.131 3.607 -10.930 1.00 0.00 C ATOM 167 O GLU A 10 -0.029 3.361 -11.413 1.00 0.00 O ATOM 168 CB GLU A 10 -3.094 4.034 -12.429 1.00 0.00 C ATOM 169 CG GLU A 10 -3.988 3.416 -13.495 1.00 0.00 C ATOM 170 CD GLU A 10 -3.202 2.777 -14.620 1.00 0.00 C ATOM 171 OE1 GLU A 10 -2.661 1.668 -14.426 1.00 0.00 O ATOM 172 OE2 GLU A 10 -3.130 3.380 -15.713 1.00 0.00 O ATOM 0 H GLU A 10 -4.223 3.064 -10.548 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.089 2.147 -12.133 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.694 4.694 -11.803 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.341 4.654 -12.915 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.630 2.665 -13.034 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.642 4.186 -13.906 1.00 0.00 H new ATOM 179 N GLU A 11 -1.297 4.386 -9.868 1.00 0.00 N ATOM 180 CA GLU A 11 -0.176 4.983 -9.163 1.00 0.00 C ATOM 181 C GLU A 11 0.719 3.912 -8.541 1.00 0.00 C ATOM 182 O GLU A 11 1.948 3.998 -8.612 1.00 0.00 O ATOM 183 CB GLU A 11 -0.693 5.949 -8.096 1.00 0.00 C ATOM 184 CG GLU A 11 -0.863 7.369 -8.604 1.00 0.00 C ATOM 185 CD GLU A 11 -1.225 8.347 -7.505 1.00 0.00 C ATOM 186 OE1 GLU A 11 -0.371 8.617 -6.636 1.00 0.00 O ATOM 187 OE2 GLU A 11 -2.358 8.869 -7.516 1.00 0.00 O ATOM 0 H GLU A 11 -2.209 4.619 -9.475 1.00 0.00 H new ATOM 0 HA GLU A 11 0.430 5.538 -9.879 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.651 5.587 -7.722 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.002 5.952 -7.253 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.062 7.692 -9.081 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.639 7.386 -9.369 1.00 0.00 H new ATOM 194 N MET A 12 0.104 2.896 -7.952 1.00 0.00 N ATOM 195 CA MET A 12 0.851 1.783 -7.376 1.00 0.00 C ATOM 196 C MET A 12 1.500 0.953 -8.481 1.00 0.00 C ATOM 197 O MET A 12 2.678 0.599 -8.398 1.00 0.00 O ATOM 198 CB MET A 12 -0.062 0.906 -6.513 1.00 0.00 C ATOM 199 CG MET A 12 -0.598 1.614 -5.275 1.00 0.00 C ATOM 200 SD MET A 12 -1.616 0.543 -4.240 1.00 0.00 S ATOM 201 CE MET A 12 -2.903 0.078 -5.394 1.00 0.00 C ATOM 0 H MET A 12 -0.909 2.818 -7.860 1.00 0.00 H new ATOM 0 HA MET A 12 1.636 2.189 -6.738 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.902 0.565 -7.118 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.489 0.018 -6.203 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.239 1.990 -4.687 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.186 2.479 -5.583 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.659 -0.513 -4.877 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.364 0.976 -5.806 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.471 -0.512 -6.202 1.00 0.00 H new ATOM 211 N LEU A 13 0.728 0.671 -9.526 1.00 0.00 N ATOM 212 CA LEU A 13 1.216 -0.090 -10.670 1.00 0.00 C ATOM 213 C LEU A 13 2.386 0.619 -11.345 1.00 0.00 C ATOM 214 O LEU A 13 3.364 -0.019 -11.735 1.00 0.00 O ATOM 215 CB LEU A 13 0.085 -0.308 -11.680 1.00 0.00 C ATOM 216 CG LEU A 13 -0.971 -1.333 -11.262 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.033 -1.474 -12.343 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.324 -2.680 -10.963 1.00 0.00 C ATOM 0 H LEU A 13 -0.247 0.961 -9.603 1.00 0.00 H new ATOM 0 HA LEU A 13 1.566 -1.056 -10.307 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.409 0.647 -11.860 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.521 -0.625 -12.627 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.453 -0.978 -10.351 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.776 -2.207 -12.029 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.518 -0.511 -12.504 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.566 -1.805 -13.271 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.092 -3.395 -10.668 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.187 -3.044 -11.854 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.396 -2.566 -10.153 1.00 0.00 H new ATOM 230 N ALA A 14 2.281 1.937 -11.470 1.00 0.00 N ATOM 231 CA ALA A 14 3.333 2.735 -12.079 1.00 0.00 C ATOM 232 C ALA A 14 4.623 2.621 -11.281 1.00 0.00 C ATOM 233 O ALA A 14 5.695 2.439 -11.852 1.00 0.00 O ATOM 234 CB ALA A 14 2.908 4.192 -12.191 1.00 0.00 C ATOM 0 H ALA A 14 1.474 2.475 -11.156 1.00 0.00 H new ATOM 0 HA ALA A 14 3.512 2.350 -13.083 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.710 4.771 -12.649 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.011 4.263 -12.807 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.698 4.587 -11.197 1.00 0.00 H new ATOM 240 N HIS A 15 4.510 2.716 -9.959 1.00 0.00 N ATOM 241 CA HIS A 15 5.671 2.597 -9.079 1.00 0.00 C ATOM 242 C HIS A 15 6.292 1.209 -9.195 1.00 0.00 C ATOM 243 O HIS A 15 7.514 1.063 -9.212 1.00 0.00 O ATOM 244 CB HIS A 15 5.273 2.868 -7.624 1.00 0.00 C ATOM 245 CG HIS A 15 6.421 2.811 -6.657 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.534 3.618 -6.752 1.00 0.00 N ATOM 247 CD2 HIS A 15 6.618 2.034 -5.567 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.364 3.339 -5.764 1.00 0.00 C ATOM 249 NE2 HIS A 15 7.832 2.382 -5.025 1.00 0.00 N ATOM 0 H HIS A 15 3.627 2.875 -9.473 1.00 0.00 H new ATOM 0 HA HIS A 15 6.407 3.339 -9.388 1.00 0.00 H new ATOM 0 HB2 HIS A 15 4.808 3.852 -7.562 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.520 2.140 -7.322 1.00 0.00 H new ATOM 0 HD2 HIS A 15 5.944 1.278 -5.191 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.318 3.814 -5.589 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.252 1.970 -4.192 1.00 0.00 H new ATOM 258 N ALA A 16 5.438 0.199 -9.255 1.00 0.00 N ATOM 259 CA ALA A 16 5.882 -1.183 -9.392 1.00 0.00 C ATOM 260 C ALA A 16 6.697 -1.373 -10.668 1.00 0.00 C ATOM 261 O ALA A 16 7.822 -1.861 -10.629 1.00 0.00 O ATOM 262 CB ALA A 16 4.682 -2.123 -9.378 1.00 0.00 C ATOM 0 H ALA A 16 4.425 0.310 -9.211 1.00 0.00 H new ATOM 0 HA ALA A 16 6.526 -1.422 -8.546 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.025 -3.152 -9.481 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.144 -2.012 -8.437 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.018 -1.877 -10.207 1.00 0.00 H new ATOM 268 N ARG A 17 6.130 -0.947 -11.789 1.00 0.00 N ATOM 269 CA ARG A 17 6.778 -1.096 -13.088 1.00 0.00 C ATOM 270 C ARG A 17 8.032 -0.227 -13.169 1.00 0.00 C ATOM 271 O ARG A 17 9.012 -0.587 -13.826 1.00 0.00 O ATOM 272 CB ARG A 17 5.799 -0.738 -14.213 1.00 0.00 C ATOM 273 CG ARG A 17 4.544 -1.600 -14.208 1.00 0.00 C ATOM 274 CD ARG A 17 3.590 -1.224 -15.333 1.00 0.00 C ATOM 275 NE ARG A 17 2.289 -1.882 -15.181 1.00 0.00 N ATOM 276 CZ ARG A 17 1.586 -2.406 -16.188 1.00 0.00 C ATOM 277 NH1 ARG A 17 2.054 -2.357 -17.430 1.00 0.00 N ATOM 278 NH2 ARG A 17 0.409 -2.976 -15.947 1.00 0.00 N ATOM 0 H ARG A 17 5.217 -0.493 -11.826 1.00 0.00 H new ATOM 0 HA ARG A 17 7.079 -2.137 -13.207 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.514 0.310 -14.119 1.00 0.00 H new ATOM 0 HB3 ARG A 17 6.303 -0.846 -15.173 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.824 -2.649 -14.305 1.00 0.00 H new ATOM 0 HG3 ARG A 17 4.035 -1.494 -13.250 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.452 -0.143 -15.347 1.00 0.00 H new ATOM 0 HD3 ARG A 17 4.029 -1.502 -16.291 1.00 0.00 H new ATOM 0 HE ARG A 17 1.894 -1.944 -14.243 1.00 0.00 H new ATOM 0 HH11 ARG A 17 2.955 -1.917 -17.619 1.00 0.00 H new ATOM 0 HH12 ARG A 17 1.513 -2.759 -18.195 1.00 0.00 H new ATOM 0 HH21 ARG A 17 0.045 -3.012 -14.995 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -0.130 -3.377 -16.714 1.00 0.00 H new ATOM 292 N GLN A 18 7.991 0.912 -12.492 1.00 0.00 N ATOM 293 CA GLN A 18 9.115 1.840 -12.442 1.00 0.00 C ATOM 294 C GLN A 18 10.321 1.219 -11.744 1.00 0.00 C ATOM 295 O GLN A 18 11.463 1.387 -12.182 1.00 0.00 O ATOM 296 CB GLN A 18 8.691 3.107 -11.697 1.00 0.00 C ATOM 297 CG GLN A 18 9.797 4.130 -11.525 1.00 0.00 C ATOM 298 CD GLN A 18 9.343 5.339 -10.734 1.00 0.00 C ATOM 299 OE1 GLN A 18 9.435 5.365 -9.506 1.00 0.00 O ATOM 300 NE2 GLN A 18 8.852 6.348 -11.431 1.00 0.00 N ATOM 0 H GLN A 18 7.177 1.220 -11.961 1.00 0.00 H new ATOM 0 HA GLN A 18 9.404 2.082 -13.465 1.00 0.00 H new ATOM 0 HB2 GLN A 18 7.864 3.571 -12.234 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.315 2.827 -10.713 1.00 0.00 H new ATOM 0 HG2 GLN A 18 10.644 3.665 -11.020 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.148 4.451 -12.506 1.00 0.00 H new ATOM 0 HE21 GLN A 18 8.794 6.285 -12.447 1.00 0.00 H new ATOM 0 HE22 GLN A 18 8.531 7.190 -10.953 1.00 0.00 H new ATOM 309 N ALA A 19 10.055 0.505 -10.661 1.00 0.00 N ATOM 310 CA ALA A 19 11.117 -0.027 -9.812 1.00 0.00 C ATOM 311 C ALA A 19 11.428 -1.491 -10.113 1.00 0.00 C ATOM 312 O ALA A 19 12.110 -2.153 -9.330 1.00 0.00 O ATOM 313 CB ALA A 19 10.745 0.141 -8.345 1.00 0.00 C ATOM 0 H ALA A 19 9.112 0.279 -10.346 1.00 0.00 H new ATOM 0 HA ALA A 19 12.020 0.543 -10.029 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.543 -0.259 -7.719 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.606 1.199 -8.124 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.819 -0.397 -8.140 1.00 0.00 H new ATOM 319 N LEU A 20 10.946 -1.998 -11.242 1.00 0.00 N ATOM 320 CA LEU A 20 11.233 -3.370 -11.638 1.00 0.00 C ATOM 321 C LEU A 20 12.734 -3.562 -11.846 1.00 0.00 C ATOM 322 O LEU A 20 13.437 -2.632 -12.245 1.00 0.00 O ATOM 323 CB LEU A 20 10.469 -3.738 -12.915 1.00 0.00 C ATOM 324 CG LEU A 20 8.963 -3.937 -12.742 1.00 0.00 C ATOM 325 CD1 LEU A 20 8.320 -4.306 -14.069 1.00 0.00 C ATOM 326 CD2 LEU A 20 8.690 -5.008 -11.692 1.00 0.00 C ATOM 0 H LEU A 20 10.358 -1.482 -11.896 1.00 0.00 H new ATOM 0 HA LEU A 20 10.903 -4.032 -10.837 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.632 -2.954 -13.655 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.895 -4.655 -13.322 1.00 0.00 H new ATOM 0 HG LEU A 20 8.523 -3.000 -12.400 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.248 -4.444 -13.928 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.491 -3.507 -14.791 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.759 -5.232 -14.441 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.614 -5.140 -11.578 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.140 -5.949 -12.007 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.121 -4.701 -10.739 1.00 0.00 H new ATOM 338 N PRO A 21 13.254 -4.773 -11.592 1.00 0.00 N ATOM 339 CA PRO A 21 12.458 -5.933 -11.196 1.00 0.00 C ATOM 340 C PRO A 21 12.344 -6.108 -9.680 1.00 0.00 C ATOM 341 O PRO A 21 12.291 -7.232 -9.183 1.00 0.00 O ATOM 342 CB PRO A 21 13.260 -7.077 -11.807 1.00 0.00 C ATOM 343 CG PRO A 21 14.685 -6.634 -11.711 1.00 0.00 C ATOM 344 CD PRO A 21 14.679 -5.121 -11.690 1.00 0.00 C ATOM 0 HA PRO A 21 11.422 -5.859 -11.528 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.097 -8.009 -11.265 1.00 0.00 H new ATOM 0 HB3 PRO A 21 12.970 -7.256 -12.842 1.00 0.00 H new ATOM 0 HG2 PRO A 21 15.152 -7.030 -10.809 1.00 0.00 H new ATOM 0 HG3 PRO A 21 15.262 -7.005 -12.558 1.00 0.00 H new ATOM 0 HD2 PRO A 21 15.244 -4.731 -10.843 1.00 0.00 H new ATOM 0 HD3 PRO A 21 15.130 -4.707 -12.592 1.00 0.00 H new ATOM 352 N ASN A 22 12.304 -5.000 -8.949 1.00 0.00 N ATOM 353 CA ASN A 22 12.113 -5.058 -7.501 1.00 0.00 C ATOM 354 C ASN A 22 10.630 -5.195 -7.186 1.00 0.00 C ATOM 355 O ASN A 22 9.811 -5.348 -8.094 1.00 0.00 O ATOM 356 CB ASN A 22 12.683 -3.809 -6.812 1.00 0.00 C ATOM 357 CG ASN A 22 14.203 -3.787 -6.756 1.00 0.00 C ATOM 358 OD1 ASN A 22 14.786 -3.227 -5.831 1.00 0.00 O ATOM 359 ND2 ASN A 22 14.856 -4.388 -7.739 1.00 0.00 N ATOM 0 H ASN A 22 12.400 -4.058 -9.329 1.00 0.00 H new ATOM 0 HA ASN A 22 12.651 -5.926 -7.120 1.00 0.00 H new ATOM 0 HB2 ASN A 22 12.334 -2.921 -7.340 1.00 0.00 H new ATOM 0 HB3 ASN A 22 12.289 -3.752 -5.797 1.00 0.00 H new ATOM 0 HD21 ASN A 22 15.876 -4.396 -7.744 1.00 0.00 H new ATOM 0 HD22 ASN A 22 14.339 -4.843 -8.491 1.00 0.00 H new ATOM 366 N GLU A 23 10.281 -5.144 -5.908 1.00 0.00 N ATOM 367 CA GLU A 23 8.893 -5.293 -5.500 1.00 0.00 C ATOM 368 C GLU A 23 8.177 -3.950 -5.446 1.00 0.00 C ATOM 369 O GLU A 23 6.948 -3.886 -5.510 1.00 0.00 O ATOM 370 CB GLU A 23 8.794 -6.025 -4.155 1.00 0.00 C ATOM 371 CG GLU A 23 9.887 -5.670 -3.155 1.00 0.00 C ATOM 372 CD GLU A 23 9.903 -4.204 -2.780 1.00 0.00 C ATOM 373 OE1 GLU A 23 9.086 -3.796 -1.932 1.00 0.00 O ATOM 374 OE2 GLU A 23 10.741 -3.456 -3.337 1.00 0.00 O ATOM 0 H GLU A 23 10.937 -5.001 -5.140 1.00 0.00 H new ATOM 0 HA GLU A 23 8.392 -5.899 -6.254 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.825 -5.804 -3.707 1.00 0.00 H new ATOM 0 HB3 GLU A 23 8.823 -7.099 -4.338 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.752 -6.267 -2.253 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.856 -5.941 -3.575 1.00 0.00 H new ATOM 381 N ALA A 24 8.968 -2.891 -5.334 1.00 0.00 N ATOM 382 CA ALA A 24 8.467 -1.522 -5.291 1.00 0.00 C ATOM 383 C ALA A 24 7.560 -1.288 -4.085 1.00 0.00 C ATOM 384 O ALA A 24 6.372 -1.611 -4.110 1.00 0.00 O ATOM 385 CB ALA A 24 7.745 -1.171 -6.583 1.00 0.00 C ATOM 0 H ALA A 24 9.984 -2.958 -5.270 1.00 0.00 H new ATOM 0 HA ALA A 24 9.329 -0.863 -5.185 1.00 0.00 H new ATOM 0 HB1 ALA A 24 7.380 -0.145 -6.529 1.00 0.00 H new ATOM 0 HB2 ALA A 24 8.434 -1.267 -7.422 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.903 -1.849 -6.725 1.00 0.00 H new ATOM 391 N CYS A 25 8.111 -0.681 -3.047 1.00 0.00 N ATOM 392 CA CYS A 25 7.367 -0.465 -1.818 1.00 0.00 C ATOM 393 C CYS A 25 7.140 1.027 -1.592 1.00 0.00 C ATOM 394 O CYS A 25 7.741 1.873 -2.263 1.00 0.00 O ATOM 395 CB CYS A 25 8.129 -1.077 -0.634 1.00 0.00 C ATOM 396 SG CYS A 25 7.253 -1.020 0.953 1.00 0.00 S ATOM 0 H CYS A 25 9.069 -0.330 -3.031 1.00 0.00 H new ATOM 0 HA CYS A 25 6.395 -0.952 -1.901 1.00 0.00 H new ATOM 0 HB2 CYS A 25 8.359 -2.116 -0.868 1.00 0.00 H new ATOM 0 HB3 CYS A 25 9.081 -0.556 -0.526 1.00 0.00 H new ATOM 0 HG CYS A 25 7.829 -0.156 1.736 1.00 0.00 H new ATOM 402 N GLY A 26 6.252 1.337 -0.667 1.00 0.00 N ATOM 403 CA GLY A 26 5.930 2.709 -0.348 1.00 0.00 C ATOM 404 C GLY A 26 4.983 2.776 0.823 1.00 0.00 C ATOM 405 O GLY A 26 4.897 1.826 1.594 1.00 0.00 O ATOM 0 H GLY A 26 5.738 0.647 -0.120 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.843 3.257 -0.116 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.479 3.193 -1.215 1.00 0.00 H new ATOM 409 N LEU A 27 4.269 3.877 0.957 1.00 0.00 N ATOM 410 CA LEU A 27 3.276 4.016 2.009 1.00 0.00 C ATOM 411 C LEU A 27 1.922 4.366 1.416 1.00 0.00 C ATOM 412 O LEU A 27 1.835 4.933 0.326 1.00 0.00 O ATOM 413 CB LEU A 27 3.698 5.088 3.015 1.00 0.00 C ATOM 414 CG LEU A 27 4.925 4.744 3.862 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.303 5.920 4.751 1.00 0.00 C ATOM 416 CD2 LEU A 27 4.663 3.504 4.703 1.00 0.00 C ATOM 0 H LEU A 27 4.357 4.691 0.349 1.00 0.00 H new ATOM 0 HA LEU A 27 3.199 3.062 2.530 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.899 6.012 2.473 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.860 5.286 3.683 1.00 0.00 H new ATOM 0 HG LEU A 27 5.759 4.535 3.192 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.178 5.659 5.347 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.532 6.786 4.130 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.470 6.158 5.413 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.547 3.275 5.299 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.816 3.686 5.365 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.438 2.662 4.049 1.00 0.00 H new ATOM 428 N LEU A 28 0.870 4.021 2.131 1.00 0.00 N ATOM 429 CA LEU A 28 -0.479 4.329 1.695 1.00 0.00 C ATOM 430 C LEU A 28 -1.129 5.315 2.643 1.00 0.00 C ATOM 431 O LEU A 28 -0.983 5.203 3.862 1.00 0.00 O ATOM 432 CB LEU A 28 -1.318 3.057 1.608 1.00 0.00 C ATOM 433 CG LEU A 28 -0.977 2.136 0.437 1.00 0.00 C ATOM 434 CD1 LEU A 28 -1.832 0.888 0.483 1.00 0.00 C ATOM 435 CD2 LEU A 28 -1.172 2.857 -0.889 1.00 0.00 C ATOM 0 H LEU A 28 0.923 3.525 3.021 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.423 4.779 0.704 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.200 2.498 2.536 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.369 3.337 1.536 1.00 0.00 H new ATOM 0 HG LEU A 28 0.071 1.848 0.522 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.578 0.242 -0.357 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.650 0.357 1.417 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.884 1.165 0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.924 