USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 759 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 53 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 107 HIS : no HD1:sc= -0.118 X(o=-0.12,f=-0.0099) USER MOD Set 2.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -28:sc= 0.0484 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= 0.503 K(o=0.5,f=-4.2!) USER MOD Single : A 55 SER OG : rot -51:sc= 1.28 USER MOD Single : A 66 ASN : amide:sc= -1.2 K(o=-1.2,f=-0.068) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl -137:sc= 0 (180deg=-0.05) USER MOD Single : A 71 SER OG : rot -99:sc= 0.556 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.0111 X(o=-0.011,f=0) USER MOD Single : A 75 GLN : amide:sc= 0.779 K(o=0.78,f=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -0.13 X(o=-0.13,f=0) USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 MET CE :methyl -125:sc= -0.108 (180deg=-0.404) USER MOD Single : A 116 ASN : amide:sc= 0.117 K(o=0.12,f=-4.9!) USER MOD Single : A 118 SER OG : rot 84:sc= 1.56 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot -7:sc= 1.25 USER MOD Single : A 127 SER OG : rot 180:sc= 0.0236 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 LYS NZ :NH3+ -168:sc= 0.959 (180deg=0.757) USER MOD Single : A 137 SER OG : rot 180:sc= 0.0283 USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 0.811 -6.336 8.457 1.00 0.00 N ATOM 49 CA THR A 36 -0.529 -6.318 7.843 1.00 0.00 C ATOM 50 C THR A 36 -0.866 -4.955 7.245 1.00 0.00 C ATOM 51 O THR A 36 -0.322 -3.932 7.659 1.00 0.00 O ATOM 52 CB THR A 36 -1.595 -6.789 8.841 1.00 0.00 C ATOM 53 OG1 THR A 36 -2.799 -7.020 8.145 1.00 0.00 O ATOM 54 CG2 THR A 36 -1.865 -5.791 9.971 1.00 0.00 C ATOM 0 HA THR A 36 -0.521 -7.024 7.013 1.00 0.00 H new ATOM 0 HB THR A 36 -1.211 -7.697 9.305 1.00 0.00 H new ATOM 0 HG1 THR A 36 -3.487 -7.323 8.773 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.629 -6.193 10.636 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.947 -5.621 10.534 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.211 -4.848 9.548 1.00 0.00 H new ATOM 62 N PHE A 37 -1.764 -4.962 6.259 1.00 0.00 N ATOM 63 CA PHE A 37 -2.116 -3.823 5.406 1.00 0.00 C ATOM 64 C PHE A 37 -3.641 -3.627 5.360 1.00 0.00 C ATOM 65 O PHE A 37 -4.391 -4.589 5.184 1.00 0.00 O ATOM 66 CB PHE A 37 -1.532 -4.096 4.006 1.00 0.00 C ATOM 67 CG PHE A 37 -1.354 -2.934 3.046 1.00 0.00 C ATOM 68 CD1 PHE A 37 -1.023 -1.644 3.499 1.00 0.00 C ATOM 69 CD2 PHE A 37 -1.384 -3.186 1.661 1.00 0.00 C ATOM 70 CE1 PHE A 37 -0.679 -0.635 2.587 1.00 0.00 C ATOM 71 CE2 PHE A 37 -1.091 -2.162 0.745 1.00 0.00 C ATOM 72 CZ PHE A 37 -0.724 -0.888 1.206 1.00 0.00 C ATOM 0 H PHE A 37 -2.292 -5.802 6.021 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.699 -2.898 5.805 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.557 -4.564 4.141 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.173 -4.831 3.519 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.034 -1.429 4.557 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.634 -4.173 1.301 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -0.379 0.338 2.947 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -1.148 -2.355 -0.316 1.00 0.00 H new ATOM 0 HZ PHE A 37 -0.478 -0.106 0.503 1.00 0.00 H new ATOM 82 N SER A 38 -4.116 -2.392 5.534 1.00 0.00 N ATOM 83 CA SER A 38 -5.546 -2.071 5.679 1.00 0.00 C ATOM 84 C SER A 38 -5.974 -0.769 4.954 1.00 0.00 C ATOM 85 O SER A 