2.184 -1.709 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.211 3.174 -0.981 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.521 3.731 -0.927 1.00 0.00 H new ATOM 447 N GLY A 29 -1.843 6.274 2.085 1.00 0.00 N ATOM 448 CA GLY A 29 -2.498 7.273 2.893 1.00 0.00 C ATOM 449 C GLY A 29 -3.938 7.478 2.488 1.00 0.00 C ATOM 450 O GLY A 29 -4.335 7.143 1.367 1.00 0.00 O ATOM 0 H GLY A 29 -1.981 6.379 1.080 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.456 6.976 3.941 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.960 8.217 2.808 1.00 0.00 H new ATOM 454 N GLY A 30 -4.721 8.011 3.400 1.00 0.00 N ATOM 455 CA GLY A 30 -6.111 8.274 3.120 1.00 0.00 C ATOM 456 C GLY A 30 -6.902 8.490 4.384 1.00 0.00 C ATOM 457 O GLY A 30 -6.377 9.004 5.373 1.00 0.00 O ATOM 0 H GLY A 30 -4.418 8.269 4.339 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.194 9.155 2.484 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.535 7.438 2.564 1.00 0.00 H new ATOM 461 N ARG A 31 -8.155 8.082 4.362 1.00 0.00 N ATOM 462 CA ARG A 31 -9.034 8.279 5.496 1.00 0.00 C ATOM 463 C ARG A 31 -9.408 6.950 6.127 1.00 0.00 C ATOM 464 O ARG A 31 -9.786 6.006 5.433 1.00 0.00 O ATOM 465 CB ARG A 31 -10.293 9.021 5.061 1.00 0.00 C ATOM 466 CG ARG A 31 -10.055 10.488 4.747 1.00 0.00 C ATOM 467 CD ARG A 31 -11.262 11.095 4.060 1.00 0.00 C ATOM 468 NE ARG A 31 -11.253 12.555 4.097 1.00 0.00 N ATOM 469 CZ ARG A 31 -11.648 13.319 3.080 1.00 0.00 C ATOM 470 NH1 ARG A 31 -11.822 12.788 1.876 1.00 0.00 N ATOM 471 NH2 ARG A 31 -11.806 14.628 3.252 1.00 0.00 N ATOM 0 H ARG A 31 -8.588 7.610 3.568 1.00 0.00 H new ATOM 0 HA ARG A 31 -8.505 8.876 6.239 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -10.707 8.532 4.179 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -11.041 8.943 5.850 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.844 11.032 5.668 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -9.178 10.590 4.108 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -11.291 10.762 3.023 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -12.170 10.729 4.538 1.00 0.00 H new ATOM 0 HE ARG A 31 -10.927 13.014 4.947 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -11.653 11.793 1.728 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -12.125 13.375 1.099 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -11.625 15.048 4.164 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -12.109 15.212 2.472 1.00 0.00 H new ATOM 485 N ARG A 32 -9.279 6.872 7.439 1.00 0.00 N ATOM 486 CA ARG A 32 -9.702 5.689 8.165 1.00 0.00 C ATOM 487 C ARG A 32 -10.818 6.062 9.128 1.00 0.00 C ATOM 488 O ARG A 32 -10.641 6.918 9.998 1.00 0.00 O ATOM 489 CB ARG A 32 -8.518 5.058 8.905 1.00 0.00 C ATOM 490 CG ARG A 32 -8.819 3.693 9.511 1.00 0.00 C ATOM 491 CD ARG A 32 -7.553 3.002 9.994 1.00 0.00 C ATOM 492 NE ARG A 32 -7.794 1.603 10.349 1.00 0.00 N ATOM 493 CZ ARG A 32 -6.832 0.739 10.671 1.00 0.00 C ATOM 494 NH1 ARG A 32 -5.555 1.113 10.663 1.00 0.00 N ATOM 495 NH2 ARG A 32 -7.145 -0.509 11.001 1.00 0.00 N ATOM 0 H ARG A 32 -8.886 7.611 8.022 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.080 4.947 7.461 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -7.682 4.960 8.213 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -8.198 5.733 9.698 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -9.511 3.809 10.345 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -9.315 3.067 8.770 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -6.792 3.053 9.215 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -7.158 3.533 10.860 1.00 0.00 H new ATOM 0 HE ARG A 32 -8.758 1.269 10.350 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -5.305 2.069 10.409 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -4.826 0.444 10.911 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -8.121 -0.805 11.008 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -6.409 -1.171 11.248 1.00 0.00 H new ATOM 509 N ASP A 33 -11.958 5.418 8.969 1.00 0.00 N ATOM 510 CA ASP A 33 -13.140 5.746 9.760 1.00 0.00 C ATOM 511 C ASP A 33 -13.744 4.477 10.329 1.00 0.00 C ATOM 512 O ASP A 33 -13.913 3.487 9.613 1.00 0.00 O ATOM 513 CB ASP A 33 -14.170 6.501 8.919 1.00 0.00 C ATOM 514 CG ASP A 33 -15.333 7.003 9.749 1.00 0.00 C ATOM 515 OD1 ASP A 33 -15.199 8.071 10.385 1.00 0.00 O ATOM 516 OD2 ASP A 33 -16.388 6.342 9.769 1.00 0.00 O ATOM 0 H ASP A 33 -12.096 4.662 8.299 1.00 0.00 H new ATOM 0 HA ASP A 33 -12.840 6.397 10.581 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -13.686 7.345 8.428 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -14.544 5.846 8.132 1.00 0.00 H new ATOM 521 N GLY A 34 -14.079 4.508 11.608 1.00 0.00 N ATOM 522 CA GLY A 34 -14.382 3.282 12.307 1.00 0.00 C ATOM 523 C GLY A 34 -13.112 2.484 12.478 1.00 0.00 C ATOM 524 O GLY A 34 -12.284 2.801 13.334 1.00 0.00 O ATOM 0 H GLY A 34 -14.146 5.356 12.171 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -14.821 3.503 13.280 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -15.118 2.703 11.749 1.00 0.00 H new ATOM 528 N ASP A 35 -12.941 1.464 11.658 1.00 0.00 N ATOM 529 CA ASP A 35 -11.641 0.826 11.521 1.00 0.00 C ATOM 530 C ASP A 35 -11.301 0.661 10.041 1.00 0.00 C ATOM 531 O ASP A 35 -10.185 0.278 9.689 1.00 0.00 O ATOM 532 CB ASP A 35 -11.599 -0.530 12.236 1.00 0.00 C ATOM 533 CG ASP A 35 -10.183 -0.941 12.609 1.00 0.00 C ATOM 534 OD1 ASP A 35 -9.724 -0.566 13.712 1.00 0.00 O ATOM 535 OD2 ASP A 35 -9.522 -1.637 11.815 1.00 0.00 O ATOM 0 H ASP A 35 -13.678 1.060 11.080 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.896 1.466 11.994 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.211 -0.482 13.137 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.039 -1.292 11.592 1.00 0.00 H new ATOM 540 N ASP A 36 -12.262 0.993 9.172 1.00 0.00 N ATOM 541 CA ASP A 36 -12.067 0.861 7.730 1.00 0.00 C ATOM 542 C ASP A 36 -11.166 1.961 7.217 1.00 0.00 C ATOM 543 O ASP A 36 -11.192 3.089 7.703 1.00 0.00 O ATOM 544 CB ASP A 36 -13.382 0.914 6.954 1.00 0.00 C ATOM 545 CG ASP A 36 -14.393 -0.118 7.405 1.00 0.00 C ATOM 546 OD1 ASP A 36 -14.327 -1.268 6.925 1.00 0.00 O ATOM 547 OD2 ASP A 36 -15.263 0.219 8.236 1.00 0.00 O ATOM 0 H ASP A 36 -13.177 1.353 9.443 1.00 0.00 H new ATOM 0 HA ASP A 36 -11.611 -0.116 7.570 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -13.817 1.908 7.060 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.175 0.769 5.894 1.00 0.00 H new ATOM 552 N ARG A 37 -10.391 1.621 6.220 1.00 0.00 N ATOM 553 CA ARG A 37 -9.367 2.505 5.689 1.00 0.00 C ATOM 554 C ARG A 37 -9.461 2.606 4.168 1.00 0.00 C ATOM 555 O ARG A 37 -9.362 1.601 3.459 1.00 0.00 O ATOM 556 CB ARG A 37 -7.979 2.030 6.146 1.00 0.00 C ATOM 557 CG ARG A 37 -7.879 0.525 6.384 1.00 0.00 C ATOM 558 CD ARG A 37 -7.604 -0.244 5.103 1.00 0.00 C ATOM 559 NE ARG A 37 -6.207 -0.126 4.693 1.00 0.00 N ATOM 560 CZ ARG A 37 -5.794 0.549 3.623 1.00 0.00 C ATOM 561 NH1 ARG A 37 -6.665 1.228 2.885 1.00 0.00 N ATOM 562 NH2 ARG A 37 -4.503 0.565 3.307 1.00 0.00 N ATOM 0 H ARG A 37 -10.447 0.720 5.746 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.529 3.509 6.082 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -7.244 2.317 5.395 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -7.714 2.550 7.066 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -7.084 0.325 7.103 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -8.808 0.167 6.828 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -7.853 -1.295 5.249 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -8.250 0.130 4.308 1.00 0.00 H new ATOM 0 HE ARG A 37 -5.502 -0.591 5.264 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -7.653 1.233 3.138 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -6.346 1.744 2.065 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -3.830 0.060 3.884 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -4.185 1.082 2.487 1.00 0.00 H new ATOM 576 N TRP A 38 -9.645 3.818 3.669 1.00 0.00 N ATOM 577 CA TRP A 38 -9.795 4.037 2.237 1.00 0.00 C ATOM 578 C TRP A 38 -8.621 4.840 1.691 1.00 0.00 C ATOM 579 O TRP A 38 -8.254 5.874 2.249 1.00 0.00 O ATOM 580 CB TRP A 38 -11.117 4.753 1.955 1.00 0.00 C ATOM 581 CG TRP A 38 -12.297 4.026 2.520 1.00 0.00 C ATOM 582 CD1 TRP A 38 -12.863 2.886 2.035 1.00 0.00 C ATOM 583 CD2 TRP A 38 -13.046 4.379 3.686 1.00 0.00 C ATOM 584 NE1 TRP A 38 -13.923 2.512 2.821 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.056 3.413 3.842 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.964 5.422 4.611 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -14.975 3.456 4.887 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -13.876 5.464 5.649 1.00 0.00 C ATOM 589 CH2 TRP A 38 -14.869 4.486 5.780 1.00 0.00 C ATOM 0 H TRP A 38 -9.694 4.666 4.234 1.00 0.00 H new ATOM 0 HA TRP A 38 -9.806 3.071 1.733 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -11.079 5.758 2.375 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -11.244 4.863 0.878 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -12.526 2.353 1.158 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -14.515 1.696 2.669 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -12.202 6.182 4.517 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -15.743 2.704 4.989 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.821 6.265 6.371 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -15.566 4.546 6.603 1.00 0.00 H new ATOM 600 N VAL A 39 -8.040 4.359 0.595 1.00 0.00 N ATOM 601 CA VAL A 39 -6.825 4.954 0.046 1.00 0.00 C ATOM 602 C VAL A 39 -7.156 6.115 -0.879 1.00 0.00 C ATOM 603 O VAL A 39 -7.724 5.916 -1.952 1.00 0.00 O ATOM 604 CB VAL A 39 -5.994 3.923 -0.748 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.697 4.544 -1.242 1.00 0.00 C ATOM 606 CG2 VAL A 39 -5.704 2.695 0.097 1.00 0.00 C ATOM 0 H VAL A 39 -8.391 3.558 0.069 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.242 5.309 0.896 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.580 3.613 -1.613 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.127 3.801 -1.799 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.923 5.390 -1.892 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.110 4.888 -0.390 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.118 1.984 -0.484 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.143 2.988 0.984 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.643 2.231 0.398 1.00 0.00 H new ATOM 616 N GLU A 40 -6.794 7.322 -0.465 1.00 0.00 N ATOM 617 CA GLU A 40 -7.008 8.499 -1.293 1.00 0.00 C ATOM 618 C GLU A 40 -5.674 9.158 -1.640 1.00 0.00 C ATOM 619 O GLU A 40 -5.636 10.195 -2.303 1.00 0.00 O ATOM 620 CB GLU A 40 -7.953 9.491 -0.601 1.00 0.00 C ATOM 621 CG GLU A 40 -9.313 8.887 -0.272 1.00 0.00 C ATOM 622 CD GLU A 40 -10.390 9.924 -0.015 1.00 0.00 C ATOM 623 OE1 GLU A 40 -10.452 10.460 1.114 1.00 0.00 O ATOM 624 OE2 GLU A 40 -11.194 10.186 -0.938 1.00 0.00 O ATOM 0 H GLU A 40 -6.353 7.510 0.435 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.482 8.184 -2.222 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.488 9.847 0.318 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -8.093 10.360 -1.244 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.626 8.246 -1.096 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -9.216 8.250 0.607 1.00 0.00 H new ATOM 631 N ARG A 41 -4.576 8.545 -1.195 1.00 0.00 N ATOM 632 CA ARG A 41 -3.240 8.991 -1.579 1.00 0.00 C ATOM 633 C ARG A 41 -2.243 7.831 -1.577 1.00 0.00 C ATOM 634 O ARG A 41 -2.239 6.999 -0.670 1.00 0.00 O ATOM 635 CB ARG A 41 -2.737 10.106 -0.652 1.00 0.00 C ATOM 636 CG ARG A 41 -1.349 10.625 -1.022 1.00 0.00 C ATOM 637 CD ARG A 41 -1.380 11.643 -2.167 1.00 0.00 C ATOM 638 NE ARG A 41 -2.277 11.256 -3.259 1.00 0.00 N ATOM 639 CZ ARG A 41 -1.915 10.559 -4.337 1.00 0.00 C ATOM 640 NH1 ARG A 41 -0.671 10.125 -4.478 1.00 0.00 N ATOM 641 NH2 ARG A 41 -2.820 10.282 -5.267 1.00 0.00 N ATOM 0 H ARG A 41 -4.588 7.740 -0.569 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.315 9.385 -2.593 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.445 10.935 -0.676 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.716 9.734 0.372 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.893 11.085 -0.145 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -0.716 9.784 -1.307 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -1.692 12.611 -1.775 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.371 11.768 -2.561 1.00 0.00 H new ATOM 0 HE ARG A 41 -3.254 11.542 -3.189 1.00 0.00 H new ATOM 0 HH11 ARG A 41 0.023 10.323 -3.757 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -0.407 9.593 -5.307 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -3.782 10.601 -5.154 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -2.554 9.750 -6.095 1.00 0.00 H new ATOM 655 N VAL A 42 -1.413 7.776 -2.611 1.00 0.00 N ATOM 656 CA VAL A 42 -0.335 6.799 -2.693 1.00 0.00 C ATOM 657 C VAL A 42 1.008 7.511 -2.534 1.00 0.00 C ATOM 658 O VAL A 42 1.208 8.590 -3.092 1.00 0.00 O ATOM 659 CB VAL A 42 -0.361 6.042 -4.042 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.763 5.026 -4.122 1.00 0.00 C ATOM 661 CG2 VAL A 42 -1.703 5.361 -4.251 1.00 0.00 C ATOM 0 H VAL A 42 -1.468 8.404 -3.413 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.472 6.072 -1.893 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.215 6.774 -4.836 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.719 4.510 -5.081 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.722 5.536 -4.028 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.657 4.301 -3.315 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -1.699 4.835 -5.206 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -1.879 4.649 -3.445 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.495 6.110 -4.253 1.00 0.00 H new ATOM 671 N TYR A 43 1.914 6.929 -1.761 1.00 0.00 N ATOM 672 CA TYR A 43 3.212 7.547 -1.521 1.00 0.00 C ATOM 673 C TYR A 43 4.353 6.560 -1.738 1.00 0.00 C ATOM 674 O TYR A 43 4.717 5.817 -0.833 1.00 0.00 O ATOM 675 CB TYR A 43 3.295 8.157 -0.121 1.00 0.00 C ATOM 676 CG TYR A 43 3.576 9.642 -0.158 1.00 0.00 C ATOM 677 CD1 TYR A 43 2.547 10.558 -0.329 1.00 0.00 C ATOM 678 CD2 TYR A 43 4.874 10.125 -0.053 1.00 0.00 C ATOM 679 CE1 TYR A 43 2.803 11.913 -0.395 1.00 0.00 C ATOM 680 CE2 TYR A 43 5.138 11.480 -0.111 1.00 0.00 C ATOM 681 CZ TYR A 43 4.096 12.369 -0.286 1.00 0.00 C ATOM 682 OH TYR A 43 4.351 13.717 -0.359 1.00 0.00 O ATOM 0 H TYR A 43 1.776 6.034 -1.291 1.00 0.00 H new ATOM 0 HA TYR A 43 3.317 8.352 -2.249 1.00 0.00 H new ATOM 0 HB2 TYR A 43 2.358 7.980 0.406 1.00 0.00 H new ATOM 0 HB3 TYR A 43 4.079 7.655 0.446 1.00 0.00 H new ATOM 0 HD1 TYR A 43 1.530 10.205 -0.412 1.00 0.00 H new ATOM 0 HD2 TYR A 43 5.690 9.430 0.076 1.00 0.00 H new ATOM 0 HE1 TYR A 43 1.991 12.612 -0.532 1.00 0.00 H new ATOM 0 HE2 TYR A 43 6.152 11.841 -0.020 1.00 0.00 H new ATOM 0 HH TYR A 43 3.519 14.215 -0.217 1.00 0.00 H new ATOM 692 N PRO A 44 4.877 6.483 -2.968 1.00 0.00 N ATOM 693 CA PRO A 44 6.017 5.616 -3.301 1.00 0.00 C ATOM 694 C PRO A 44 7.296 5.995 -2.540 1.00 0.00 C ATOM 695 O PRO A 44 7.762 7.130 -2.620 1.00 0.00 O ATOM 696 CB PRO A 44 6.214 5.847 -4.805 1.00 0.00 C ATOM 697 CG PRO A 44 4.933 6.438 -5.285 1.00 0.00 C ATOM 698 CD PRO A 44 4.403 7.240 -4.138 1.00 0.00 C ATOM 0 HA PRO A 44 5.822 4.579 -3.030 1.00 0.00 H new ATOM 0 HB2 PRO A 44 7.052 6.519 -4.993 1.00 0.00 H new ATOM 0 HB3 PRO A 44 6.433 4.912 -5.321 1.00 0.00 H new ATOM 0 HG2 PRO A 44 5.095 7.067 -6.160 1.00 0.00 H new ATOM 0 HG3 PRO A 44 4.228 5.660 -5.578 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.789 8.259 -4.144 1.00 0.00 H new ATOM 0 HD3 PRO A 44 3.316 7.311 -4.161 1.00 0.00 H new ATOM 706 N LEU A 45 7.855 5.039 -1.800 1.00 0.00 N ATOM 707 CA LEU A 45 9.111 5.251 -1.081 1.00 0.00 C ATOM 708 C LEU A 45 10.225 4.386 -1.675 1.00 0.00 C ATOM 709 O LEU A 45 10.056 3.790 -2.743 1.00 0.00 O ATOM 710 CB LEU A 45 8.948 4.944 0.414 1.00 0.00 C ATOM 711 CG LEU A 45 8.447 6.101 1.286 1.00 0.00 C ATOM 712 CD1 LEU A 45 9.282 7.353 1.059 1.00 0.00 C ATOM 713 CD2 LEU A 45 6.978 6.392 1.032 1.00 0.00 C ATOM 0 H LEU A 45 7.457 4.107 -1.682 1.00 0.00 H new ATOM 0 HA LEU A 45 9.384 6.301 -1.190 1.00 0.00 H new ATOM 0 HB2 LEU A 45 8.256 4.109 0.520 1.00 0.00 H new ATOM 0 HB3 LEU A 45 9.910 4.612 0.804 1.00 0.00 H new ATOM 0 HG LEU A 45 8.555 5.796 2.327 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.907 8.160 1.689 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.322 7.148 1.313 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.216 7.649 0.012 1.00 0.00 H new ATOM 0 HD21 LEU A 45 6.656 7.218 1.667 1.00 0.00 H new ATOM 0 HD22 LEU A 45 6.836 6.662 -0.014 1.00 0.00 H new ATOM 0 HD23 LEU A 45 6.387 5.506 1.261 1.00 0.00 H new ATOM 725 N ASN A 46 11.358 4.323 -0.983 1.00 0.00 N ATOM 726 CA ASN A 46 12.533 3.603 -1.467 1.00 0.00 C ATOM 727 C ASN A 46 12.753 2.305 -0.680 1.00 0.00 C ATOM 728 O ASN A 46 12.431 2.223 0.504 1.00 0.00 O ATOM 729 CB ASN A 46 13.762 4.517 -1.361 1.00 0.00 C ATOM 730 CG ASN A 46 15.065 3.829 -1.720 1.00 0.00 C ATOM 731 OD1 ASN A 46 15.442 3.760 -2.892 1.00 0.00 O ATOM 732 ND2 ASN A 46 15.775 3.340 -0.715 1.00 0.00 N ATOM 0 H ASN A 46 11.489 4.767 -0.074 1.00 0.00 H new ATOM 0 HA ASN A 46 12.374 3.327 -2.509 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.622 5.377 -2.017 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.832 4.901 -0.343 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.670 2.886 -0.896 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.427 3.418 0.241 1.00 0.00 H new ATOM 739 N ASN A 47 13.292 1.287 -1.352 1.00 0.00 N ATOM 740 CA ASN A 47 13.582 0.005 -0.708 1.00 0.00 C ATOM 741 C ASN A 47 15.083 -0.124 -0.451 1.00 0.00 C ATOM 742 O ASN A 47 15.887 -0.106 -1.383 1.00 0.00 O ATOM 743 CB ASN A 47 13.103 -1.167 -1.578 1.00 0.00 C ATOM 744 CG ASN A 47 13.198 -2.517 -0.872 1.00 0.00 C ATOM 745 OD1 ASN A 47 14.004 -2.717 0.032 1.00 0.00 O ATOM 746 ND2 ASN A 47 12.385 -3.462 -1.294 1.00 0.00 N ATOM 0 H ASN A 47 13.537 1.325 -2.342 1.00 0.00 H new ATOM 0 HA ASN A 47 13.047 -0.027 0.241 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.069 -0.992 -1.875 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.696 -1.199 -2.492 1.00 0.00 H new ATOM 0 HD21 ASN A 47 12.415 -4.388 -0.868 1.00 0.00 H new ATOM 0 HD22 ASN A 47 11.725 -3.268 -2.047 1.00 0.00 H new ATOM 753 N LEU A 48 15.449 -0.256 0.816 1.00 0.00 N ATOM 754 CA LEU A 48 16.843 -0.367 1.218 1.00 0.00 C ATOM 755 C LEU A 48 17.413 -1.749 0.907 1.00 0.00 C ATOM 756 O LEU A 48 18.606 -1.887 0.640 1.00 0.00 O ATOM 757 CB LEU A 48 16.981 -0.066 2.714 1.00 0.00 C ATOM 758 CG LEU A 48 16.920 1.415 3.108 1.00 0.00 C ATOM 759 CD1 LEU A 48 18.110 2.168 2.533 1.00 0.00 C ATOM 760 CD2 LEU A 48 15.617 2.067 2.662 1.00 0.00 C ATOM 0 H LEU A 48 14.789 -0.289 1.593 1.00 0.00 H new ATOM 0 HA LEU A 48 17.414 0.363 0.645 1.00 0.00 H new ATOM 0 HB2 LEU A 48 16.191 -0.596 3.246 1.00 0.00 H new ATOM 0 HB3 LEU A 48 17.930 -0.476 3.061 1.00 0.00 H new ATOM 0 HG LEU A 48 16.959 1.465 4.196 1.00 0.00 H new ATOM 0 HD11 LEU A 48 18.051 3.217 2.822 1.00 0.00 H new ATOM 0 HD12 LEU A 48 19.034 1.737 2.918 1.00 0.00 H new ATOM 0 HD13 LEU A 48 18.099 2.090 1.446 1.00 0.00 H new ATOM 0 HD21 LEU A 48 15.614 3.115 2.960 1.00 0.00 H new ATOM 0 HD22 LEU A 48 15.528 1.998 1.578 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.776 1.555 3.128 1.00 0.00 H new ATOM 772 N ASP A 49 16.562 -2.773 0.933 1.00 0.00 N ATOM 773 CA ASP A 49 17.009 -4.138 0.661 1.00 0.00 C ATOM 774 C ASP A 49 17.266 -4.291 -0.831 1.00 0.00 C ATOM 775 O ASP A 49 18.224 -4.941 -1.248 1.00 0.00 O ATOM 776 CB ASP A 49 15.962 -5.168 1.106 1.00 0.00 C ATOM 777 CG ASP A 49 16.556 -6.536 1.396 1.00 0.00 C ATOM 778 OD1 ASP A 49 17.174 -7.131 0.494 1.00 0.00 O ATOM 779 OD2 ASP A 49 16.378 -7.037 2.531 1.00 0.00 O ATOM 0 H ASP A 49 15.567 -2.685 1.138 1.00 0.00 H new ATOM 0 HA ASP A 49 17.924 -4.319 1.225 1.00 0.00 H new ATOM 0 HB2 ASP A 49 15.457 -4.801 2.000 1.00 0.00 H new ATOM 0 HB3 ASP A 49 15.204 -5.265 0.329 1.00 0.00 H new ATOM 784 N GLN A 50 16.389 -3.667 -1.622 1.00 0.00 N ATOM 785 CA GLN A 50 16.499 -3.664 -3.082 1.00 0.00 C ATOM 786 C GLN A 50 16.370 -5.090 -3.623 1.00 0.00 C ATOM 787 O GLN A 50 17.021 -5.478 -4.596 1.00 0.00 O ATOM 788 CB GLN A 50 17.826 -3.020 -3.504 1.00 0.00 C ATOM 789 CG GLN A 50 17.899 -2.653 -4.977 1.00 0.00 C ATOM 790 CD GLN A 50 19.165 -1.898 -5.321 1.00 0.00 C ATOM 791 OE1 GLN A 50 19.704 -1.158 -4.496 1.00 0.00 O ATOM 792 NE2 GLN A 50 19.648 -2.078 -6.539 1.00 0.00 N ATOM 0 H GLN A 50 15.584 -3.150 -1.268 1.00 0.00 H new ATOM 0 HA GLN A 50 15.687 -3.073 -3.506 1.00 0.00 H new ATOM 0 HB2 GLN A 50 17.986 -2.121 -2.909 1.00 0.00 H new ATOM 0 HB3 GLN A 50 18.640 -3.706 -3.271 1.00 0.00 H new ATOM 0 HG2 GLN A 50 17.846 -3.561 -5.578 1.00 0.00 H new ATOM 0 HG3 GLN A 50 17.034 -2.045 -5.241 1.00 0.00 H new ATOM 0 HE21 GLN A 50 19.170 -2.700 -7.191 1.00 0.00 H new ATOM 0 HE22 GLN A 50 20.499 -1.595 -6.827 1.00 0.00 H new ATOM 801 N SER A 51 15.503 -5.857 -2.987 1.00 0.00 N ATOM 802 CA SER A 51 15.293 -7.246 -3.347 1.00 0.00 C ATOM 803 C SER A 51 13.849 -7.475 -3.781 1.00 0.00 C ATOM 804 O SER A 51 12.936 -6.866 -3.237 1.00 0.00 O ATOM 805 CB SER A 51 15.631 -8.136 -2.154 1.00 0.00 C ATOM 806 OG SER A 51 17.019 -8.110 -1.871 1.00 0.00 O ATOM 0 H SER A 51 14.927 -5.535 -2.209 1.00 0.00 H new ATOM 0 HA SER A 51 15.945 -7.498 -4.184 1.00 0.00 H new ATOM 0 HB2 SER A 51 15.073 -7.803 -1.279 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.319 -9.160 -2.361 1.00 0.00 H new ATOM 0 HG SER A 51 17.199 -7.439 -1.180 1.00 0.00 H new ATOM 812 N PRO A 52 13.624 -8.364 -4.762 1.00 0.00 N ATOM 813 CA PRO A 52 12.278 -8.670 -5.269 1.00 0.00 C ATOM 814 C PRO A 52 11.443 -9.474 -4.270 1.00 0.00 C ATOM 815 O PRO A 52 10.221 -9.576 -4.399 1.00 0.00 O ATOM 816 CB PRO A 52 12.542 -9.512 -6.530 1.00 0.00 C ATOM 817 CG PRO A 52 14.007 -9.396 -6.803 1.00 0.00 C ATOM 818 CD PRO A 52 14.656 -9.127 -5.479 1.00 0.00 C ATOM 0 HA PRO A 52 11.708 -7.760 -5.457 1.00 0.00 H new ATOM 0 HB2 PRO A 52 12.256 -10.552 -6.372 1.00 0.00 H new ATOM 0 HB3 PRO A 52 11.958 -9.145 -7.374 1.00 0.00 H new ATOM 0 HG2 PRO A 52 14.394 -10.313 -7.248 1.00 0.00 H new ATOM 0 HG3 PRO A 52 14.210 -8.589 -7.507 1.00 0.00 H new ATOM 0 HD2 PRO A 52 14.912 -10.050 -4.959 1.00 0.00 H new ATOM 0 HD3 PRO A 52 15.578 -8.557 -5.589 1.00 0.00 H new ATOM 826 N GLU A 53 12.113 -10.053 -3.279 1.00 0.00 N ATOM 827 CA GLU A 53 11.443 -10.868 -2.274 1.00 0.00 C ATOM 828 C GLU A 53 11.387 -10.154 -0.929 1.00 0.00 C ATOM 829 O GLU A 53 10.762 -10.642 0.011 1.00 0.00 O ATOM 830 CB GLU A 53 12.160 -12.210 -2.105 1.00 0.00 C ATOM 831 CG GLU A 53 12.158 -13.067 -3.359 1.00 0.00 C ATOM 832 CD GLU A 53 12.864 -14.394 -3.158 1.00 0.00 C ATOM 833 OE1 GLU A 53 12.423 -15.184 -2.299 1.00 0.00 O ATOM 834 OE2 GLU A 53 13.875 -14.647 -3.851 1.00 0.00 O ATOM 0 H GLU A 53 13.122 -9.972 -3.151 1.00 0.00 H new ATOM 0 HA GLU A 53 10.424 -11.041 -2.621 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.191 -12.025 -1.804 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.686 -12.765 -1.296 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.129 -13.250 -3.668 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.642 -12.521 -4.169 1.00 0.00 H new ATOM 841 N HIS A 54 12.037 -9.002 -0.836 1.00 0.00 N ATOM 842 CA HIS A 54 12.121 -8.284 0.431 1.00 0.00 C ATOM 843 C HIS A 54 11.649 -6.853 0.278 1.00 0.00 C ATOM 844 O HIS A 54 11.974 -6.185 -0.698 1.00 0.00 O ATOM 845 CB HIS A 54 13.554 -8.236 0.959 1.00 0.00 C ATOM 846 CG HIS A 54 14.118 -9.535 1.457 1.00 0.00 C ATOM 847 ND1 HIS A 54 15.350 -9.616 2.063 1.00 0.00 N ATOM 848 CD2 HIS A 54 13.615 -10.792 1.466 1.00 0.00 C ATOM 849 CE1 HIS A 54 15.579 -10.863 2.422 1.00 0.00 C ATOM 850 NE2 HIS A 54 14.544 -11.601 2.076 1.00 0.00 N ATOM 0 H HIS A 54 12.511 -8.546 -1.616 1.00 0.00 H new ATOM 0 HA HIS A 54 11.484 -8.826 1.130 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.200 -7.864 0.164 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.596 -7.510 1.771 1.00 0.00 H new ATOM 0 HD1 HIS A 54 15.987 -8.833 2.211 1.00 0.00 H new ATOM 0 HD2 HIS A 54 12.660 -11.102 1.068 1.00 0.00 H new ATOM 0 HE1 HIS A 54 16.469 -11.221 2.918 1.00 0.00 H new ATOM 0 HE2 HIS A 54 14.448 -12.604 2.234 1.00 0.00 H new ATOM 859 N PHE A 55 10.932 -6.377 1.270 1.00 0.00 N ATOM 860 CA PHE A 55 10.517 -4.990 1.304 1.00 0.00 C ATOM 861 C PHE A 55 10.968 -4.360 2.613 1.00 0.00 C ATOM 862 O PHE A 55 10.548 -4.767 3.697 1.00 0.00 O ATOM 863 CB PHE A 55 8.996 -4.848 1.106 1.00 0.00 C ATOM 864 CG PHE A 55 8.144 -5.513 2.160 1.00 0.00 C ATOM 865 CD1 PHE A 55 7.991 -6.890 2.191 1.00 0.00 C ATOM 866 CD2 PHE A 55 7.482 -4.750 3.111 1.00 0.00 C ATOM 867 CE1 PHE A 55 7.199 -7.493 3.151 1.00 0.00 C ATOM 868 CE2 PHE A 55 6.691 -5.349 4.074 1.00 0.00 C ATOM 869 CZ PHE A 55 6.549 -6.722 4.092 1.00 0.00 C ATOM 0 H PHE A 55 10.622 -6.931 2.068 1.00 0.00 H new ATOM 0 HA PHE A 55 10.990 -4.462 0.476 1.00 0.00 H new ATOM 0 HB2 PHE A 55 8.747 -3.787 1.077 1.00 0.00 H new ATOM 0 HB3 PHE A 55 8.732 -5.264 0.133 1.00 0.00 H new ATOM 0 HD1 PHE A 55 8.496 -7.500 1.457 1.00 0.00 H new ATOM 0 HD2 PHE A 55 7.586 -3.675 3.099 1.00 0.00 H new ATOM 0 HE1 PHE A 55 7.089 -8.567 3.164 1.00 0.00 H new ATOM 0 HE2 PHE A 55 6.185 -4.743 4.811 1.00 0.00 H new ATOM 0 HZ PHE A 55 5.930 -7.192 4.842 1.00 0.00 H new ATOM 879 N SER A 56 11.876 -3.411 2.513 1.00 0.00 N ATOM 880 CA SER A 56 12.402 -2.735 3.681 1.00 0.00 C ATOM 881 C SER A 56 12.678 -1.279 3.350 1.00 0.00 C ATOM 882 O SER A 56 13.304 -0.965 2.339 1.00 0.00 O ATOM 883 CB SER A 56 13.672 -3.431 4.167 1.00 0.00 C ATOM 884 OG SER A 56 13.432 -4.812 4.392 1.00 0.00 O ATOM 0 H SER A 56 12.267 -3.089 1.628 1.00 0.00 H new ATOM 0 HA SER A 56 11.664 -2.776 4.482 1.00 0.00 H new ATOM 0 HB2 SER A 56 14.464 -3.310 3.428 1.00 0.00 H new ATOM 0 HB3 SER A 56 14.020 -2.962 5.088 1.00 0.00 H new ATOM 0 HG SER A 56 14.257 -5.241 4.701 1.00 0.00 H new ATOM 890 N MET A 57 12.209 -0.398 4.205 1.00 0.00 N ATOM 891 CA MET A 57 12.273 1.028 3.952 1.00 0.00 C ATOM 892 C MET A 57 12.874 1.748 5.149 1.00 0.00 C ATOM 893 O MET A 57 12.928 1.195 6.250 1.00 0.00 O ATOM 894 CB MET A 57 10.873 1.555 3.626 1.00 0.00 C ATOM 895 CG MET A 57 9.829 1.217 4.681 1.00 0.00 C ATOM 896 SD MET A 57 8.141 1.246 4.037 1.00 0.00 S ATOM 897 CE MET A 57 8.068 2.887 3.328 1.00 0.00 C ATOM 0 H MET A 57 11.773 -0.646 5.093 1.00 0.00 H new ATOM 0 HA MET A 57 12.918 1.218 3.094 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.921 2.638 3.509 1.00 0.00 H new ATOM 0 HB3 MET A 57 10.554 1.144 2.668 1.00 0.00 H new ATOM 0 HG2 MET A 57 10.040 0.228 5.089 1.00 0.00 H new ATOM 0 HG3 MET A 57 9.910 1.926 5.505 1.00 0.00 H new ATOM 0 HE1 MET A 57 7.463 3.532 3.965 1.00 0.00 H new ATOM 0 HE2 MET A 57 9.076 3.295 3.251 1.00 0.00 H new ATOM 0 HE3 MET A 57 7.621 2.835 2.335 1.00 0.00 H new ATOM 907 N ASP A 58 13.338 2.966 4.929 1.00 0.00 N ATOM 908 CA ASP A 58 14.022 3.720 5.969 1.00 0.00 C ATOM 909 C ASP A 58 13.034 4.482 6.855 1.00 0.00 C ATOM 910 O ASP A 58 12.036 5.015 6.374 1.00 0.00 O ATOM 911 CB ASP A 58 15.018 4.686 5.327 1.00 0.00 C ATOM 912 CG ASP A 58 15.480 5.758 6.275 1.00 0.00 C ATOM 913 OD1 ASP A 58 16.473 5.541 7.004 1.00 0.00 O ATOM 914 OD2 ASP A 58 14.838 6.822 6.299 1.00 0.00 O ATOM 0 H ASP A 58 13.254 3.456 4.038 1.00 0.00 H new ATOM 0 HA ASP A 58 14.556 3.017 6.608 1.00 0.00 H new ATOM 0 HB2 ASP A 58 15.882 4.126 4.969 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.557 5.151 4.456 1.00 0.00 H new ATOM 919 N PRO A 59 13.317 4.550 8.170 1.00 0.00 N ATOM 920 CA PRO A 59 12.457 5.239 9.139 1.00 0.00 C ATOM 921 C PRO A 59 12.260 6.729 8.845 1.00 0.00 C ATOM 922 O PRO A 59 11.136 7.231 8.903 1.00 0.00 O ATOM 923 CB PRO A 59 13.195 5.062 10.469 1.00 0.00 C ATOM 924 CG PRO A 59 14.078 3.880 10.267 1.00 0.00 C ATOM 925 CD PRO A 59 14.478 3.918 8.822 1.00 0.00 C ATOM 0 HA PRO A 59 11.450 4.823 9.122 1.00 0.00 H new ATOM 0 HB2 PRO A 59 13.776 5.950 10.719 1.00 0.00 H new ATOM 0 HB3 PRO A 59 12.496 4.897 11.289 1.00 0.00 H new ATOM 0 HG2 PRO A 59 14.952 3.928 10.917 1.00 0.00 H new ATOM 0 HG3 PRO A 59 13.554 2.954 10.505 1.00 0.00 H new ATOM 0 HD2 PRO A 59 15.389 4.497 8.671 1.00 0.00 H new ATOM 0 HD3 PRO A 59 14.666 2.919 8.429 1.00 0.00 H new ATOM 933 N ARG A 60 13.336 7.445 8.520 1.00 0.00 N ATOM 934 CA ARG A 60 13.235 8.892 8.356 1.00 0.00 C ATOM 935 C ARG A 60 12.563 9.268 7.033 1.00 0.00 C ATOM 936 O ARG A 60 11.919 10.318 6.943 1.00 0.00 O ATOM 937 CB ARG A 60 14.594 9.610 8.563 1.00 0.00 C ATOM 938 CG ARG A 60 15.767 9.126 7.713 1.00 0.00 C ATOM 939 CD ARG A 60 15.708 9.650 6.285 1.00 0.00 C ATOM 940 NE ARG A 60 16.949 9.390 5.543 1.00 0.00 N ATOM 941 CZ ARG A 60 17.019 8.659 4.426 1.00 0.00 C ATOM 942 NH1 ARG A 60 15.958 7.988 4.000 1.00 0.00 N ATOM 943 NH2 ARG A 60 18.169 8.565 3.765 1.00 0.00 N ATOM 0 H ARG A 60 14.267 7.057 8.368 1.00 0.00 H new ATOM 0 HA ARG A 60 12.584 9.255 9.151 1.00 0.00 H new ATOM 0 HB2 ARG A 60 14.449 10.673 8.368 1.00 0.00 H new ATOM 0 HB3 ARG A 60 14.873 9.513 9.612 1.00 0.00 H new ATOM 0 HG2 ARG A 60 16.702 9.444 8.175 1.00 0.00 H new ATOM 0 HG3 ARG A 60 15.774 8.036 7.697 1.00 0.00 H new ATOM 0 HD2 ARG A 60 14.872 9.184 5.764 1.00 0.00 H new ATOM 0 HD3 ARG A 60 15.516 10.723 6.302 1.00 0.00 H new ATOM 0 HE ARG A 60 17.814 9.794 5.904 1.00 0.00 H new ATOM 0 HH11 ARG A 60 15.084 8.028 4.525 1.00 0.00 H new ATOM 0 HH12 ARG A 60 16.015 7.431 3.147 1.00 0.00 H new ATOM 0 HH21 ARG A 60 18.997 9.050 4.110 1.00 0.00 H new ATOM 0 HH22 ARG A 60 18.223 8.007 2.913 1.00 0.00 H new ATOM 957 N GLU A 61 12.684 8.424 6.007 1.00 0.00 N ATOM 958 CA GLU A 61 11.947 8.677 4.771 1.00 0.00 C ATOM 959 C GLU A 61 10.460 8.396 4.990 1.00 0.00 C ATOM 960 O GLU A 61 9.602 9.091 4.439 1.00 0.00 O ATOM 961 CB GLU A 61 12.504 7.881 3.577 1.00 0.00 C ATOM 962 CG GLU A 61 12.269 6.381 3.629 1.00 0.00 C ATOM 963 CD GLU A 61 12.739 5.682 2.364 1.00 0.00 C ATOM 964 OE1 GLU A 61 13.928 5.296 2.302 1.00 0.00 O ATOM 965 OE2 GLU A 61 11.929 5.528 1.427 1.00 0.00 O ATOM 0 H GLU A 61 13.266 7.586 6.005 1.00 0.00 H new ATOM 0 HA GLU A 61 12.075 9.729 4.514 1.00 0.00 H new ATOM 0 HB2 GLU A 61 12.057 8.270 2.662 1.00 0.00 H new ATOM 0 HB3 GLU A 61 13.577 8.062 3.510 1.00 0.00 H new ATOM 0 HG2 GLU A 61 12.792 5.963 4.489 1.00 0.00 H new ATOM 0 HG3 GLU A 61 11.207 6.186 3.776 1.00 0.00 H new ATOM 972 N GLN A 62 10.161 7.397 5.823 1.00 0.00 N ATOM 973 CA GLN A 62 8.783 7.109 6.216 1.00 0.00 C ATOM 974 C GLN A 62 8.189 8.298 6.961 1.00 0.00 C ATOM 975 O GLN A 62 7.081 8.741 6.661 1.00 0.00 O ATOM 976 CB GLN A 62 8.711 5.873 7.120 1.00 0.00 C ATOM 977 CG GLN A 62 9.071 4.565 6.439 1.00 0.00 C ATOM 978 CD GLN A 62 8.964 3.378 7.381 1.00 0.00 C ATOM 979 OE1 GLN A 62 9.922 3.014 8.062 1.00 0.00 O ATOM 980 NE2 GLN A 62 7.792 2.765 7.425 1.00 0.00 N ATOM 0 H GLN A 62 10.855 6.775 6.237 1.00 0.00 H new ATOM 0 HA GLN A 62 8.214 6.917 5.306 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.380 6.021 7.968 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.701 5.792 7.521 1.00 0.00 H new ATOM 0 HG2 GLN A 62 8.412 4.409 5.585 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.087 4.628 6.050 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.021 3.096 6.845 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.660 1.961 8.039 1.00 0.00 H new ATOM 989 N LEU A 63 8.944 8.807 7.930 1.00 0.00 N ATOM 990 CA LEU A 63 8.507 9.932 8.749 1.00 0.00 C ATOM 991 C LEU A 63 8.168 11.144 7.884 1.00 0.00 C ATOM 992 O LEU A 63 7.138 11.792 8.079 1.00 0.00 O ATOM 993 CB LEU A 63 9.596 10.302 9.761 1.00 0.00 C ATOM 994 CG LEU A 63 9.260 11.474 10.684 1.00 0.00 C ATOM 995 CD1 LEU A 63 8.060 11.146 11.560 1.00 0.00 C ATOM 996 CD2 LEU A 63 10.462 11.829 11.541 1.00 0.00 C ATOM 0 H LEU A 63 9.871 8.453 8.168 1.00 0.00 H new ATOM 0 HA LEU A 63 7.606 9.630 9.283 1.00 0.00 H new ATOM 0 HB2 LEU A 63 9.810 9.427 10.375 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.509 10.541 9.216 1.00 0.00 H new ATOM 0 HG LEU A 63 9.004 12.335 10.067 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.840 11.994 12.208 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.196 10.937 10.930 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.284 10.271 12.171 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.210 12.665 12.194 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.744 10.968 12.147 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.297 12.110 10.899 1.00 0.00 H new ATOM 1008 N THR A 64 9.029 11.435 6.921 1.00 0.00 N ATOM 1009 CA THR A 64 8.822 12.560 6.024 1.00 0.00 