38 -5.134 0.119 4.753 1.00 0.00 O ATOM 86 CB SER A 38 -5.909 -2.014 7.174 1.00 0.00 C ATOM 87 OG SER A 38 -5.254 -0.955 7.860 1.00 0.00 O ATOM 0 H SER A 38 -3.512 -1.571 5.579 1.00 0.00 H new ATOM 0 HA SER A 38 -6.102 -2.869 5.188 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.988 -1.895 7.277 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.646 -2.962 7.643 1.00 0.00 H new ATOM 0 HG SER A 38 -4.402 -0.757 7.419 1.00 0.00 H new ATOM 93 N PRO A 39 -7.262 -0.616 4.568 1.00 0.00 N ATOM 94 CA PRO A 39 -8.331 -1.618 4.638 1.00 0.00 C ATOM 95 C PRO A 39 -8.071 -2.783 3.681 1.00 0.00 C ATOM 96 O PRO A 39 -7.315 -2.645 2.722 1.00 0.00 O ATOM 97 CB PRO A 39 -9.617 -0.886 4.238 1.00 0.00 C ATOM 98 CG PRO A 39 -9.112 0.217 3.312 1.00 0.00 C ATOM 99 CD PRO A 39 -7.762 0.591 3.921 1.00 0.00 C ATOM 0 HA PRO A 39 -8.395 -2.046 5.639 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.318 -1.549 3.731 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -10.136 -0.478 5.106 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -9.007 -0.135 2.286 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.793 1.068 3.289 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -7.070 0.936 3.153 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.870 1.403 4.641 1.00 0.00 H new ATOM 107 N ALA A 40 -8.718 -3.927 3.928 1.00 0.00 N ATOM 108 CA ALA A 40 -8.623 -5.102 3.053 1.00 0.00 C ATOM 109 C ALA A 40 -9.084 -4.809 1.609 1.00 0.00 C ATOM 110 O ALA A 40 -8.558 -5.404 0.668 1.00 0.00 O ATOM 111 CB ALA A 40 -9.437 -6.238 3.687 1.00 0.00 C ATOM 0 H ALA A 40 -9.322 -4.065 4.739 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.577 -5.395 2.967 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.381 -7.123 3.053 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.032 -6.470 4.672 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.477 -5.928 3.787 1.00 0.00 H new ATOM 117 N LEU A 41 -10.004 -3.853 1.434 1.00 0.00 N ATOM 118 CA LEU A 41 -10.417 -3.294 0.146 1.00 0.00 C ATOM 119 C LEU A 41 -10.637 -1.784 0.303 1.00 0.00 C ATOM 120 O LEU A 41 -11.467 -1.357 1.111 1.00 0.00 O ATOM 121 CB LEU A 41 -11.688 -4.020 -0.345 1.00 0.00 C ATOM 122 CG LEU A 41 -12.357 -3.394 -1.592 1.00 0.00 C ATOM 123 CD1 LEU A 41 -11.444 -3.384 -2.828 1.00 0.00 C ATOM 124 CD2 LEU A 41 -13.646 -4.159 -1.923 1.00 0.00 C ATOM 0 H LEU A 41 -10.500 -3.432 2.220 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.642 -3.444 -0.606 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.433 -5.056 -0.569 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.414 -4.039 0.468 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.573 -2.355 -1.344 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -11.973 -2.932 -3.667 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.545 -2.806 -2.612 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.165 -4.407 -3.083 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.116 -3.717 -2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.408 -5.203 -2.126 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.331 -4.101 -1.077 1.00 0.00 H new ATOM 136 N LEU A 42 -9.924 -0.984 -0.490 1.00 0.00 N ATOM 137 CA LEU A 42 -10.124 0.460 -0.626 1.00 0.00 C ATOM 138 C LEU A 42 -10.800 0.754 -1.970 1.00 0.00 C ATOM 139 O LEU A 42 -10.282 0.354 -3.013 1.00 0.00 O ATOM 140 CB LEU A 42 -8.749 1.148 -0.522 1.00 0.00 C ATOM 141 CG LEU A 42 -8.767 2.684 -0.638 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.643 3.354 0.431 1.00 0.00 C ATOM 143 CD2 LEU A 42 -7.331 3.207 -0.506 1.00 0.00 C ATOM 0 H LEU A 42 -9.166 -1.335 -1.075 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.771 0.843 0.163 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.298 0.878 0.433 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.102 0.749 -1.304 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.195 2.933 -1.609 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.616 4.436 0.298 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.670 3.002 0.333 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.266 3.101 1.422 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -7.331 4.294 -0.587 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.925 2.915 0.462 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.715 2.784 -1.300 1.00 0.00 H new ATOM 155 N VAL A 43 -11.923 1.474 -1.955 1.00 0.00 N ATOM 156 CA VAL A 43 -12.607 1.960 -3.166 1.00 0.00 C ATOM 157 C VAL A 43 -12.431 3.478 -3.260 1.00 0.00 C ATOM 158 O VAL A 43 -12.792 4.202 -2.333 1.00 0.00 O ATOM 159 CB VAL A 43 -14.110 1.587 -3.203 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.721 1.938 -4.572 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.337 0.088 -2.931 1.00 0.00 C ATOM 0 H VAL A 43 -12.394 1.743 -1.091 1.00 0.00 H new ATOM 0 HA VAL A 43 -12.151 1.469 -4.026 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.597 2.163 -2.416 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.777 1.669 -4.579 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.618 3.008 -4.753 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.201 1.386 -5.355 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.404 -0.131 -2.966 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.821 -0.502 -3.689 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.947 -0.166 -1.945 1.00 0.00 H new ATOM 171 N VAL A 44 -11.881 3.945 -4.381 1.00 0.00 N ATOM 172 CA VAL A 44 -11.760 5.377 -4.736 1.00 0.00 C ATOM 173 C VAL A 44 -12.326 5.659 -6.135 1.00 0.00 C ATOM 174 O VAL A 44 -12.595 4.725 -6.885 1.00 0.00 O ATOM 175 CB VAL A 44 -10.297 5.875 -4.668 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.726 5.757 -3.247 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.384 5.161 -5.679 1.00 0.00 C ATOM 0 H VAL A 44 -11.493 3.327 -5.094 1.00 0.00 H new ATOM 0 HA VAL A 44 -12.345 5.922 -3.995 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.321 6.930 -4.942 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.697 6.116 -3.237 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -10.326 6.357 -2.563 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.749 4.714 -2.931 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.369 5.548 -5.589 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.383 4.090 -5.476 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.752 5.338 -6.690 1.00 0.00 H new ATOM 187 N THR A 45 -12.464 6.941 -6.493 1.00 0.00 N ATOM 188 CA THR A 45 -12.865 7.418 -7.830 1.00 0.00 C ATOM 189 C THR A 45 -11.634 7.819 -8.644 1.00 0.00 C ATOM 190 O THR A 45 -10.623 8.242 -8.082 1.00 0.00 O ATOM 191 CB THR A 45 -13.829 8.610 -7.701 1.00 0.00 C ATOM 192 OG1 THR A 45 -14.854 8.286 -6.782 1.00 0.00 O ATOM 193 CG2 THR A 45 -14.510 8.979 -9.024 1.00 0.00 C ATOM 0 H THR A 45 -12.294 7.705 -5.839 1.00 0.00 H new ATOM 0 HA THR A 45 -13.376 6.608 -8.350 1.00 0.00 H new ATOM 0 HB THR A 45 -13.227 9.457 -7.371 