C ATOM 1010 C THR A 64 7.547 12.378 5.193 1.00 0.00 C ATOM 1011 O THR A 64 6.820 13.341 4.930 1.00 0.00 O ATOM 1012 CB THR A 64 10.041 12.739 5.103 1.00 0.00 C ATOM 1013 OG1 THR A 64 11.229 12.857 5.902 1.00 0.00 O ATOM 1014 CG2 THR A 64 9.895 13.974 4.225 1.00 0.00 C ATOM 0 H THR A 64 9.881 10.905 6.741 1.00 0.00 H new ATOM 0 HA THR A 64 8.703 13.458 6.630 1.00 0.00 H new ATOM 0 HB THR A 64 10.110 11.866 4.454 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.486 11.973 6.238 1.00 0.00 H new ATOM 0 HG21 THR A 64 10.773 14.072 3.586 1.00 0.00 H new ATOM 0 HG22 THR A 64 9.004 13.876 3.605 1.00 0.00 H new ATOM 0 HG23 THR A 64 9.804 14.859 4.854 1.00 0.00 H new ATOM 1022 N ALA A 65 7.268 11.136 4.811 1.00 0.00 N ATOM 1023 CA ALA A 65 6.074 10.821 4.036 1.00 0.00 C ATOM 1024 C ALA A 65 4.812 10.976 4.880 1.00 0.00 C ATOM 1025 O ALA A 65 3.826 11.562 4.434 1.00 0.00 O ATOM 1026 CB ALA A 65 6.166 9.412 3.470 1.00 0.00 C ATOM 0 H ALA A 65 7.854 10.330 5.026 1.00 0.00 H new ATOM 0 HA ALA A 65 6.013 11.528 3.208 1.00 0.00 H new ATOM 0 HB1 ALA A 65 5.267 9.192 2.894 1.00 0.00 H new ATOM 0 HB2 ALA A 65 7.040 9.336 2.822 1.00 0.00 H new ATOM 0 HB3 ALA A 65 6.257 8.697 4.287 1.00 0.00 H new ATOM 1032 N VAL A 66 4.855 10.457 6.102 1.00 0.00 N ATOM 1033 CA VAL A 66 3.720 10.555 7.018 1.00 0.00 C ATOM 1034 C VAL A 66 3.441 12.014 7.375 1.00 0.00 C ATOM 1035 O VAL A 66 2.285 12.431 7.496 1.00 0.00 O ATOM 1036 CB VAL A 66 3.961 9.733 8.307 1.00 0.00 C ATOM 1037 CG1 VAL A 66 2.782 9.856 9.260 1.00 0.00 C ATOM 1038 CG2 VAL A 66 4.221 8.272 7.968 1.00 0.00 C ATOM 0 H VAL A 66 5.662 9.964 6.483 1.00 0.00 H new ATOM 0 HA VAL A 66 2.850 10.141 6.508 1.00 0.00 H new ATOM 0 HB VAL A 66 4.843 10.137 8.805 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.977 9.269 10.158 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.643 10.902 9.534 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.880 9.485 8.773 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.388 7.710 8.887 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.359 7.861 7.443 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.103 8.198 7.331 1.00 0.00 H new ATOM 1048 N LYS A 67 4.509 12.789 7.511 1.00 0.00 N ATOM 1049 CA LYS A 67 4.398 14.212 7.801 1.00 0.00 C ATOM 1050 C LYS A 67 3.613 14.920 6.700 1.00 0.00 C ATOM 1051 O LYS A 67 2.797 15.802 6.968 1.00 0.00 O ATOM 1052 CB LYS A 67 5.792 14.834 7.918 1.00 0.00 C ATOM 1053 CG LYS A 67 5.779 16.276 8.402 1.00 0.00 C ATOM 1054 CD LYS A 67 7.170 16.890 8.401 1.00 0.00 C ATOM 1055 CE LYS A 67 8.127 16.138 9.314 1.00 0.00 C ATOM 1056 NZ LYS A 67 9.450 16.810 9.394 1.00 0.00 N ATOM 0 H LYS A 67 5.468 12.453 7.424 1.00 0.00 H new ATOM 0 HA LYS A 67 3.869 14.332 8.746 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.391 14.235 8.604 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.282 14.791 6.945 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.122 16.867 7.764 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.366 16.316 9.410 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.565 16.892 7.385 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.107 17.930 8.720 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.695 16.064 10.312 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.257 15.120 8.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.076 16.270 10.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.873 16.859 8.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.328 17.773 9.768 1.00 0.00 H new ATOM 1070 N ASP A 68 3.873 14.524 5.462 1.00 0.00 N ATOM 1071 CA ASP A 68 3.183 15.095 4.310 1.00 0.00 C ATOM 1072 C ASP A 68 1.744 14.602 4.242 1.00 0.00 C ATOM 1073 O ASP A 68 0.837 15.334 3.847 1.00 0.00 O ATOM 1074 CB ASP A 68 3.907 14.732 3.022 1.00 0.00 C ATOM 1075 CG ASP A 68 3.425 15.554 1.845 1.00 0.00 C ATOM 1076 OD1 ASP A 68 3.902 16.698 1.678 1.00 0.00 O ATOM 1077 OD2 ASP A 68 2.580 15.061 1.072 1.00 0.00 O ATOM 0 H ASP A 68 4.559 13.807 5.227 1.00 0.00 H new ATOM 0 HA ASP A 68 3.179 16.179 4.426 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.978 14.883 3.154 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.758 13.673 2.809 1.00 0.00 H new ATOM 1082 N MET A 69 1.551 13.353 4.630 1.00 0.00 N ATOM 1083 CA MET A 69 0.226 12.739 4.623 1.00 0.00 C ATOM 1084 C MET A 69 -0.724 13.513 5.530 1.00 0.00 C ATOM 1085 O MET A 69 -1.830 13.882 5.130 1.00 0.00 O ATOM 1086 CB MET A 69 0.313 11.291 5.106 1.00 0.00 C ATOM 1087 CG MET A 69 -0.816 10.412 4.601 1.00 0.00 C ATOM 1088 SD MET A 69 -0.604 9.967 2.868 1.00 0.00 S ATOM 1089 CE MET A 69 0.919 9.024 2.961 1.00 0.00 C ATOM 0 H MET A 69 2.297 12.738 4.956 1.00 0.00 H new ATOM 0 HA MET A 69 -0.154 12.760 3.602 1.00 0.00 H new ATOM 0 HB2 MET A 69 1.264 10.866 4.785 1.00 0.00 H new ATOM 0 HB3 MET A 69 0.311 11.280 6.196 1.00 0.00 H new ATOM 0 HG2 MET A 69 -0.867 9.506 5.204 1.00 0.00 H new ATOM 0 HG3 MET A 69 -1.765 10.933 4.728 1.00 0.00 H new ATOM 0 HE1 MET A 69 0.902 8.231 2.213 1.00 0.00 H new ATOM 0 HE2 MET A 69 1.767 9.683 2.773 1.00 0.00 H new ATOM 0 HE3 MET A 69 1.015 8.584 3.954 1.00 0.00 H new ATOM 1099 N ARG A 70 -0.263 13.788 6.746 1.00 0.00 N ATOM 1100 CA ARG A 70 -1.062 14.517 7.727 1.00 0.00 C ATOM 1101 C ARG A 70 -1.208 15.979 7.311 1.00 0.00 C ATOM 1102 O ARG A 70 -2.147 16.664 7.712 1.00 0.00 O ATOM 1103 CB ARG A 70 -0.431 14.398 9.131 1.00 0.00 C ATOM 1104 CG ARG A 70 0.889 15.136 9.301 1.00 0.00 C ATOM 1105 CD ARG A 70 0.670 16.581 9.726 1.00 0.00 C ATOM 1106 NE ARG A 70 1.675 17.481 9.159 1.00 0.00 N ATOM 1107 CZ ARG A 70 1.508 18.799 9.054 1.00 0.00 C ATOM 1108 NH1 ARG A 70 0.398 19.363 9.519 1.00 0.00 N ATOM 1109 NH2 ARG A 70 2.451 19.554 8.495 1.00 0.00 N ATOM 0 H ARG A 70 0.663 13.516 7.077 1.00 0.00 H new ATOM 0 HA ARG A 70 -2.058 14.076 7.767 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -1.141 14.777 9.866 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -0.273 13.343 9.355 1.00 0.00 H new ATOM 0 HG2 ARG A 70 1.499 14.625 10.046 1.00 0.00 H new ATOM 0 HG3 ARG A 70 1.444 15.112 8.363 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -0.323 16.904 9.413 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.698 16.647 10.814 1.00 0.00 H new ATOM 0 HE ARG A 70 2.551 17.078 8.826 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -0.323 18.787 9.955 1.00 0.00 H new ATOM 0 HH12 ARG A 70 0.267 20.371 9.440 1.00 0.00 H new ATOM 0 HH21 ARG A 70 3.307 19.124 8.144 1.00 0.00 H new ATOM 0 HH22 ARG A 70 2.318 20.562 8.417 1.00 0.00 H new ATOM 1123 N LYS A 71 -0.262 16.438 6.502 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.229 17.813 6.022 1.00 0.00 C ATOM 1125 C LYS A 71 -1.495 18.150 5.240 1.00 0.00 C ATOM 1126 O LYS A 71 -2.018 19.263 5.327 1.00 0.00 O ATOM 1127 CB LYS A 71 1.000 17.987 5.137 1.00 0.00 C ATOM 1128 CG LYS A 71 1.278 19.407 4.678 1.00 0.00 C ATOM 1129 CD LYS A 71 2.474 19.432 3.739 1.00 0.00 C ATOM 1130 CE LYS A 71 3.692 18.797 4.389 1.00 0.00 C ATOM 1131 NZ LYS A 71 4.772 18.527 3.410 1.00 0.00 N ATOM 0 H LYS A 71 0.508 15.864 6.159 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.177 18.492 6.873 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.872 17.622 5.680 1.00 0.00 H new ATOM 0 HB3 LYS A 71 0.885 17.355 4.256 1.00 0.00 H new ATOM 0 HG2 LYS A 71 0.401 19.811 4.172 1.00 0.00 H new ATOM 0 HG3 LYS A 71 1.471 20.044 5.541 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.230 18.900 2.819 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.701 20.461 3.461 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.069 19.456 5.171 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.400 17.864 4.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 5.692 18.539 3.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.622 17.594 2.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.762 19.259 2.671 1.00 0.00 H new ATOM 1145 N ASN A 72 -1.985 17.185 4.473 1.00 0.00 N ATOM 1146 CA ASN A 72 -3.216 17.379 3.715 1.00 0.00 C ATOM 1147 C ASN A 72 -4.427 16.993 4.558 1.00 0.00 C ATOM 1148 O ASN A 72 -5.543 17.452 4.313 1.00 0.00 O ATOM 1149 CB ASN A 72 -3.184 16.561 2.419 1.00 0.00 C ATOM 1150 CG ASN A 72 -4.403 16.804 1.546 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -5.402 16.097 1.644 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -4.324 17.806 0.684 1.00 0.00 N ATOM 0 H ASN A 72 -1.554 16.267 4.359 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.297 18.434 3.455 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.284 16.811 1.858 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -3.122 15.501 2.664 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -5.112 18.014 0.070 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -3.476 18.370 0.634 1.00 0.00 H new ATOM 1159 N GLY A 73 -4.191 16.187 5.582 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.262 15.800 6.476 1.00 0.00 C ATOM 1161 C GLY A 73 -5.444 14.297 6.561 1.00 0.00 C ATOM 1162 O GLY A 73 -6.173 13.803 7.421 1.00 0.00 O ATOM 0 H GLY A 73 -3.278 15.794 5.810 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -5.058 16.193 7.472 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.193 16.255 6.138 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.777 13.566 5.679 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.901 12.115 5.646 1.00 0.00 C ATOM 1168 C TRP A 74 -4.027 11.459 6.708 1.00 0.00 C ATOM 1169 O TRP A 74 -3.183 12.107 7.332 1.00 0.00 O ATOM 1170 CB TRP A 74 -4.518 11.574 4.267 1.00 0.00 C ATOM 1171 CG TRP A 74 -5.484 11.934 3.178 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.839 11.755 3.189 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -5.166 12.514 1.908 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -7.381 12.188 2.004 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -6.377 12.660 1.202 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -3.977 12.925 1.297 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -6.431 13.199 -0.081 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -4.034 13.461 0.023 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -5.253 13.593 -0.653 1.00 0.00 C ATOM 0 H TRP A 74 -4.145 13.953 4.978 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.943 11.872 5.854 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.531 11.952 4.002 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -4.439 10.488 4.324 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -7.401 11.334 4.010 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -8.371 12.162 1.761 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -3.032 12.826 1.810 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -7.370 13.302 -0.605 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -3.123 13.783 -0.458 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -5.263 14.015 -1.647 1.00 0.00 H new ATOM 1190 N VAL A 75 -4.251 10.174 6.917 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.426 9.375 7.808 1.00 0.00 C ATOM 1192 C VAL A 75 -2.848 8.195 7.038 1.00 0.00 C ATOM 1193 O VAL A 75 -3.306 7.896 5.933 1.00 0.00 O ATOM 1194 CB VAL A 75 -4.221 8.847 9.026 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.700 9.998 9.898 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.400 7.992 8.582 1.00 0.00 C ATOM 0 H VAL A 75 -5.009 9.654 6.475 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.630 10.018 8.184 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.550 8.222 9.615 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.256 9.603 10.748 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.841 10.564 10.258 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.347 10.653 9.314 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.941 7.634 9.458 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.069 8.588 7.961 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.036 7.140 8.008 1.00 0.00 H new ATOM 1206 N MET A 76 -1.844 7.533 7.599 1.00 0.00 N ATOM 1207 CA MET A 76 -1.259 6.381 6.943 1.00 0.00 C ATOM 1208 C MET A 76 -2.155 5.165 7.144 1.00 0.00 C ATOM 1209 O MET A 76 -2.742 4.976 8.212 1.00 0.00 O ATOM 1210 CB MET A 76 0.152 6.106 7.471 1.00 0.00 C ATOM 1211 CG MET A 76 0.189 5.332 8.781 1.00 0.00 C ATOM 1212 SD MET A 76 1.866 5.060 9.393 1.00 0.00 S ATOM 1213 CE MET A 76 2.572 4.122 8.040 1.00 0.00 C ATOM 0 H MET A 76 -1.425 7.774 8.497 1.00 0.00 H new ATOM 0 HA MET A 76 -1.178 6.591 5.876 1.00 0.00 H new ATOM 0 HB2 MET A 76 0.708 5.548 6.717 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.668 7.056 7.609 1.00 0.00 H new ATOM 0 HG2 MET A 76 -0.383 5.875 9.534 1.00 0.00 H new ATOM 0 HG3 MET A 76 -0.302 4.369 8.641 1.00 0.00 H new ATOM 0 HE1 MET A 76 3.204 3.328 8.438 1.00 0.00 H new ATOM 0 HE2 MET A 76 1.771 3.684 7.444 1.00 0.00 H new ATOM 0 HE3 MET A 76 3.171 4.782 7.413 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.275 4.355 6.112 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.140 3.189 6.162 1.00 0.00 C ATOM 1225 C LEU A 77 -2.332 1.916 5.968 1.00 0.00 C ATOM 1226 O LEU A 77 -2.881 0.841 5.721 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.212 3.295 5.082 1.00 0.00 C ATOM 1228 CG LEU A 77 -5.021 4.591 5.090 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -5.998 4.604 3.931 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -5.759 4.761 6.409 1.00 0.00 C ATOM 0 H LEU A 77 -1.785 4.481 5.226 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.617 3.150 7.141 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.734 3.190 4.108 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.899 2.456 5.192 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.331 5.428 4.978 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.569 5.532 3.947 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.449 4.531 2.992 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.679 3.758 4.020 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.328 5.691 6.391 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.439 3.922 6.556 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.039 4.792 7.227 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.022 2.046 6.086 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.144 0.913 5.879 1.00 0.00 C ATOM 1244 C GLY A 78 0.785 1.130 4.706 1.00 0.00 C ATOM 1245 O GLY A 78 1.149 2.270 4.406 1.00 0.00 O ATOM 0 H GLY A 78 -0.548 2.918 6.322 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.443 0.739 6.781 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.741 0.017 5.709 1.00 0.00 H new ATOM 1249 N ASN A 79 1.157 0.050 4.034 1.00 0.00 N ATOM 1250 CA ASN A 79 2.075 0.133 2.906 1.00 0.00 C ATOM 1251 C ASN A 79 1.688 -0.855 1.815 1.00 0.00 C ATOM 1252 O ASN A 79 0.746 -1.634 1.967 1.00 0.00 O ATOM 1253 CB ASN A 79 3.519 -0.123 3.357 1.00 0.00 C ATOM 1254 CG ASN A 79 3.784 -1.559 3.781 1.00 0.00 C ATOM 1255 OD1 ASN A 79 2.900 -2.258 4.274 1.00 0.00 O ATOM 1256 ND2 ASN A 79 5.016 -2.007 3.594 1.00 0.00 N ATOM 0 H ASN A 79 0.838 -0.894 4.250 1.00 0.00 H new ATOM 0 HA ASN A 79 2.009 1.142 2.500 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.195 0.136 2.543 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.753 0.541 4.189 1.00 0.00 H new ATOM 0 HD21 ASN A 79 5.258 -2.961 3.862 1.00 0.00 H new ATOM 0 HD22 ASN A 79 5.723 -1.398 3.182 1.00 0.00 H new ATOM 1263 N PHE A 80 2.427 -0.824 0.719 1.00 0.00 N ATOM 1264 CA PHE A 80 2.136 -1.673 -0.424 1.00 0.00 C ATOM 1265 C PHE A 80 3.429 -2.128 -1.085 1.00 0.00 C ATOM 1266 O PHE A 80 4.433 -1.417 -1.044 1.00 0.00 O ATOM 1267 CB PHE A 80 1.261 -0.924 -1.442 1.00 0.00 C ATOM 1268 CG PHE A 80 1.957 0.230 -2.119 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.070 1.460 -1.489 1.00 0.00 C ATOM 1270 CD2 PHE A 80 2.499 0.082 -3.387 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.711 2.517 -2.109 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.140 1.135 -4.011 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.247 2.353 -3.371 1.00 0.00 C ATOM 0 H PHE A 80 3.237 -0.217 0.596 1.00 0.00 H new ATOM 0 HA PHE A 80 1.591 -2.549 -0.072 1.00 0.00 H new ATOM 0 HB2 PHE A 80 0.924 -1.628 -2.203 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.371 -0.551 -0.935 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.652 1.594 -0.502 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.419 -0.869 -3.893 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.792 