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.469 9.045 -6.697 1.00 0.00 H new ATOM 0 HG21 THR A 45 -15.177 9.827 -8.866 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.753 9.246 -9.761 1.00 0.00 H new ATOM 0 HG23 THR A 45 -15.085 8.127 -9.387 1.00 0.00 H new ATOM 201 N GLU A 46 -11.710 7.717 -9.972 1.00 0.00 N ATOM 202 CA GLU A 46 -10.733 8.268 -10.900 1.00 0.00 C ATOM 203 C GLU A 46 -10.394 9.731 -10.558 1.00 0.00 C ATOM 204 O GLU A 46 -11.278 10.583 -10.430 1.00 0.00 O ATOM 205 CB GLU A 46 -11.320 8.207 -12.314 1.00 0.00 C ATOM 206 CG GLU A 46 -11.054 6.905 -13.069 1.00 0.00 C ATOM 207 CD GLU A 46 -11.399 7.086 -14.555 1.00 0.00 C ATOM 208 OE1 GLU A 46 -12.581 7.352 -14.873 1.00 0.00 O1- ATOM 209 OE2 GLU A 46 -10.481 6.977 -15.401 1.00 0.00 O ATOM 0 H GLU A 46 -12.477 7.234 -10.440 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.816 7.683 -10.830 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -12.398 8.359 -12.251 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.915 9.035 -12.895 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.008 6.619 -12.961 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -11.651 6.098 -12.643 1.00 0.00 H new ATOM 216 N GLY A 47 -9.096 10.015 -10.425 1.00 0.00 N ATOM 217 CA GLY A 47 -8.549 11.324 -10.064 1.00 0.00 C ATOM 218 C GLY A 47 -8.457 11.585 -8.557 1.00 0.00 C ATOM 219 O GLY A 47 -7.970 12.650 -8.176 1.00 0.00 O ATOM 0 H GLY A 47 -8.371 9.313 -10.571 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.553 11.419 -10.497 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.168 12.099 -10.516 1.00 0.00 H new ATOM 223 N ASP A 48 -8.882 10.655 -7.698 1.00 0.00 N ATOM 224 CA ASP A 48 -8.713 10.760 -6.241 1.00 0.00 C ATOM 225 C ASP A 48 -7.374 10.152 -5.771 1.00 0.00 C ATOM 226 O ASP A 48 -6.755 9.340 -6.466 1.00 0.00 O ATOM 227 CB ASP A 48 -9.918 10.108 -5.540 1.00 0.00 C ATOM 228 CG ASP A 48 -10.011 10.404 -4.031 1.00 0.00 C ATOM 229 OD1 ASP A 48 -9.562 11.490 -3.591 1.00 0.00 O ATOM 230 OD2 ASP A 48 -10.563 9.553 -3.297 1.00 0.00 O1- ATOM 0 H ASP A 48 -9.356 9.801 -7.993 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.677 11.814 -5.967 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.833 10.451 -6.023 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.867 9.029 -5.684 1.00 0.00 H new ATOM 235 N ASN A 49 -6.932 10.540 -4.573 1.00 0.00 N ATOM 236 CA ASN A 49 -5.738 10.002 -3.917 1.00 0.00 C ATOM 237 C ASN A 49 -6.124 8.841 -2.978 1.00 0.00 C ATOM 238 O ASN A 49 -6.882 9.028 -2.023 1.00 0.00 O ATOM 239 CB ASN A 49 -5.017 11.125 -3.152 1.00 0.00 C ATOM 240 CG ASN A 49 -4.623 12.311 -4.034 1.00 0.00 C ATOM 241 OD1 ASN A 49 -4.309 12.179 -5.211 1.00 0.00 O ATOM 242 ND2 ASN A 49 -4.632 13.514 -3.490 1.00 0.00 N ATOM 0 H ASN A 49 -7.405 11.254 -4.019 1.00 0.00 H new ATOM 0 HA ASN A 49 -5.055 9.608 -4.670 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -5.663 11.479 -2.349 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -4.121 10.717 -2.684 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -4.378 14.328 -4.049 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -4.893 13.629 -2.511 1.00 0.00 H new ATOM 249 N ALA A 50 -5.604 7.640 -3.243 1.00 0.00 N ATOM 250 CA ALA A 50 -5.858 6.427 -2.463 1.00 0.00 C ATOM 251 C ALA A 50 -4.719 6.173 -1.463 1.00 0.00 C ATOM 252 O ALA A 50 -3.578 5.986 -1.896 1.00 0.00 O ATOM 253 CB ALA A 50 -5.996 5.256 -3.448 1.00 0.00 C ATOM 0 H ALA A 50 -4.975 7.480 -4.030 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.774 