3.470 -1.607 1.00 0.00 H new ATOM 0 HE2 PHE A 80 3.557 1.005 -4.999 1.00 0.00 H new ATOM 0 HZ PHE A 80 3.749 3.177 -3.856 1.00 0.00 H new ATOM 1283 N HIS A 81 3.404 -3.322 -1.662 1.00 0.00 N ATOM 1284 CA HIS A 81 4.528 -3.826 -2.448 1.00 0.00 C ATOM 1285 C HIS A 81 4.041 -4.941 -3.369 1.00 0.00 C ATOM 1286 O HIS A 81 3.137 -5.701 -3.010 1.00 0.00 O ATOM 1287 CB HIS A 81 5.676 -4.319 -1.547 1.00 0.00 C ATOM 1288 CG HIS A 81 5.364 -5.542 -0.737 1.00 0.00 C ATOM 1289 ND1 HIS A 81 4.466 -5.551 0.308 1.00 0.00 N ATOM 1290 CD2 HIS A 81 5.847 -6.804 -0.824 1.00 0.00 C ATOM 1291 CE1 HIS A 81 4.412 -6.762 0.829 1.00 0.00 C ATOM 1292 NE2 HIS A 81 5.240 -7.544 0.163 1.00 0.00 N ATOM 0 H HIS A 81 2.614 -3.964 -1.601 1.00 0.00 H new ATOM 0 HA HIS A 81 4.925 -3.008 -3.049 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.545 -4.527 -2.172 1.00 0.00 H new ATOM 0 HB3 HIS A 81 5.957 -3.514 -0.868 1.00 0.00 H new ATOM 0 HD2 HIS A 81 6.575 -7.163 -1.537 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.793 -7.063 1.662 1.00 0.00 H new ATOM 0 HE2 HIS A 81 5.403 -8.534 0.349 1.00 0.00 H new ATOM 1301 N SER A 82 4.632 -5.042 -4.544 1.00 0.00 N ATOM 1302 CA SER A 82 4.183 -6.004 -5.535 1.00 0.00 C ATOM 1303 C SER A 82 5.248 -7.061 -5.788 1.00 0.00 C ATOM 1304 O SER A 82 6.427 -6.758 -5.871 1.00 0.00 O ATOM 1305 CB SER A 82 3.838 -5.279 -6.841 1.00 0.00 C ATOM 1306 OG SER A 82 3.378 -6.184 -7.831 1.00 0.00 O ATOM 0 H SER A 82 5.424 -4.470 -4.837 1.00 0.00 H new ATOM 0 HA SER A 82 3.293 -6.504 -5.154 1.00 0.00 H new ATOM 0 HB2 SER A 82 3.072 -4.527 -6.650 1.00 0.00 H new ATOM 0 HB3 SER A 82 4.718 -4.752 -7.209 1.00 0.00 H new ATOM 0 HG SER A 82 3.093 -7.019 -7.404 1.00 0.00 H new ATOM 1312 N HIS A 83 4.831 -8.309 -5.910 1.00 0.00 N ATOM 1313 CA HIS A 83 5.765 -9.361 -6.260 1.00 0.00 C ATOM 1314 C HIS A 83 5.907 -9.406 -7.776 1.00 0.00 C ATOM 1315 O HIS A 83 4.917 -9.260 -8.492 1.00 0.00 O ATOM 1316 CB HIS A 83 5.284 -10.717 -5.732 1.00 0.00 C ATOM 1317 CG HIS A 83 5.341 -10.862 -4.237 1.00 0.00 C ATOM 1318 ND1 HIS A 83 4.446 -11.631 -3.527 1.00 0.00 N ATOM 1319 CD2 HIS A 83 6.210 -10.363 -3.321 1.00 0.00 C ATOM 1320 CE1 HIS A 83 4.758 -11.599 -2.244 1.00 0.00 C ATOM 1321 NE2 HIS A 83 5.826 -10.838 -2.089 1.00 0.00 N ATOM 0 H HIS A 83 3.867 -8.614 -5.774 1.00 0.00 H new ATOM 0 HA HIS A 83 6.732 -9.150 -5.803 1.00 0.00 H new ATOM 0 HB2 HIS A 83 4.257 -10.877 -6.061 1.00 0.00 H new ATOM 0 HB3 HIS A 83 5.889 -11.503 -6.184 1.00 0.00 H new ATOM 0 HD1 HIS A 83 3.663 -12.146 -3.930 1.00 0.00 H new ATOM 0 HD2 HIS A 83 7.048 -9.713 -3.523 1.00 0.00 H new ATOM 0 HE1 HIS A 83 4.228 -12.110 -1.454 1.00 0.00 H new ATOM 1330 N PRO A 84 7.127 -9.627 -8.286 1.00 0.00 N ATOM 1331 CA PRO A 84 7.397 -9.608 -9.726 1.00 0.00 C ATOM 1332 C PRO A 84 6.960 -10.891 -10.422 1.00 0.00 C ATOM 1333 O PRO A 84 6.163 -10.863 -11.354 1.00 0.00 O ATOM 1334 CB PRO A 84 8.927 -9.450 -9.811 1.00 0.00 C ATOM 1335 CG PRO A 84 9.401 -9.255 -8.404 1.00 0.00 C ATOM 1336 CD PRO A 84 8.353 -9.863 -7.519 1.00 0.00 C ATOM 0 HA PRO A 84 6.844 -8.812 -10.224 1.00 0.00 H new ATOM 0 HB2 PRO A 84 9.386 -10.332 -10.259 1.00 0.00 H new ATOM 0 HB3 PRO A 84 9.197 -8.598 -10.435 1.00 0.00 H new ATOM 0 HG2 PRO A 84 10.367 -9.735 -8.249 1.00 0.00 H new ATOM 0 HG3 PRO A 84 9.532 -8.196 -8.181 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.529 -10.925 -7.349 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.319 -9.385 -6.540 1.00 0.00 H new ATOM 1344 N ALA A 85 7.470 -12.017 -9.947 1.00 0.00 N ATOM 1345 CA ALA A 85 7.178 -13.304 -10.560 1.00 0.00 C ATOM 1346 C ALA A 85 6.741 -14.303 -9.502 1.00 0.00 C ATOM 1347 O ALA A 85 7.132 -15.471 -9.522 1.00 0.00 O ATOM 1348 CB ALA A 85 8.398 -13.813 -11.317 1.00 0.00 C ATOM 0 H ALA A 85 8.089 -12.066 -9.138 1.00 0.00 H new ATOM 0 HA ALA A 85 6.361 -13.181 -11.271 1.00 0.00 H new ATOM 0 HB1 ALA A 85 8.168 -14.777 -11.772 1.00 0.00 H new ATOM 0 HB2 ALA A 85 8.667 -13.099 -12.096 1.00 0.00 H new ATOM 0 HB3 ALA A 85 9.233 -13.928 -10.626 1.00 0.00 H new ATOM 1354 N THR A 86 5.920 -13.830 -8.580 1.00 0.00 N ATOM 1355 CA THR A 86 5.422 -14.653 -7.489 1.00 0.00 C ATOM 1356 C THR A 86 3.983 -14.272 -7.143 1.00 0.00 C ATOM 1357 O THR A 86 3.545 -13.154 -7.437 1.00 0.00 O ATOM 1358 CB THR A 86 6.325 -14.530 -6.240 1.00 0.00 C ATOM 1359 OG1 THR A 86 6.942 -13.234 -6.205 1.00 0.00 O ATOM 1360 CG2 THR A 86 7.393 -15.617 -6.225 1.00 0.00 C ATOM 0 H THR A 86 5.580 -12.868 -8.566 1.00 0.00 H new ATOM 0 HA THR A 86 5.440 -15.692 -7.819 1.00 0.00 H new ATOM 0 HB THR A 86 5.700 -14.656 -5.356 1.00 0.00 H new ATOM 0 HG1 THR A 86 7.511 -13.164 -5.410 1.00 0.00 H new ATOM 0 HG21 THR A 86 8.013 -15.506 -5.335 1.00 0.00 H new ATOM 0 HG22 THR A 86 6.915 -16.597 -6.214 1.00 0.00 H new ATOM 0 HG23 THR A 86 8.016 -15.527 -7.115 1.00 0.00 H new ATOM 1368 N PRO A 87 3.220 -15.204 -6.541 1.00 0.00 N ATOM 1369 CA PRO A 87 1.810 -14.982 -6.189 1.00 0.00 C ATOM 1370 C PRO A 87 1.617 -13.868 -5.159 1.00 0.00 C ATOM 1371 O PRO A 87 2.581 -13.258 -4.686 1.00 0.00 O ATOM 1372 CB PRO A 87 1.363 -16.329 -5.606 1.00 0.00 C ATOM 1373 CG PRO A 87 2.374 -17.316 -6.076 1.00 0.00 C ATOM 1374 CD PRO A 87 3.664 -16.559 -6.174 1.00 0.00 C ATOM 0 HA PRO A 87 1.233 -14.662 -7.056 1.00 0.00 H new ATOM 0 HB2 PRO A 87 1.325 -16.293 -4.517 1.00 0.00 H new ATOM 0 HB3 PRO A 87 0.364 -16.595 -5.951 1.00 0.00 H new ATOM 0 HG2 PRO A 87 2.461 -18.150 -5.379 1.00 0.00 H new ATOM 0 HG3 PRO A 87 2.092 -17.736 -7.042 1.00 0.00 H new ATOM 0 HD2 PRO A 87 4.209 -16.564 -5.230 1.00 0.00 H new ATOM 0 HD3 PRO A 87 4.327 -16.985 -6.927 1.00 0.00 H new ATOM 1382 N ALA A 88 0.363 -13.613 -4.806 1.00 0.00 N ATOM 1383 CA ALA A 88 0.032 -12.533 -3.886 1.00 0.00 C ATOM 1384 C ALA A 88 0.013 -13.021 -2.444 1.00 0.00 C ATOM 1385 O ALA A 88 -0.225 -12.251 -1.516 1.00 0.00 O ATOM 1386 CB ALA A 88 -1.308 -11.910 -4.261 1.00 0.00 C ATOM 0 H ALA A 88 -0.442 -14.140 -5.144 1.00 0.00 H new ATOM 0 HA ALA A 88 0.807 -11.771 -3.967 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.542 -11.105 -3.565 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -1.253 -11.510 -5.273 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -2.088 -12.669 -4.213 1.00 0.00 H new ATOM 1392 N ARG A 89 0.265 -14.305 -2.262 1.00 0.00 N ATOM 1393 CA ARG A 89 0.318 -14.882 -0.929 1.00 0.00 C ATOM 1394 C ARG A 89 1.607 -14.456 -0.231 1.00 0.00 C ATOM 1395 O ARG A 89 2.648 -14.297 -0.874 1.00 0.00 O ATOM 1396 CB ARG A 89 0.217 -16.410 -1.002 1.00 0.00 C ATOM 1397 CG ARG A 89 1.397 -17.081 -1.684 1.00 0.00 C ATOM 1398 CD ARG A 89 1.093 -18.535 -1.998 1.00 0.00 C ATOM 1399 NE ARG A 89 0.042 -18.662 -3.005 1.00 0.00 N ATOM 1400 CZ ARG A 89 -0.411 -19.825 -3.466 1.00 0.00 C ATOM 1401 NH1 ARG A 89 0.017 -20.968 -2.938 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -1.319 -19.845 -4.434 1.00 0.00 N ATOM 0 H ARG A 89 0.436 -14.968 -3.018 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.529 -14.516 -0.349 1.00 0.00 H new ATOM 0 HB2 ARG A 89 0.124 -16.805 0.009 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -0.696 -16.677 -1.534 1.00 0.00 H new ATOM 0 HG2 ARG A 89 1.639 -16.550 -2.605 1.00 0.00 H new ATOM 0 HG3 ARG A 89 2.275 -17.021 -1.041 1.00 0.00 H new ATOM 0 HD2 ARG A 89 1.998 -19.028 -2.353 1.00 0.00 H new ATOM 0 HD3 ARG A 89 0.787 -19.048 -1.086 1.00 0.00 H new ATOM 0 HE ARG A 89 -0.370 -17.806 -3.378 1.00 0.00 H new ATOM 0 HH11 ARG A 89 0.695 -20.956 -2.176 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -0.333 -21.857 -3.295 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -1.669 -18.970 -4.824 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -1.667 -20.736 -4.788 1.00 0.00 H new ATOM 1416 N PRO A 90 1.552 -14.245 1.087 1.00 0.00 N ATOM 1417 CA PRO A 90 2.718 -13.819 1.860 1.00 0.00 C ATOM 1418 C PRO A 90 3.772 -14.917 1.974 1.00 0.00 C ATOM 1419 O PRO A 90 3.480 -16.036 2.414 1.00 0.00 O ATOM 1420 CB PRO A 90 2.136 -13.491 3.236 1.00 0.00 C ATOM 1421 CG PRO A 90 0.884 -14.294 3.326 1.00 0.00 C ATOM 1422 CD PRO A 90 0.349 -14.392 1.927 1.00 0.00 C ATOM 0 HA PRO A 90 3.231 -12.980 1.390 1.00 0.00 H new ATOM 0 HB2 PRO A 90 2.832 -13.755 4.032 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.929 -12.425 3.333 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.085 -15.284 3.736 1.00 0.00 H new ATOM 0 HG3 PRO A 90 0.161 -13.816 3.987 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -0.148 -15.347 1.753 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -0.382 -13.610 1.721 1.00 0.00 H new ATOM 1430 N SER A 91 4.991 -14.600 1.563 1.00 0.00 N ATOM 1431 CA SER A 91 6.099 -15.526 1.696 1.00 0.00 C ATOM 1432 C SER A 91 6.597 -15.513 3.139 1.00 0.00 C ATOM 1433 O SER A 91 6.132 -14.710 3.949 1.00 0.00 O ATOM 1434 CB SER A 91 7.225 -15.151 0.720 1.00 0.00 C ATOM 1435 OG SER A 91 8.272 -16.112 0.733 1.00 0.00 O ATOM 0 H SER A 91 5.235 -13.707 1.135 1.00 0.00 H new ATOM 0 HA SER A 91 5.765 -16.534 1.449 1.00 0.00 H new ATOM 0 HB2 SER A 91 6.820 -15.067 -0.288 1.00 0.00 H new ATOM 0 HB3 SER A 91 7.626 -14.172 0.985 1.00 0.00 H new ATOM 0 HG SER A 91 8.970 -15.844 0.100 1.00 0.00 H new ATOM 1441 N ALA A 92 7.535 -16.397 3.458 1.00 0.00 N ATOM 1442 CA ALA A 92 8.085 -16.477 4.805 1.00 0.00 C ATOM 1443 C ALA A 92 8.695 -15.142 5.223 1.00 0.00 C ATOM 1444 O ALA A 92 8.651 -14.761 6.392 1.00 0.00 O ATOM 1445 CB ALA A 92 9.121 -17.585 4.882 1.00 0.00 C ATOM 0 H ALA A 92 7.931 -17.069 2.801 1.00 0.00 H new ATOM 0 HA ALA A 92 7.274 -16.708 5.496 1.00 0.00 H new ATOM 0 HB1 ALA A 92 9.525 -17.636 5.893 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.655 -18.537 4.630 1.00 0.00 H new ATOM 0 HB3 ALA A 92 9.928 -17.378 4.179 1.00 0.00 H new ATOM 1451 N GLU A 93 9.256 -14.438 4.252 1.00 0.00 N ATOM 1452 CA GLU A 93 9.862 -13.140 4.496 1.00 0.00 C ATOM 1453 C GLU A 93 8.794 -12.072 4.731 1.00 0.00 C ATOM 1454 O GLU A 93 8.880 -11.313 5.694 1.00 0.00 O ATOM 1455 CB GLU A 93 10.762 -12.760 3.319 1.00 0.00 C ATOM 1456 CG GLU A 93 11.867 -13.775 3.056 1.00 0.00 C ATOM 1457 CD GLU A 93 12.880 -13.844 4.182 1.00 0.00 C ATOM 1458 OE1 GLU A 93 12.563 -14.414 5.251 1.00 0.00 O ATOM 1459 OE2 GLU A 93 13.994 -13.316 4.007 1.00 0.00 O ATOM 0 H GLU A 93 9.304 -14.747 3.281 1.00 0.00 H new ATOM 0 HA GLU A 93 10.470 -13.202 5.399 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.152 -12.657 2.422 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.211 -11.786 3.513 1.00 0.00 H new ATOM 0 HG2 GLU A 93 11.423 -14.760 2.912 1.00 0.00 H new ATOM 0 HG3 GLU A 93 12.378 -13.517 2.129 1.00 0.00 H new ATOM 1466 N ASP A 94 7.775 -12.037 3.863 1.00 0.00 N ATOM 1467 CA ASP A 94 6.668 -11.084 4.007 1.00 0.00 C ATOM 1468 C ASP A 94 5.977 -11.281 5.348 1.00 0.00 C ATOM 1469 O ASP A 94 5.598 -10.322 6.021 1.00 0.00 O ATOM 1470 CB ASP A 94 5.624 -11.261 2.891 1.00 0.00 C ATOM 1471 CG ASP A 94 6.163 -11.021 1.494 1.00 0.00 C ATOM 1472 OD1 ASP A 94 6.643 -11.990 0.871 1.00 0.00 O ATOM 1473 OD2 ASP A 94 6.075 -9.875 0.998 1.00 0.00 O ATOM 0 H ASP A 94 7.694 -12.656 3.056 1.00 0.00 H new ATOM 0 HA ASP A 94 7.092 -10.082 3.942 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.219 -12.272 2.944 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.795 -10.576 3.072 1.00 0.00 H new ATOM 1478 N LYS A 95 5.826 -12.546 5.720 1.00 0.00 N ATOM 1479 CA LYS A 95 5.139 -12.933 6.947 1.00 0.00 C ATOM 1480 C LYS A 95 5.810 -12.343 8.186 1.00 0.00 C ATOM 1481 O LYS A 95 5.141 -11.760 9.040 1.00 0.00 O ATOM 1482 CB LYS A 95 5.112 -14.464 7.044 1.00 0.00 C ATOM 1483 CG LYS A 95 4.487 -15.012 8.319 1.00 0.00 C ATOM 1484 CD LYS A 95 3.001 -14.707 8.406 1.00 0.00 C ATOM 1485 CE LYS A 95 2.351 -15.465 9.554 1.00 0.00 C ATOM 1486 NZ LYS A 95 2.399 -16.935 9.333 1.00 0.00 N ATOM 0 H LYS A 95 6.177 -13.335 5.178 1.00 0.00 H new ATOM 0 HA LYS A 95 4.123 -12.539 6.909 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.564 -14.859 6.189 1.00 0.00 H new ATOM 0 HB3 LYS A 95 6.133 -14.837 6.967 1.00 0.00 H new ATOM 0 HG2 LYS A 95 4.638 -16.091 8.361 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.995 -14.585 9.184 1.00 0.00 H new ATOM 0 HD2 LYS A 95 2.854 -13.636 8.545 1.00 0.00 H new ATOM 0 HD3 LYS A 95 2.516 -14.976 7.468 1.00 0.00 H new ATOM 0 HE2 LYS A 95 2.858 -15.220 10.487 1.00 0.00 H new ATOM 0 HE3 LYS A 95 1.314 -15.146 9.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 1.860 -17.416 10.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.983 -17.161 8.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 3.387 -17.258 9.357 1.00 0.00 H new ATOM 1500 N ARG A 96 7.128 -12.471 8.277 1.00 0.00 N ATOM 1501 CA ARG A 96 7.842 -12.066 9.464 1.00 0.00 C ATOM 1502 C ARG A 96 7.971 -10.545 9.554 1.00 0.00 C ATOM 1503 O ARG A 96 8.037 -9.988 10.649 1.00 0.00 O ATOM 1504 CB ARG A 96 9.221 -12.719 9.488 1.00 0.00 C ATOM 1505 CG ARG A 96 9.949 -12.476 10.786 1.00 0.00 C ATOM 1506 CD ARG A 96 11.248 -13.257 10.882 1.00 0.00 C ATOM 1507 NE ARG A 96 11.826 -13.160 12.220 1.00 0.00 N ATOM 1508 CZ ARG A 96 11.851 -14.165 13.097 1.00 0.00 C ATOM 1509 NH1 ARG A 96 11.390 -15.366 12.764 1.00 0.00 N ATOM 1510 NH2 ARG A 96 12.340 -13.969 14.313 1.00 0.00 N ATOM 0 H ARG A 96 7.718 -12.853 7.538 1.00 0.00 H new ATOM 0 HA ARG A 96 7.270 -12.398 10.331 1.00 0.00 H new ATOM 0 HB2 ARG A 96 9.115 -13.792 9.329 1.00 0.00 H new ATOM 0 HB3 ARG A 96 9.818 -12.332 8.662 1.00 0.00 H new ATOM 0 HG2 ARG A 96 10.161 -11.411 10.886 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.301 -12.751 11.619 1.00 0.00 H new ATOM 0 HD2 ARG A 96 11.065 -14.303 10.637 1.00 0.00 H new ATOM 0 HD3 ARG A 96 11.959 -12.877 10.148 1.00 0.00 H new ATOM 0 HE ARG A 96 12.236 -12.269 12.501 1.00 0.00 H new ATOM 0 HH11 ARG A 96 11.012 -15.526 11.830 1.00 0.00 H new ATOM 0 HH12 ARG A 96 11.414 -16.127 13.442 1.00 0.00 H new ATOM 0 HH21 ARG A 96 12.697 -13.051 14.577 1.00 0.00 H new ATOM 0 HH22 ARG A 96 12.360 -14.736 14.985 1.00 0.00 H new ATOM 1524 N LEU A 97 7.979 -9.878 8.404 1.00 0.00 N ATOM 1525 CA LEU A 97 8.176 -8.433 8.362 1.00 0.00 C ATOM 1526 C LEU A 97 6.932 -7.677 8.830 1.00 0.00 C ATOM 1527 O LEU A 97 6.944 -6.450 8.933 1.00 0.00 O ATOM 1528 CB LEU A 97 8.562 -7.994 6.947 1.00 0.00 C ATOM 1529 CG LEU A 97 9.915 -8.516 6.450 1.00 0.00 C ATOM 1530 CD1 LEU A 97 10.192 -8.032 5.033 1.00 0.00 C ATOM 1531 CD2 LEU A 97 11.035 -8.087 7.384 1.00 0.00 C ATOM 0 H LEU A 97 7.852 -10.314 7.491 1.00 0.00 H new ATOM 0 HA LEU A 97 8.987 -8.189 9.048 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.786 -8.325 6.256 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.576 -6.905 6.912 1.00 0.00 H new ATOM 0 HG LEU A 97 9.873 -9.605 6.441 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.157 -8.414 4.700 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.409 -8.393 4.366 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.208 -6.942 5.017 1.00 0.00 H new ATOM 0 HD21 LEU A 97 11.986 -8.469 7.012 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.074 -6.999 7.430 1.00 0.00 H new ATOM 0 HD23 LEU A 97 10.850 -8.486 8.381 1.00 0.00 H new ATOM 1543 N ALA A 98 5.866 -8.408 9.118 1.00 0.00 N ATOM 1544 CA ALA A 98 4.651 -7.805 9.631 1.00 0.00 C ATOM 1545 C ALA A 98 4.732 -7.641 11.143 1.00 0.00 C ATOM 1546 O ALA A 98 4.401 -8.555 11.900 1.00 0.00 O ATOM 1547 CB ALA A 98 3.441 -8.639 9.254 1.00 0.00 C ATOM 0 H ALA A 98 5.820 -9.421 9.004 1.00 0.00 H new ATOM 0 HA ALA A 98 4.543 -6.818 9.182 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.539 -8.170 9.648 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.370 -8.707 8.168 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.543 -9.639 9.675 1.00 0.00 H new ATOM 1553 N PHE A 99 5.207 -6.484 11.576 1.00 0.00 N ATOM 1554 CA PHE A 99 5.357 -6.200 12.999 1.00 0.00 C ATOM 1555 C PHE A 99 4.249 -5.275 13.498 1.00 0.00 C ATOM 1556 O PHE A 99 4.143 -5.009 14.695 1.00 0.00 O ATOM 1557 CB PHE A 99 6.722 -5.566 13.281 1.00 0.00 C ATOM 1558 CG PHE A 99 7.890 -6.446 12.933 1.00 0.00 C ATOM 1559 CD1 PHE A 99 8.240 -7.510 13.750 1.00 0.00 C ATOM 1560 CD2 PHE A 99 8.644 -6.206 11.796 1.00 0.00 C ATOM 1561 CE1 PHE A 99 9.318 -8.317 13.439 1.00 0.00 C ATOM 1562 CE2 PHE A 99 9.723 -7.010 11.478 1.00 0.00 C ATOM 1563 CZ PHE A 99 10.060 -8.067 12.301 1.00 0.00 C ATOM 0 H PHE A 99 5.497 -5.723 10.962 1.00 0.00 H new ATOM 0 HA PHE A 99 5.285 -7.148 13.533 1.00 0.00 H new ATOM 0 HB2 PHE A 99 6.802 -4.635 12.719 1.00 0.00 H new ATOM 0 HB3 PHE A 99 6.779 -5.306 14.338 1.00 0.00 H new ATOM 0 HD1 PHE A 99 7.663 -7.711 14.641 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.386 -5.380 11.150 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.580 -9.142 14.085 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.301 -6.812 10.588 1.00 0.00 H new ATOM 0 HZ PHE A 99 10.902 -8.697 12.055 1.00 0.00 H new ATOM 1573 N ASP A 100 3.429 -4.789 12.581 1.00 0.00 N ATOM 1574 CA ASP A 100 2.368 -3.849 12.929 1.00 0.00 C ATOM 1575 C ASP A 100 1.030 -4.319 12.370 1.00 0.00 C ATOM 1576 O ASP A 100 0.664 -3.977 11.246 1.00 0.00 O ATOM 1577 CB ASP A 100 2.686 -2.444 12.411 1.00 0.00 C ATOM 1578 CG ASP A 100 1.815 -1.378 13.049 1.00 0.00 C ATOM 1579 OD1 ASP A 100 0.574 -1.460 12.932 1.00 0.00 O ATOM 1580 OD2 ASP A 100 2.374 -0.457 13.687 1.00 0.00 O ATOM 0 H ASP A 100 3.475 -5.027 11.590 1.00 0.00 H new ATOM 0 HA ASP A 100 2.302 -3.809 14.016 1.00 0.00 H new ATOM 0 HB2 ASP A 100 3.734 -2.217 12.606 1.00 0.00 H new ATOM 0 HB3 ASP A 100 2.551 -2.420 11.330 1.00 0.00 H new ATOM 1585 N PRO A 101 0.296 -5.141 13.136 1.00 0.00 N ATOM 1586 CA PRO A 101 -0.992 -5.700 12.699 1.00 0.00 C ATOM 1587 C PRO A 101 -2.091 -4.641 12.553 1.00 0.00 C ATOM 1588 O PRO A 101 -3.201 -4.947 12.114 1.00 0.00 O ATOM 1589 CB PRO A 101 -1.348 -6.685 13.817 1.00 0.00 C ATOM 1590 CG PRO A 101 -0.623 -6.177 15.014 1.00 0.00 C ATOM 1591 CD PRO A 101 0.656 -5.586 14.494 1.00 0.00 C ATOM 0 HA PRO A 101 -0.914 -6.154 11.711 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -2.424 -6.716 13.989 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -1.036 -7.699 13.566 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -1.214 -5.428 15.541 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -0.423 -6.982 15.722 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.996 -4.755 15.113 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.461 -6.321 14.476 1.00 0.00 H new ATOM 1599 N SER A 102 -1.786 -3.403 12.926 1.00 0.00 N ATOM 1600 CA SER A 102 -2.752 -2.320 12.822 1.00 0.00 C ATOM 1601 C SER A 102 -2.657 -1.662 11.447 1.00 0.00 C ATOM 1602 O SER A 102 -3.604 -1.023 10.977 1.00 0.00 O ATOM 1603 CB SER A 102 -2.510 -1.293 13.929 1.00 0.00 C ATOM 1604 OG SER A 102 -2.586 -1.906 15.207 1.00 0.00 O ATOM 0 H SER A 102 -0.879 -3.127 13.302 1.00 0.00 H new ATOM 0 HA SER A 102 -3.756 -2.727 12.941 1.00 0.00 H new ATOM 0 HB2 SER A 102 -1.530 -0.834 13.798 1.00 0.00 H new ATOM 0 HB3 SER A 102 -3.248 -0.494 13.859 1.00 0.00 H new ATOM 0 HG SER A 102 -2.427 -1.234 15.902 1.00 0.00 H new ATOM 1610 N LEU A 103 -1.507 -1.828 10.811 1.00 0.00 N ATOM 1611 CA LEU A 103 -1.289 -1.316 9.470 1.00 0.00 C ATOM 1612 C LEU A 103 -1.630 -2.380 8.436 1.00 0.00 C ATOM 1613 O LEU A 103 -1.428 -3.573 8.665 1.00 0.00 O ATOM 1614 CB LEU A 103 0.163 -0.866 9.298 1.00 0.00 C ATOM 1615 CG LEU A 103 0.578 0.340 10.145 1.00 0.00 C ATOM 1616 CD1 LEU A 103 2.041 0.679 9.905 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -0.306 1.540 9.841 1.00 0.00 C ATOM 0 H LEU A 103 -0.705 -2.318 11.208 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.942 -0.456 9.320 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.817 -1.703 9.542 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.330 -0.627 8.248 1.00 0.00 H new ATOM 0 HG LEU A 103 0.451 0.081 11.196 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.320 1.538 10.515 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.662 -0.175 10.176 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.191 0.917 8.852 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.006 2.386 10.453 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.214 1.802 8.787 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.344 1.293 10.065 1.00 0.00 H new ATOM 1629 N SER A 104 -2.156 -1.950 7.302 1.00 0.00 N ATOM 1630 CA SER A 104 -2.528 -2.875 6.248 1.00 0.00 C ATOM 1631 C SER A 104 -1.354 -3.118 5.305 1.00 0.00 C ATOM 1632 O SER A 104 -0.828 -2.181 4.697 1.00 0.00 O ATOM 1633 CB SER A 104 -3.722 -2.323 5.471 1.00 0.00 C ATOM 1634 OG SER A 104 -4.748 -1.895 6.353 1.00 0.00 O ATOM 0 H SER A 104 -2.334 -0.969 7.089 1.00 0.00 H new ATOM 0 HA SER A 104 -2.805 -3.827 6.702 1.00 0.00 H new ATOM 0 HB2 SER A 104 -3.401 -1.488 4.848 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.110 -3.090 4.800 1.00 0.00 H new ATOM 0 HG SER A 104 -5.601 -2.293 6.081 1.00 0.00 H new ATOM 1640 N TYR A 105 -0.938 -4.370 5.195 1.00 0.00 N ATOM 1641 CA TYR A 105 0.130 -4.739 4.282 1.00 0.00 C ATOM 1642 C TYR A 105 -0.467 -5.201 2.958 1.00 0.00 C ATOM 1643 O TYR A 105 -1.031 -6.289 2.873 1.00 0.00 O ATOM 1644 CB TYR A 105 0.996 -5.854 4.878 1.00 0.00 C ATOM 1645 CG TYR A 105 1.676 -5.484 6.179 1.00 0.00 C ATOM 1646 CD1 TYR A 105 2.895 -4.816 6.182 1.00 0.00 C ATOM 1647 CD2 TYR A 105 1.102 -5.808 7.403 1.00 0.00 C ATOM 1648 CE1 TYR A 105 3.523 -4.482 7.367 1.00 0.00 C ATOM 1649 CE2 TYR A 105 1.725 -5.478 8.592 1.00 0.00 C ATOM 1650 CZ TYR A 105 2.935 -4.816 8.570 1.00 0.00 C ATOM 1651 OH TYR A 105 3.558 -4.486 9.753 1.00 0.00 O ATOM 0 H TYR A 105 -1.325 -5.148 5.728 1.00 0.00 H new ATOM 0 HA TYR A 105 0.761 -3.866 4.115 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.373 -6.733 5.044 1.00 0.00 H new ATOM 0 HB3 TYR A 105 1.757 -6.136 4.150 1.00 0.00 H new ATOM 0 HD1 TYR A 105 3.359 -4.554 5.243 1.00 0.00 H new ATOM 0 HD2 TYR A 105 0.154 -6.326 7.425 1.00 0.00 H new ATOM 0 HE1 TYR A 105 4.469 -3.962 7.352 1.00 0.00 H new ATOM 0 HE2 TYR A 105 1.266 -5.737 9.535 1.00 0.00 H new ATOM 0 HH TYR A 105 3.669 -3.514 9.804 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.380 -4.362 1.937 1.00 0.00 N ATOM 1662 CA LEU A 106 -0.911 -4.720 0.632 1.00 0.00 C ATOM 1663 C LEU A 106 0.128 -5.453 -0.195 1.00 0.00 C ATOM 1664 O LEU A 106 1.286 -5.029 -0.288 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.405 -3.487 -0.132 1.00 0.00 C ATOM 1666 CG LEU A 106 -2.778 -2.956 0.290 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -2.706 -2.256 1.639 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.334 -2.020 -0.773 1.00 0.00 C ATOM 0 H LEU A 106 0.049 -3.438 1.986 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.760 -5.382 0.802 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -0.673 -2.689 -0.010 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.439 -3.729 -1.194 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.453 -3.806 0.392 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.696 -1.890 1.912 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.358 -2.959 2.396 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.013 -1.417 1.577 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.310 -1.651 -0.458 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.654 -1.179 -0.908 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.436 -2.559 -1.715 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.293 -6.561 -0.781 1.00 0.00 N ATOM 1681 CA ILE A 107 0.567 -7.349 -1.642 1.00 0.00 C ATOM 1682 C ILE A 107 -0.051 -7.460 -3.028 1.00 0.00 C ATOM 1683 O ILE A 107 -1.171 -7.949 -3.189 1.00 0.00 O ATOM 1684 CB ILE A 107 0.825 -8.763 -1.076 1.00 0.00 C ATOM 1685 CG1 ILE A 107 1.458 -8.677 0.318 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.723 -9.553 -2.020 1.00 0.00 C ATOM 1687 CD1 ILE A 107 1.711 -10.027 0.958 1.00 0.00 C ATOM 0 H ILE A 107 -1.235 -6.937 -0.673 1.00 0.00 H new ATOM 0 HA ILE A 107 1.527 -6.836 -1.699 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.130 -9.281 -0.988 1.00 0.00 H new ATOM 0 HG12 ILE A 107 2.402 -8.137 0.246 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.806 -8.094 0.968 1.00 0.00 H new ATOM 0 HG21 ILE A 107 1.897 -10.548 -1.609 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.240 -9.642 -2.993 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.676 -9.036 -2.134 1.00 0.00 H new ATOM 0 HD11 ILE A 107 2.160 -9.885 1.941 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.767 -10.562 1.064 1.00 0.00 H new ATOM 0 HD13 ILE A 107 2.388 -10.606 0.330 1.00 0.00 H new ATOM 1699 N ILE A 108 0.671 -6.974 -4.018 1.00 0.00 N ATOM 1700 CA ILE A 108 0.229 -7.046 -5.397 1.00 0.00 C ATOM 1701 C ILE A 108 1.019 -8.130 -6.123 1.00 0.00 C ATOM 1702 O ILE A 108 2.188 -8.355 -5.820 1.00 0.00 O ATOM 1703 CB ILE A 108 0.419 -5.690 -6.117 1.00 0.00 C ATOM 1704 CG1 ILE A 108 -0.273 -4.571 -5.331 1.00 0.00 C ATOM 1705 CG2 ILE A 108 -0.117 -5.750 -7.540 1.00 0.00 C ATOM 1706 CD1 ILE A 108 -0.021 -3.180 -5.880 1.00 0.00 C ATOM 0 H ILE A 108 1.576 -6.520 -3.891 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.834 -7.288 -5.408 1.00 0.00 H new ATOM 0 HB ILE A 108 1.487 -5.476 -6.167 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.347 -4.758 -5.323 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.064 -4.607 -4.295 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.028 -4.785 -8.025 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.416 -6.520 -8.098 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -1.180 -5.989 -7.519 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.545 -2.447 -5.268 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.048 -2.970 -5.862 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -0.385 -3.122 -6.906 1.00 0.00 H new ATOM 1718 N SER A 109 0.376 -8.834 -7.036 1.00 0.00 N ATOM 1719 CA SER A 109 1.059 -9.850 -7.811 1.00 0.00 C ATOM 1720 C SER A 109 1.159 -9.427 -9.271 1.00 0.00 C ATOM 1721 O SER A 109 0.155 -9.386 -9.986 1.00 0.00 O ATOM 1722 CB SER A 109 0.336 -11.195 -7.689 1.00 0.00 C ATOM 1723 OG SER A 109 1.076 -12.239 -8.308 1.00 0.00 O ATOM 0 H SER A 109 -0.613 -8.721 -7.258 1.00 0.00 H new ATOM 0 HA SER A 109 2.068 -9.966 -7.416 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.180 -11.432 -6.637 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.650 -11.123 -8.149 1.00 0.00 H new ATOM 0 HG SER A 109 1.922 -12.368 -7.830 1.00 0.00 H new ATOM 1729 N LEU A 110 2.374 -9.107 -9.708 1.00 0.00 N ATOM 1730 CA LEU A 110 2.613 -8.710 -11.090 1.00 0.00 C ATOM 1731 C LEU A 110 2.893 -9.941 -11.950 1.00 0.00 C ATOM 1732 O LEU A 110 3.273 -9.828 -13.114 1.00 0.00 O ATOM 1733 CB LEU A 110 3.790 -7.728 -11.167 1.00 0.00 C ATOM 1734 CG LEU A 110 3.492 -6.391 -11.855 1.00 0.00 C ATOM 1735 CD1 LEU A 110 3.098 -6.602 -13.310 1.00 0.00 C ATOM 1736 CD2 LEU A 110 2.398 -5.642 -11.108 1.00 0.00 C ATOM 0 H LEU A 110 3.209 -9.115 -9.123 1.00 0.00 H new ATOM 0 HA LEU A 110 1.721 -8.212 -11.470 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.138 -7.525 -10.154 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.611 -8.213 -11.695 1.00 0.00 H new ATOM 0 HG LEU A 110 4.401 -5.789 -11.836 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.892 -5.638 -13.775 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.914 -7.093 -13.840 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.206 -7.226 -13.358 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.198 -4.695 -11.609 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.489 -6.244 -11.094 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.722 -5.450 -10.085 1.00 0.00 H new ATOM 1748 N ALA A 111 2.688 -11.119 -11.361 1.00 0.00 N ATOM 1749 CA ALA A 111 2.859 -12.383 -12.073 1.00 0.00 C ATOM 1750 C ALA A 111 1.812 -12.527 -13.176 1.00 0.00 C ATOM 1751 O ALA A 111 1.960 -13.334 -14.096 1.00 0.00 O ATOM 1752 CB ALA A 111 2.776 -13.557 -11.105 1.00 0.00 C ATOM 0 H ALA A 111 2.402 -11.223 -10.388 1.00 0.00 H new ATOM 0 HA ALA A 111 3.846 -12.384 -12.535 1.00 0.00 H new ATOM 0 HB1 ALA A 111 2.906 -14.490 -11.653 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.560 -13.465 -10.354 1.00 0.00 H new ATOM 0 HB3 ALA A 111 1.802 -13.556 -10.615 1.00 0.00 H new ATOM 1758 N GLU A 112 0.749 -11.740 -13.068 1.00 0.00 N ATOM 1759 CA GLU A 112 -0.305 -11.714 -14.073 1.00 0.00 C ATOM 1760 C GLU A 112 -0.578 -10.267 -14.477 1.00 0.00 C ATOM 1761 O GLU A 112 -1.436 -9.606 -13.904 1.00 0.00 O ATOM 1762 CB GLU A 112 -1.577 -12.386 -13.535 1.00 0.00 C ATOM 1763 CG GLU A 112 -2.665 -12.580 -14.580 1.00 0.00 C ATOM 1764 CD GLU A 112 -3.808 -13.441 -14.079 1.00 0.00 C ATOM 1765 OE1 GLU A 112 -3.593 -14.652 -13.869 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -4.931 -12.922 -13.920 1.00 0.00 O ATOM 0 H GLU A 112 0.594 -11.105 -12.285 1.00 0.00 H new ATOM 0 HA GLU A 112 0.016 -12.272 -14.952 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -1.313 -13.357 -13.116 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -1.976 -11.784 -12.718 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -3.053 -11.607 -14.880 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -2.232 -13.039 -15.469 1.00 0.00 H new ATOM 1773 N PRO A 113 0.189 -9.741 -15.448 1.00 0.00 N ATOM 1774 CA PRO A 113 0.127 -8.322 -15.830 1.00 0.00 C ATOM 1775 C PRO A 113 -1.166 -7.934 -16.544 1.00 0.00 C ATOM 1776 O PRO A 113 -1.475 -6.751 -16.685 1.00 0.00 O ATOM 1777 CB PRO A 113 1.327 -8.152 -16.764 1.00 0.00 C ATOM 1778 CG PRO A 113 1.572 -9.510 -17.320 1.00 0.00 C ATOM 1779 CD PRO A 113 1.191 -10.480 -16.238 1.00 0.00 C ATOM 0 HA PRO A 113 0.149 -7.678 -14.951 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.114 -7.433 -17.555 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.199 -7.782 -16.224 1.00 0.00 H new ATOM 0 HG2 PRO A 113 0.978 -9.676 -18.219 1.00 0.00 H new ATOM 0 HG3 PRO A 113 2.618 -9.632 -17.602 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.777 -11.400 -16.651 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.051 -10.762 -15.631 1.00 0.00 H new ATOM 1787 N GLN A 114 -1.912 -8.926 -16.993 1.00 0.00 N ATOM 1788 CA GLN A 114 -3.188 -8.679 -17.658 1.00 0.00 C ATOM 1789 C GLN A 114 -4.292 -8.483 -16.628 1.00 0.00 C ATOM 1790 O GLN A 114 -5.318 -7.861 -16.906 1.00 0.00 O ATOM 1791 CB GLN A 114 -3.537 -9.829 -18.599 1.00 0.00 C ATOM 1792 CG GLN A 114 -2.612 -9.931 -19.796 1.00 0.00 C ATOM 1793 CD GLN A 114 -2.995 -11.060 -20.726 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -3.792 -10.882 -21.645 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -2.417 -12.228 -20.501 1.00 0.00 N ATOM 0 H GLN A 114 -1.661 -9.911 -16.912 1.00 0.00 H new ATOM 0 HA GLN A 114 -3.097 -7.768 -18.250 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -3.504 -10.766 -18.043 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -4.561 -9.703 -18.950 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -2.628 -8.990 -20.346 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -1.589 -10.080 -19.450 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -1.761 -12.332 -19.727 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -2.627 -13.025 -21.102 1.00 0.00 H new ATOM 1804 N LYS A 115 -4.062 -9.016 -15.436 1.00 0.00 N ATOM 1805 CA LYS A 115 -4.979 -8.864 -14.319 1.00 0.00 C ATOM 1806 C LYS A 115 -4.212 -8.947 -13.007 1.00 0.00 C ATOM 1807 O LYS A 115 -4.220 -9.984 -12.341 1.00 0.00 O ATOM 1808 CB LYS A 115 -6.074 -9.934 -14.341 1.00 0.00 C ATOM 1809 CG LYS A 115 -7.287 -9.576 -15.187 1.00 0.00 C ATOM 1810 CD LYS A 115 -8.383 -10.625 -15.062 1.00 0.00 C ATOM 1811 CE LYS A 115 -8.789 -10.838 -13.610 1.00 0.00 C ATOM 1812 NZ LYS A 115 -9.375 -9.614 -13.002 1.00 0.00 N ATOM 0 H LYS A 115 -3.232 -9.567 -15.218 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.456 -7.888 -14.409 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -5.648 -10.865 -14.715 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -6.402 -10.122 -13.319 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.674 -8.605 -14.878 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.989 -9.482 -16.231 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -9.252 -10.315 -15.642 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -8.036 -11.567 -15.486 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -9.512 -11.651 -13.553 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.917 -11.146 -13.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -9.713 -9.831 -12.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.651 -8.869 -12.