6.537 -1.882 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.186 4.336 -2.895 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.826 5.449 -4.128 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.074 5.151 -4.020 1.00 0.00 H new ATOM 259 N THR A 51 -5.018 6.128 -0.155 1.00 0.00 N ATOM 260 CA THR A 51 -4.022 5.871 0.901 1.00 0.00 C ATOM 261 C THR A 51 -4.445 4.699 1.779 1.00 0.00 C ATOM 262 O THR A 51 -5.537 4.702 2.348 1.00 0.00 O ATOM 263 CB THR A 51 -3.743 7.116 1.755 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.464 8.201 0.896 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.521 6.928 2.664 1.00 0.00 C ATOM 0 H THR A 51 -5.963 6.270 0.203 1.00 0.00 H new ATOM 0 HA THR A 51 -3.091 5.610 0.399 1.00 0.00 H new ATOM 0 HB THR A 51 -4.622 7.294 2.374 1.00 0.00 H new ATOM 0 HG1 THR A 51 -3.286 9.003 1.430 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.361 7.833 3.250 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.693 6.087 3.335 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.640 6.730 2.053 1.00 0.00 H new ATOM 273 N PHE A 52 -3.551 3.719 1.902 1.00 0.00 N ATOM 274 CA PHE A 52 -3.644 2.572 2.808 1.00 0.00 C ATOM 275 C PHE A 52 -2.744 2.768 4.042 1.00 0.00 C ATOM 276 O PHE A 52 -1.763 3.516 3.986 1.00 0.00 O ATOM 277 CB PHE A 52 -3.186 1.314 2.064 1.00 0.00 C ATOM 278 CG PHE A 52 -4.033 0.860 0.894 1.00 0.00 C ATOM 279 CD1 PHE A 52 -3.742 1.311 -0.408 1.00 0.00 C ATOM 280 CD2 PHE A 52 -5.061 -0.080 1.099 1.00 0.00 C ATOM 281 CE1 PHE A 52 -4.477 0.821 -1.502 1.00 0.00 C ATOM 282 CE2 PHE A 52 -5.796 -0.566 0.007 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.501 -0.118 -1.291 1.00 0.00 C ATOM 0 H PHE A 52 -2.697 3.702 1.344 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.678 2.475 3.139 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -2.172 1.485 1.702 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -3.134 0.496 2.782 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -2.955 2.033 -0.566 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -5.284 -0.427 2.097 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.255 1.165 -2.501 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -6.588 -1.284 0.164 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.064 -0.497 -2.131 1.00 0.00 H new ATOM 293 N THR A 53 -3.038 2.038 5.124 1.00 0.00 N ATOM 294 CA THR A 53 -2.262 2.004 6.375 1.00 0.00 C ATOM 295 C THR A 53 -1.643 0.621 6.549 1.00 0.00 C ATOM 296 O THR A 53 -2.354 -0.383 6.506 1.00 0.00 O ATOM 297 CB THR A 53 -3.170 2.335 7.567 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.772 3.596 7.350 1.00 0.00 O ATOM 299 CG2 THR A 53 -2.391 2.415 8.880 1.00 0.00 C ATOM 0 H THR A 53 -3.856 1.429 5.156 1.00 0.00 H new ATOM 0 HA THR A 53 -1.467 2.749 6.329 1.00 0.00 H new ATOM 0 HB THR A 53 -3.909 1.538 7.645 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.355 3.815 8.107 1.00 0.00 H new ATOM 0 HG21 THR A 53 -3.075 2.651 9.695 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.910 1.457 9.077 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.632 3.194 8.806 1.00 0.00 H new ATOM 307 N CYS A 54 -0.327 0.558 6.759 1.00 0.00 N ATOM 308 CA CYS A 54 0.432 -0.681 6.968 1.00 0.00 C ATOM 309 C CYS A 54 1.099 -0.706 8.348 1.00 0.00 C ATOM 310 O CYS A 54 1.816 0.223 8.717 1.00 0.00 O ATOM 311 CB CYS A 54 1.455 -0.855 5.837 1.00 0.00 C ATOM 312 SG CYS A 54 1.659 -2.586 5.352 1.00 0.00 S ATOM 0 H CYS