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -10.172 -9.285 -13.584 1.00 0.00 H new ATOM 1826 N PRO A 116 -3.510 -7.866 -12.636 1.00 0.00 N ATOM 1827 CA PRO A 116 -2.702 -7.834 -11.418 1.00 0.00 C ATOM 1828 C PRO A 116 -3.557 -8.054 -10.182 1.00 0.00 C ATOM 1829 O PRO A 116 -4.472 -7.273 -9.905 1.00 0.00 O ATOM 1830 CB PRO A 116 -2.099 -6.425 -11.408 1.00 0.00 C ATOM 1831 CG PRO A 116 -2.223 -5.938 -12.812 1.00 0.00 C ATOM 1832 CD PRO A 116 -3.455 -6.590 -13.366 1.00 0.00 C ATOM 0 HA PRO A 116 -1.947 -8.620 -11.405 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -2.632 -5.773 -10.716 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -1.057 -6.445 -11.088 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -2.309 -4.852 -12.843 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -1.343 -6.205 -13.397 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -4.345 -5.986 -13.191 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.381 -6.744 -14.443 1.00 0.00 H new ATOM 1840 N VAL A 117 -3.287 -9.131 -9.460 1.00 0.00 N ATOM 1841 CA VAL A 117 -4.046 -9.426 -8.259 1.00 0.00 C ATOM 1842 C VAL A 117 -3.561 -8.543 -7.125 1.00 0.00 C ATOM 1843 O VAL A 117 -2.392 -8.593 -6.742 1.00 0.00 O ATOM 1844 CB VAL A 117 -3.904 -10.908 -7.846 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -4.778 -11.222 -6.633 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -4.247 -11.826 -9.013 1.00 0.00 C ATOM 0 H VAL A 117 -2.556 -9.807 -9.683 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.097 -9.231 -8.470 1.00 0.00 H new ATOM 0 HB VAL A 117 -2.865 -11.085 -7.567 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -4.661 -12.271 -6.362 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.476 -10.594 -5.795 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.822 -11.025 -6.876 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -4.141 -12.865 -8.702 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.274 -11.645 -9.329 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.571 -11.625 -9.844 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.463 -7.738 -6.599 1.00 0.00 N ATOM 1857 CA CYS A 118 -4.153 -6.861 -5.491 1.00 0.00 C ATOM 1858 C CYS A 118 -4.999 -7.228 -4.283 1.00 0.00 C ATOM 1859 O CYS A 118 -6.213 -7.376 -4.397 1.00 0.00 O ATOM 1860 CB CYS A 118 -4.391 -5.407 -5.896 1.00 0.00 C ATOM 1861 SG CYS A 118 -3.529 -4.930 -7.413 1.00 0.00 S ATOM 0 H CYS A 118 -5.427 -7.675 -6.927 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.103 -6.979 -5.223 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -5.461 -5.246 -6.029 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -4.069 -4.755 -5.084 1.00 0.00 H new ATOM 0 HG CYS A 118 -3.630 -3.645 -7.584 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.363 -7.401 -3.140 1.00 0.00 N ATOM 1868 CA LYS A 119 -5.081 -7.645 -1.898 1.00 0.00 C ATOM 1869 C LYS A 119 -4.454 -6.849 -0.770 1.00 0.00 C ATOM 1870 O LYS A 119 -3.324 -6.373 -0.879 1.00 0.00 O ATOM 1871 CB LYS A 119 -5.059 -9.127 -1.526 1.00 0.00 C ATOM 1872 CG LYS A 119 -5.833 -10.043 -2.461 1.00 0.00 C ATOM 1873 CD LYS A 119 -7.296 -10.145 -2.054 1.00 0.00 C ATOM 1874 CE LYS A 119 -8.034 -11.185 -2.886 1.00 0.00 C ATOM 1875 NZ LYS A 119 -9.396 -11.460 -2.358 1.00 0.00 N ATOM 0 H LYS A 119 -3.348 -7.377 -3.043 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.115 -7.334 -2.048 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.022 -9.461 -1.493 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.462 -9.238 -0.519 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -5.763 -9.667 -3.482 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -5.382 -11.035 -2.456 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.364 -10.407 -0.998 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.777 -9.174 -2.173 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -8.109 -10.838 -3.917 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.458 -12.110 -2.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.929 -12.026 -3.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -9.322 -11.986 -1.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -9.892 -10.561 -2.191 1.00 0.00 H new ATOM 1889 N SER A 120 -5.192 -6.724 0.309 1.00 0.00 N ATOM 1890 CA SER A 120 -4.691 -6.098 1.512 1.00 0.00 C ATOM 1891 C SER A 120 -4.714 -7.135 2.617 1.00 0.00 C ATOM 1892 O SER A 120 -5.744 -7.746 2.870 1.00 0.00 O ATOM 1893 CB SER A 120 -5.550 -4.890 1.893 1.00 0.00 C ATOM 1894 OG SER A 120 -4.941 -4.133 2.924 1.00 0.00 O ATOM 0 H SER A 120 -6.155 -7.053 0.378 1.00 0.00 H new ATOM 0 HA SER A 120 -3.675 -5.737 1.351 1.00 0.00 H new ATOM 0 HB2 SER A 120 -5.704 -4.259 1.017 1.00 0.00 H new ATOM 0 HB3 SER A 120 -6.534 -5.228 2.219 1.00 0.00 H new ATOM 0 HG SER A 120 -5.510 -3.367 3.147 1.00 0.00 H new ATOM 1900 N PHE A 121 -3.585 -7.368 3.243 1.00 0.00 N ATOM 1901 CA PHE A 121 -3.507 -8.417 4.233 1.00 0.00 C ATOM 1902 C PHE A 121 -3.201 -7.859 5.608 1.00 0.00 C ATOM 1903 O PHE A 121 -2.286 -7.052 5.785 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.445 -9.445 3.845 1.00 0.00 C ATOM 1905 CG PHE A 121 -2.699 -10.116 2.524 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -3.685 -11.079 2.399 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -1.941 -9.790 1.412 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -3.909 -11.709 1.190 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -2.162 -10.414 0.199 1.00 0.00 C ATOM 1910 CZ PHE A 121 -3.146 -11.375 0.088 1.00 0.00 C ATOM 0 H PHE A 121 -2.718 -6.853 3.088 1.00 0.00 H new ATOM 0 HA PHE A 121 -4.481 -8.904 4.270 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.473 -8.953 3.810 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.389 -10.206 4.623 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.287 -11.341 3.257 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.168 -9.040 1.494 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -4.679 -12.461 1.107 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -1.565 -10.150 -0.661 1.00 0.00 H new ATOM 0 HZ PHE A 121 -3.319 -11.865 -0.859 1.00 0.00 H new ATOM 1920 N LEU A 122 -3.991 -8.278 6.573 1.00 0.00 N ATOM 1921 CA LEU A 122 -3.686 -8.024 7.961 1.00 0.00 C ATOM 1922 C LEU A 122 -2.998 -9.255 8.513 1.00 0.00 C ATOM 1923 O LEU A 122 -3.624 -10.301 8.694 1.00 0.00 O ATOM 1924 CB LEU A 122 -4.960 -7.717 8.754 1.00 0.00 C ATOM 1925 CG LEU A 122 -5.720 -6.464 8.309 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -6.993 -6.295 9.122 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -4.835 -5.231 8.442 1.00 0.00 C ATOM 0 H LEU A 122 -4.854 -8.799 6.418 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.036 -7.153 8.049 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.630 -8.574 8.680 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.696 -7.608 9.806 1.00 0.00 H new ATOM 0 HG LEU A 122 -5.995 -6.582 7.261 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.520 -5.400 8.792 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -7.633 -7.166 8.980 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -6.740 -6.198 10.178 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -5.390 -4.349 8.122 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.532 -5.111 9.482 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -3.950 -5.349 7.817 1.00 0.00 H new ATOM 1939 N ILE A 123 -1.704 -9.151 8.744 1.00 0.00 N ATOM 1940 CA ILE A 123 -0.933 -10.310 9.135 1.00 0.00 C ATOM 1941 C ILE A 123 -0.909 -10.461 10.647 1.00 0.00 C ATOM 1942 O ILE A 123 -0.281 -9.679 11.364 1.00 0.00 O ATOM 1943 CB ILE A 123 0.502 -10.263 8.572 1.00 0.00 C ATOM 1944 CG1 ILE A 123 0.453 -10.145 7.043 1.00 0.00 C ATOM 1945 CG2 ILE A 123 1.281 -11.504 8.993 1.00 0.00 C ATOM 1946 CD1 ILE A 123 1.814 -10.076 6.384 1.00 0.00 C ATOM 0 H ILE A 123 -1.171 -8.285 8.668 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.425 -11.183 8.707 1.00 0.00 H new ATOM 0 HB ILE A 123 1.015 -9.390 8.976 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.091 -11.000 6.641 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.114 -9.253 6.776 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.291 -11.454 8.587 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.329 -11.552 10.081 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.780 -12.394 8.612 1.00 0.00 H new ATOM 0 HD11 ILE A 123 1.692 -9.994 5.304 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.354 -9.205 6.755 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.378 -10.979 6.618 1.00 0.00 H new ATOM 1958 N LYS A 124 -1.628 -11.467 11.107 1.00 0.00 N ATOM 1959 CA LYS A 124 -1.689 -11.814 12.516 1.00 0.00 C ATOM 1960 C LYS A 124 -0.430 -12.581 12.903 1.00 0.00 C ATOM 1961 O LYS A 124 0.403 -12.863 12.037 1.00 0.00 O ATOM 1962 CB LYS A 124 -2.952 -12.648 12.768 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.234 -11.840 12.582 1.00 0.00 C ATOM 1964 CD LYS A 124 -5.436 -12.719 12.254 1.00 0.00 C ATOM 1965 CE LYS A 124 -6.699 -11.880 12.066 1.00 0.00 C ATOM 1966 NZ LYS A 124 -7.867 -12.681 11.596 1.00 0.00 N ATOM 0 H LYS A 124 -2.191 -12.072 10.509 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.739 -10.915 13.130 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -2.962 -13.500 12.089 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -2.923 -13.048 13.781 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.439 -11.275 13.491 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.089 -11.114 11.782 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.236 -13.289 11.347 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -5.592 -13.441 13.056 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -6.952 -11.398 13.010 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.497 -11.086 11.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -8.749 -12.200 11.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -7.828 -12.778 10.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -7.840 -13.624 12.033 1.00 0.00 H new ATOM 1980 N LYS A 125 -0.295 -12.912 14.190 1.00 0.00 N ATOM 1981 CA LYS A 125 0.893 -13.605 14.696 1.00 0.00 C ATOM 1982 C LYS A 125 1.270 -14.763 13.787 1.00 0.00 C ATOM 1983 O LYS A 125 2.399 -14.857 13.302 1.00 0.00 O ATOM 1984 CB LYS A 125 0.651 -14.122 16.110 1.00 0.00 C ATOM 1985 CG LYS A 125 1.919 -14.605 16.793 1.00 0.00 C ATOM 1986 CD LYS A 125 1.656 -15.031 18.223 1.00 0.00 C ATOM 1987 CE LYS A 125 2.941 -15.435 18.925 1.00 0.00 C ATOM 1988 NZ LYS A 125 2.708 -15.780 20.352 1.00 0.00 N ATOM 0 H LYS A 125 -0.996 -12.710 14.903 1.00 0.00 H new ATOM 0 HA LYS A 125 1.715 -12.889 14.714 1.00 0.00 H new ATOM 0 HB2 LYS A 125 0.202 -13.329 16.709 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -0.069 -14.940 16.073 1.00 0.00 H new ATOM 0 HG2 LYS A 125 2.337 -15.443 16.235 1.00 0.00 H new ATOM 0 HG3 LYS A 125 2.665 -13.810 16.781 1.00 0.00 H new ATOM 0 HD2 LYS A 125 1.184 -14.213 18.767 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.956 -15.866 18.233 1.00 0.00 H new ATOM 0 HE2 LYS A 125 3.382 -16.290 18.412 1.00 0.00 H new ATOM 0 HE3 LYS A 125 3.661 -14.619 18.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.609 -16.050 20.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 2.311 -14.956 20.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 2.040 -16.575 20.412 1.00 0.00 H new ATOM 2002 N ASP A 126 0.311 -15.637 13.558 1.00 0.00 N ATOM 2003 CA ASP A 126 0.487 -16.703 12.588 1.00 0.00 C ATOM 2004 C ASP A 126 -0.795 -16.932 11.803 1.00 0.00 C ATOM 2005 O ASP A 126 -1.501 -17.923 11.993 1.00 0.00 O ATOM 2006 CB ASP A 126 0.951 -18.005 13.241 1.00 0.00 C ATOM 2007 CG ASP A 126 1.292 -19.055 12.204 1.00 0.00 C ATOM 2008 OD1 ASP A 126 2.071 -18.748 11.278 1.00 0.00 O ATOM 2009 OD2 ASP A 126 0.771 -20.186 12.299 1.00 0.00 O ATOM 0 H ASP A 126 -0.595 -15.632 14.027 1.00 0.00 H new ATOM 0 HA ASP A 126 1.271 -16.385 11.901 1.00 0.00 H new ATOM 0 HB2 ASP A 126 1.824 -17.810 13.864 1.00 0.00 H new ATOM 0 HB3 ASP A 126 0.168 -18.383 13.899 1.00 0.00 H new ATOM 2014 N GLY A 127 -1.111 -15.973 10.956 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.240 -16.099 10.068 1.00 0.00 C ATOM 2016 C GLY A 127 -2.443 -14.839 9.275 1.00 0.00 C ATOM 2017 O GLY A 127 -2.372 -13.740 9.818 1.00 0.00 O ATOM 0 H GLY A 127 -0.597 -15.096 10.867 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -2.083 -16.938 9.390 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -3.138 -16.319 10.645 1.00 0.00 H new ATOM 2021 N VAL A 128 -2.679 -14.987 7.994 1.00 0.00 N ATOM 2022 CA VAL A 128 -2.875 -13.841 7.133 1.00 0.00 C ATOM 2023 C VAL A 128 -4.363 -13.645 6.859 1.00 0.00 C ATOM 2024 O VAL A 128 -5.059 -14.575 6.452 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.077 -13.981 5.813 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -2.533 -15.183 4.996 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -2.173 -12.710 4.996 1.00 0.00 C ATOM 0 H VAL A 128 -2.740 -15.889 7.522 1.00 0.00 H new ATOM 0 HA VAL A 128 -2.495 -12.957 7.645 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.033 -14.148 6.079 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.947 -15.243 4.079 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -2.391 -16.094 5.578 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.588 -15.074 4.746 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.606 -12.827 4.072 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.217 -12.509 4.758 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -1.765 -11.877 5.569 1.00 0.00 H new ATOM 2037 N ASP A 129 -4.859 -12.452 7.137 1.00 0.00 N ATOM 2038 CA ASP A 129 -6.270 -12.157 6.944 1.00 0.00 C ATOM 2039 C ASP A 129 -6.444 -11.234 5.755 1.00 0.00 C ATOM 2040 O ASP A 129 -5.939 -10.111 5.751 1.00 0.00 O ATOM 2041 CB ASP A 129 -6.850 -11.519 8.199 1.00 0.00 C ATOM 2042 CG ASP A 129 -8.341 -11.733 8.329 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -8.735 -12.802 8.839 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -9.118 -10.833 7.952 1.00 0.00 O ATOM 0 H ASP A 129 -4.308 -11.673 7.496 1.00 0.00 H new ATOM 0 HA ASP A 129 -6.805 -13.087 6.750 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.350 -11.932 9.075 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.641 -10.449 8.187 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.136 -11.722 4.744 1.00 0.00 N ATOM 2050 CA GLU A 130 -7.281 -10.992 3.505 1.00 0.00 C ATOM 2051 C GLU A 130 -8.444 -10.001 3.562 1.00 0.00 C ATOM 2052 O GLU A 130 -9.578 -10.360 3.882 1.00 0.00 O ATOM 2053 CB GLU A 130 -7.461 -11.961 2.334 1.00 0.00 C ATOM 2054 CG GLU A 130 -8.746 -12.774 2.374 1.00 0.00 C ATOM 2055 CD GLU A 130 -8.954 -13.597 1.118 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -9.267 -13.008 0.057 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -8.810 -14.837 1.181 1.00 0.00 O ATOM 0 H GLU A 130 -7.608 -12.626 4.759 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.368 -10.417 3.353 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -7.435 -11.394 1.403 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.614 -12.646 2.314 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -8.726 -13.437 3.239 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -9.593 -12.101 2.508 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.143 -8.753 3.260 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.154 -7.726 3.132 1.00 0.00 C ATOM 2066 C GLU A 131 -9.407 -7.475 1.649 1.00 0.00 C ATOM 2067 O GLU A 131 -8.460 -7.395 0.859 1.00 0.00 O ATOM 2068 CB GLU A 131 -8.694 -6.447 3.832 1.00 0.00 C ATOM 2069 CG GLU A 131 -9.771 -5.386 3.933 1.00 0.00 C ATOM 2070 CD GLU A 131 -11.017 -5.886 4.634 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -11.025 -5.945 5.881 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -12.000 -6.211 3.936 1.00 0.00 O ATOM 0 H GLU A 131 -7.191 -8.424 3.097 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.081 -8.050 3.606 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.348 -6.697 4.835 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -7.841 -6.035 3.293 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -9.377 -4.524 4.471 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -10.034 -5.044 2.932 1.00 0.00 H new ATOM 2079 N GLU A 132 -10.671 -7.361 1.271 1.00 0.00 N ATOM 2080 CA GLU A 132 -11.034 -7.314 -0.136 1.00 0.00 C ATOM 2081 C GLU A 132 -10.862 -5.912 -0.712 1.00 0.00 C ATOM 2082 O GLU A 132 -11.201 -4.916 -0.067 1.00 0.00 O ATOM 2083 CB GLU A 132 -12.472 -7.785 -0.325 1.00 0.00 C ATOM 2084 CG GLU A 132 -12.758 -8.281 -1.729 1.00 0.00 C ATOM 2085 CD GLU A 132 -11.835 -9.414 -2.133 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -12.064 -10.557 -1.692 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -10.867 -9.169 -2.886 1.00 0.00 O ATOM 0 H GLU A 132 -11.459 -7.300 1.916 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.363 -7.982 -0.675 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.682 -8.584 0.386 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.150 -6.964 -0.091 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.793 -8.618 -1.790 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.649 -7.456 -2.434 1.00 0.00 H new ATOM 2094 N ILE A 133 -10.352 -5.853 -1.936 1.00 0.00 N ATOM 2095 CA ILE A 133 -10.066 -4.589 -2.600 1.00 0.00 C ATOM 2096 C ILE A 133 -11.252 -4.140 -3.444 1.00 0.00 C ATOM 2097 O ILE A 133 -11.651 -4.819 -4.394 1.00 0.00 O ATOM 2098 CB ILE A 133 -8.821 -4.701 -3.513 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -7.584 -5.110 -2.707 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -8.569 -3.386 -4.241 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -7.109 -4.061 -1.727 1.00 0.00 C ATOM 0 H ILE A 133 -10.126 -6.677 -2.494 1.00 0.00 H new ATOM 0 HA ILE A 133 -9.872 -3.855 -1.818 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.017 -5.476 -4.254 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.806 -6.027 -2.161 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -6.773 -5.339 -3.398 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.690 -3.485 -4.878 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -9.435 -3.138 -4.855 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.402 -2.593 -3.512 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -6.230 -4.429 -1.198 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -6.852 -3.149 -2.266 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -7.902 -3.848 -1.010 1.00 0.00 H new ATOM 2113 N ILE A 134 -11.817 -3.002 -3.082 1.00 0.00 N ATOM 2114 CA ILE A 134 -12.901 -2.414 -3.846 1.00 0.00 C ATOM 2115 C ILE A 134 -12.361 -1.285 -4.715 1.00 0.00 C ATOM 2116 O ILE A 134 -11.742 -0.347 -4.207 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.012 -1.861 -2.926 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -14.496 -2.944 -1.955 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.173 -1.322 -3.756 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -15.075 -4.168 -2.633 1.00 0.00 C ATOM 0 H ILE A 134 -11.541 -2.465 -2.260 1.00 0.00 H new ATOM 0 HA ILE A 134 -13.333 -3.197 -4.469 1.00 0.00 H new ATOM 0 HB ILE A 134 -13.599 -1.039 -2.341 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -13.661 -3.251 -1.325 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -15.251 -2.515 -1.296 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -15.947 -0.936 -3.092 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -14.817 -0.520 -4.402 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -15.586 -2.124 -4.367 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -15.394 -4.886 -1.877 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -15.932 -3.876 -3.241 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.317 -4.624 -3.270 1.00 0.00 H new ATOM 2132 N LEU A 135 -12.581 -1.379 -6.019 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.107 -0.358 -6.942 1.00 0.00 C ATOM 2134 C LEU A 135 -13.163 0.719 -7.138 1.00 0.00 C ATOM 2135 O LEU A 135 -14.319 0.424 -7.450 1.00 0.00 O ATOM 2136 CB LEU A 135 -11.733 -0.972 -8.294 1.00 0.00 C ATOM 2137 CG LEU A 135 -10.536 -1.924 -8.269 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -10.198 -2.391 -9.675 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -9.332 -1.248 -7.638 1.00 0.00 C ATOM 0 H LEU A 135 -13.083 -2.149 -6.460 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.216 0.095 -6.508 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -12.597 -1.511 -8.682 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.520 -0.165 -8.995 1.00 0.00 H new ATOM 0 HG LEU A 135 -10.802 -2.793 -7.668 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.344 -3.067 -9.638 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.055 -2.912 -10.101 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -9.952 -1.529 -10.295 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.490 -1.940 -7.629 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.068 -0.362 -8.216 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -9.573 -0.956 -6.616 1.00 0.00 H new ATOM 2151 N LYS A 136 -12.764 1.965 -6.944 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.675 3.085 -7.097 1.00 0.00 C ATOM 2153 C LYS A 136 -13.332 3.884 -8.348 1.00 0.00 C ATOM 2154 O LYS A 136 -12.228 3.767 -8.885 1.00 0.00 O ATOM 2155 CB LYS A 136 -13.629 3.982 -5.863 1.00 0.00 C ATOM 2156 CG LYS A 136 -14.994 4.484 -5.410 1.00 0.00 C ATOM 2157 CD LYS A 136 -15.837 3.403 -4.732 1.00 0.00 C ATOM 2158 CE LYS A 136 -16.340 2.346 -5.704 1.00 0.00 C ATOM 2159 NZ LYS A 136 -17.283 1.396 -5.057 1.00 0.00 N ATOM 0 H LYS A 136 -11.814 2.226 -6.680 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.687 2.694 -7.203 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -13.166 3.432 -5.044 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -12.990 4.839 -6.073 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -14.857 5.316 -4.719 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -15.536 4.871 -6.272 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -15.244 2.921 -3.955 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -16.689 3.870 -4.239 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -16.836 2.833 -6.544 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -15.492 1.795 -6.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -17.601 0.693 -5.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -16.803 0.912 -4.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -18.105 1.918 -4.692 1.00 0.00 H new ATOM 2173 N GLU A 137 -14.279 4.702 -8.793 1.00 0.00 N ATOM 2174 CA GLU A 137 -14.154 5.417 -10.054 1.00 0.00 C ATOM 2175 C GLU A 137 -13.158 6.557 -9.971 1.00 0.00 C ATOM 2176 O GLU A 137 -12.481 6.887 -10.946 1.00 0.00 O ATOM 2177 CB GLU A 137 -15.502 6.018 -10.441 1.00 0.00 C ATOM 2178 CG GLU A 137 -16.681 5.058 -10.389 1.00 0.00 C ATOM 2179 CD GLU A 137 -17.199 4.859 -8.978 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -17.817 5.798 -8.430 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -16.961 3.777 -8.402 1.00 0.00 O ATOM 0 H GLU A 137 -15.149 4.886 -8.293 1.00 0.00 H new ATOM 0 HA GLU A 137 -13.809 4.693 -10.792 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -15.710 6.859 -9.779 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -15.426 6.419 -11.452 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -17.485 5.439 -11.018 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -16.381 4.095 -10.803 1.00 0.00 H new ATOM 2188 N GLU A 138 -13.056 7.121 -8.790 1.00 0.00 N ATOM 2189 CA GLU A 138 -12.237 8.308 -8.564 1.00 0.00 C ATOM 2190 C GLU A 138 -12.267 8.690 -7.085 1.00 0.00 C ATOM 2191 O GLU A 138 -13.124 8.211 -6.332 1.00 0.00 O ATOM 2192 CB GLU A 138 -12.752 9.467 -9.436 1.00 0.00 C ATOM 2193 CG GLU A 138 -11.870 10.705 -9.427 1.00 0.00 C ATOM 2194 CD GLU A 138 -10.417 10.387 -9.717 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -10.056 10.245 -10.905 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -9.633 10.280 -8.755 1.00 0.00 O ATOM 0 H GLU A 138 -13.533 6.778 -7.956 1.00 0.00 H new ATOM 0 HA GLU A 138 -11.205 8.094 -8.842 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -12.852 9.115 -10.463 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -13.750 9.745 -9.096 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -12.238 11.414 -10.168 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -11.944 11.193 -8.455 1.00 0.00 H new ATOM 2203 N LEU A 139 -11.321 9.530 -6.672 1.00 0.00 N ATOM 2204 CA LEU A 139 -11.212 9.962 -5.286 1.00 0.00 C ATOM 2205 C LEU A 139 -12.496 10.628 -4.813 1.00 0.00 C ATOM 2206 O LEU A 139 -13.192 11.279 -5.597 1.00 0.00 O ATOM 2207 CB LEU A 139 -10.031 10.917 -5.120 1.00 0.00 C ATOM 2208 CG LEU A 139 -8.667 10.306 -5.437 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -7.575 11.353 -5.306 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -8.382 9.121 -4.526 1.00 0.00 C ATOM 0 H LEU A 139 -10.612 9.928 -7.288 1.00 0.00 H new ATOM 0 HA LEU A 139 -11.044 9.078 -4.671 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -10.186 11.781 -5.766 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -10.020 11.285 -4.094 1.00 0.00 H new ATOM 0 HG LEU A 139 -8.683 9.948 -6.466 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.609 10.902 -5.535 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -7.768 12.169 -6.002 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -7.562 11.740 -4.287 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.406 8.702 -4.769 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -8.386 9.451 -3.487 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -9.149 8.360 -4.668 1.00 0.00 H new ATOM 2222 N GLU A 140 -12.790 10.433 -3.525 1.00 0.00 N ATOM 2223 CA GLU A 140 -14.019 10.907 -2.860 1.00 0.00 C ATOM 2224 C GLU A 140 -15.297 10.636 -3.675 1.00 0.00 C ATOM 2225 O GLU A 140 -16.333 11.265 -3.443 1.00 0.00 O ATOM 2226 CB GLU A 140 -13.920 12.399 -2.487 1.00 0.00 C ATOM 2227 CG GLU A 140 -13.964 13.368 -3.660 1.00 0.00 C ATOM 2228 CD GLU A 140 -14.016 14.812 -3.210 1.00 0.00 C ATOM 2229 OE1 GLU A 140 -15.071 15.237 -2.690 1.00 0.00 O ATOM 2230 OE2 GLU A 140 -13.006 15.529 -3.374 1.00 0.00 O ATOM 0 H GLU A 140 -12.167 9.928 -2.894 1.00 0.00 H new ATOM 0 HA GLU A 140 -14.102 10.322 -1.944 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -14.736 12.641 -1.806 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -12.991 12.559 -1.940 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -13.085 13.216 -4.287 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -14.836 13.150 -4.276 1.00 0.00 H new ATOM 2237 N HIS A 141 -15.244 9.681 -4.595 1.00 0.00 N ATOM 2238 CA HIS A 141 -16.418 9.334 -5.389 1.00 0.00 C ATOM 2239 C HIS A 141 -16.748 7.856 -5.233 1.00 0.00 C ATOM 2240 O HIS A 141 -16.301 7.027 -6.017 1.00 0.00 O ATOM 2241 CB HIS A 141 -16.194 9.662 -6.870 1.00 0.00 C ATOM 2242 CG HIS A 141 -17.448 9.618 -7.696 1.00 0.00 C ATOM 2243 ND1 HIS A 141 -17.908 8.481 -8.329 1.00 0.00 N ATOM 2244 CD2 HIS A 141 -18.338 10.593 -7.994 1.00 0.00 C ATOM 2245 CE1 HIS A 141 -19.022 8.763 -8.979 1.00 0.00 C ATOM 2246 NE2 HIS A 141 -19.307 10.038 -8.790 1.00 0.00 N ATOM 0 H HIS A 141 -14.409 9.136 -4.809 1.00 0.00 H new ATOM 0 HA HIS A 141 -17.257 9.927 -5.024 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -15.752 10.655 -6.950 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -15.472 8.958 -7.284 1.00 0.00 H new ATOM 0 HD1 HIS A 141 -17.458 7.566 -8.299 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -18.293 11.621 -7.665 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -19.603 8.067 -9.567 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -20.115 10.529 -9.173 1.00 0.00 H new ATOM 2255 N HIS A 142 -17.530 7.535 -4.215 1.00 0.00 N ATOM 2256 CA HIS A 142 -17.867 6.148 -3.912 1.00 0.00 C ATOM 2257 C HIS A 142 -19.259 5.818 -4.443 1.00 0.00 C ATOM 2258 O HIS A 142 -20.053 5.169 -3.761 1.00 0.00 O ATOM 2259 CB HIS A 142 -17.813 5.908 -2.397 1.00 0.00 C ATOM 2260 CG HIS A 142 -16.504 6.276 -1.761 1.00 0.00 C ATOM 2261 ND1 HIS A 142 -16.401 7.199 -0.744 1.00 0.00 N ATOM 2262 CD2 HIS A 142 -15.243 5.838 -1.993 1.00 0.00 C ATOM 2263 CE1 HIS A 142 -15.138 7.316 -0.380 1.00 0.00 C ATOM 2264 NE2 HIS A 142 -14.414 6.501 -1.121 1.00 0.00 N ATOM 0 H HIS A 142 -17.946 8.217 -3.581 1.00 0.00 H new ATOM 0 HA HIS A 142 -17.140 5.497 -4.398 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -18.609 6.481 -1.921 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -18.017 4.855 -2.200 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -14.945 5.104 -2.727 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -14.761 7.969 0.394 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -13.403 6.382 -1.057 1.00 0.00 H new ATOM 2273 N HIS A 143 -19.511 6.222 -5.690 1.00 0.00 N ATOM 2274 CA HIS A 143 -20.854 6.207 -6.274 1.00 0.00 C ATOM 2275 C HIS A 143 -21.781 7.126 -5.490 1.00 0.00 C ATOM 2276 O HIS A 143 -22.473 6.700 -4.565 1.00 0.00 O ATOM 2277 CB HIS A 143 -21.447 4.794 -6.365 1.00 0.00 C ATOM 2278 CG HIS A 143 -20.862 3.971 -7.470 1.00 0.00 C ATOM 2279 ND1 HIS A 143 -20.289 2.736 -7.267 1.00 0.00 N ATOM 2280 CD2 HIS A 143 -20.776 4.210 -8.798 1.00 0.00 C ATOM 2281 CE1 HIS A 143 -19.873 2.253 -8.424 1.00 0.00 C ATOM 2282 NE2 HIS A 143 -20.157 3.128 -9.371 1.00 0.00 N ATOM 0 H HIS A 143 -18.790 6.569 -6.323 1.00 0.00 H new ATOM 0 HA HIS A 143 -20.761 6.574 -7.296 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -21.288 4.280 -5.417 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -22.525 4.869 -6.510 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -21.130 5.091 -9.313 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -19.383 1.302 -8.571 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -19.950 3.018 -10.364 1.00 0.00 H new ATOM 2291 N HIS A 144 -21.761 8.398 -5.861 1.00 0.00 N ATOM 2292 CA HIS A 144 -22.553 9.421 -5.197 1.00 0.00 C ATOM 2293 C HIS A 144 -22.715 10.615 -6.130 1.00 0.00 C ATOM 2294 O HIS A 144 -22.021 11.623 -5.987 1.00 0.00 O ATOM 2295 CB HIS A 144 -21.894 9.849 -3.874 1.00 0.00 C ATOM 2296 CG HIS A 144 -22.677 10.862 -3.090 1.00 0.00 C ATOM 2297 ND1 HIS A 144 -22.253 12.160 -2.904 1.00 0.00 N ATOM 2298 CD2 HIS A 144 -23.854 10.756 -2.430 1.00 0.00 C ATOM 2299 CE1 HIS A 144 -23.132 12.806 -2.165 1.00 0.00 C ATOM 2300 NE2 HIS A 144 -24.112 11.978 -1.867 1.00 0.00 N ATOM 0 H HIS A 144 -21.194 8.750 -6.632 1.00 0.00 H new ATOM 0 HA HIS A 144 -23.536 9.015 -4.960 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -21.744 8.965 -3.254 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -20.907 10.258 -4.090 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -24.473 9.874 -2.360 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -23.061 13.838 -1.856 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -24.932 12.210 -1.307 1.00 0.00 H new ATOM 2309 N HIS A 145 -23.598 10.451 -7.117 1.00 0.00 N ATOM 2310 CA HIS A 145 -23.888 11.483 -8.118 1.00 0.00 C ATOM 2311 C HIS A 145 -22.682 11.720 -9.042 1.00 0.00 C ATOM 2312 O HIS A 145 -21.536 11.473 -8.670 1.00 0.00 O ATOM 2313 CB HIS A 145 -24.323 12.788 -7.432 1.00 0.00 C ATOM 2314 CG HIS A 145 -24.917 13.802 -8.362 1.00 0.00 C ATOM 2315 ND1 HIS A 145 -24.536 15.125 -8.380 1.00 0.00 N ATOM 2316 CD2 HIS A 145 -25.874 13.678 -9.310 1.00 0.00 C ATOM 2317 CE1 HIS A 145 -25.232 15.767 -9.298 1.00 0.00 C ATOM 2318 NE2 HIS A 145 -26.052 14.912 -9.882 1.00 0.00 N ATOM 0 H HIS A 145 -24.136 9.594 -7.246 1.00 0.00 H new ATOM 0 HA HIS A 145 -24.711 11.130 -8.740 1.00 0.00 H new ATOM 0 HB2 HIS A 145 -25.051 12.552 -6.656 1.00 0.00 H new ATOM 0 HB3 HIS A 145 -23.459 13.229 -6.935 1.00 0.00 H new ATOM 0 HD2 HIS A 145 -26.402 12.772 -9.569 1.00 0.00 H new ATOM 0 HE1 HIS A 145 -25.146 16.818 -9.533 1.00 0.00 H new ATOM 0 HE2 HIS A 145 -26.707 15.132 -10.632 1.00 0.00 H new ATOM 2327 N HIS A 146 -22.945 12.170 -10.262 1.00 0.00 N ATOM 2328 CA HIS A 146 -21.876 12.462 -11.208 1.00 0.00 C ATOM 2329 C HIS A 146 -21.632 13.969 -11.281 1.00 0.00 C ATOM 2330 O HIS A 146 -20.835 14.482 -10.472 1.00 0.00 O ATOM 2331 CB HIS A 146 -22.229 11.906 -12.594 1.00 0.00 C ATOM 2332 CG HIS A 146 -21.138 12.048 -13.613 1.00 0.00 C ATOM 2333 ND1 HIS A 146 -20.975 13.170 -14.391 1.00 0.00 N ATOM 2334 CD2 HIS A 146 -20.165 11.189 -13.997 1.00 0.00 C ATOM 2335 CE1 HIS A 146 -19.955 12.996 -15.208 1.00 0.00 C ATOM 2336 NE2 HIS A 146 -19.444 11.800 -14.991 1.00 0.00 N ATOM 2337 OXT HIS A 146 -22.244 14.635 -12.142 1.00 0.00 O ATOM 0 H HIS A 146 -23.885 12.340 -10.619 1.00 0.00 H new ATOM 0 HA HIS A 146 -20.961 11.980 -10.865 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -22.482 10.850 -12.495 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -23.121 12.415 -12.960 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -19.989 10.203 -13.594 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -19.598 13.712 -15.933 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -18.645 11.396 -15.481 1.00 0.00 H new TER 2346 HIS A 146