A 54 0.260 1.392 6.790 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.258 -1.524 6.943 1.00 0.00 H new ATOM 0 HB2 CYS A 54 1.138 -0.273 4.972 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.417 -0.454 6.156 1.00 0.00 H new ATOM 317 N SER A 55 0.880 -1.771 9.113 1.00 0.00 N ATOM 318 CA SER A 55 1.298 -1.901 10.517 1.00 0.00 C ATOM 319 C SER A 55 2.265 -3.077 10.665 1.00 0.00 C ATOM 320 O SER A 55 2.049 -4.121 10.048 1.00 0.00 O ATOM 321 CB SER A 55 0.072 -2.147 11.413 1.00 0.00 C ATOM 322 OG SER A 55 -0.863 -1.080 11.348 1.00 0.00 O ATOM 0 H SER A 55 0.392 -2.597 8.768 1.00 0.00 H new ATOM 0 HA SER A 55 1.792 -0.977 10.820 1.00 0.00 H new ATOM 0 HB2 SER A 55 -0.416 -3.074 11.112 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.399 -2.279 12.444 1.00 0.00 H new ATOM 0 HG SER A 55 -0.401 -0.230 11.507 1.00 0.00 H new ATOM 328 N PHE A 56 3.322 -2.921 11.473 1.00 0.00 N ATOM 329 CA PHE A 56 4.439 -3.869 11.543 1.00 0.00 C ATOM 330 C PHE A 56 4.912 -4.179 12.971 1.00 0.00 C ATOM 331 O PHE A 56 4.816 -3.363 13.886 1.00 0.00 O ATOM 332 CB PHE A 56 5.622 -3.298 10.739 1.00 0.00 C ATOM 333 CG PHE A 56 5.548 -3.517 9.242 1.00 0.00 C ATOM 334 CD1 PHE A 56 4.859 -2.612 8.413 1.00 0.00 C ATOM 335 CD2 PHE A 56 6.213 -4.619 8.674 1.00 0.00 C ATOM 336 CE1 PHE A 56 4.858 -2.800 7.019 1.00 0.00 C ATOM 337 CE2 PHE A 56 6.222 -4.800 7.283 1.00 0.00 C ATOM 338 CZ PHE A 56 5.560 -3.883 6.455 1.00 0.00 C ATOM 0 H PHE A 56 3.426 -2.125 12.102 1.00 0.00 H new ATOM 0 HA PHE A 56 4.076 -4.809 11.128 1.00 0.00 H new ATOM 0 HB2 PHE A 56 5.688 -2.227 10.931 1.00 0.00 H new ATOM 0 HB3 PHE A 56 6.544 -3.746 11.111 1.00 0.00 H new ATOM 0 HD1 PHE A 56 4.332 -1.775 8.846 1.00 0.00 H new ATOM 0 HD2 PHE A 56 6.719 -5.329 9.312 1.00 0.00 H new ATOM 0 HE1 PHE A 56 4.319 -2.114 6.382 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.738 -5.644 6.851 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.588 -4.007 5.383 1.00 0.00 H new ATOM 424 N PHE A 63 15.507 -1.369 9.326 1.00 0.00 N ATOM 425 CA PHE A 63 15.024 -1.909 8.049 1.00 0.00 C ATOM 426 C PHE A 63 14.577 -0.827 7.051 1.00 0.00 C ATOM 427 O PHE A 63 14.267 0.303 7.431 1.00 0.00 O ATOM 428 CB PHE A 63 13.870 -2.906 8.323 1.00 0.00 C ATOM 429 CG PHE A 63 12.743 -2.380 9.195 1.00 0.00 C ATOM 430 CD1 PHE A 63 11.713 -1.598 8.637 1.00 0.00 C ATOM 431 CD2 PHE A 63 12.726 -2.673 10.574 1.00 0.00 C ATOM 432 CE1 PHE A 63 10.684 -1.102 9.457 1.00 0.00 C ATOM 433 CE2 PHE A 63 11.692 -2.183 11.390 1.00 0.00 C ATOM 434 CZ PHE A 63 10.671 -1.396 10.831 1.00 0.00 C ATOM 0 HA PHE A 63 15.864 -2.418 7.576 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.450 -3.220 7.367 1.00 0.00 H new ATOM 0 HB3 PHE A 63 14.287 -3.796 8.796 1.00 0.00 H new ATOM 0 HD1 PHE A 63 11.714 -1.379 7.579 1.00 0.00 H new ATOM 0 HD2 PHE A 63 13.511 -3.277 11.005 1.00 0.00 H new ATOM 0 HE1 PHE A 63 9.901 -0.493 9.029 1.00 0.00 H new ATOM 0 HE2 PHE A 63 11.682 -2.411 12.446 1.00 0.00 H new ATOM 0 HZ PHE A 63 9.877 -1.017 11.457 1.00 0.00 H new ATOM 444 N VAL A 64 14.511 -1.210 5.773 1.00 0.00 N ATOM 445 CA VAL A 64 13.871 -0.451 4.685 1.00 0.00 C ATOM 446 C VAL A 64 12.456 -1.007 4.523 1.00 0.00 C ATOM 447 O VAL A 64 12.274 -2.225 4.471 1.00 0.00 O ATOM 448 CB VAL A 64 14.631 -0.570 3.338 1.00 0.00 C ATOM 449 CG1 VAL A 64 13.943 0.246 2.228 1.00 0.00 C ATOM 450 CG2 VAL A 64 16.083 -0.079 3.476 1.00 0.00 C ATOM 0 H VAL A 64 14.916 -2.089 5.451 1.00 0.00 H new ATOM 0 HA VAL A 64 13.872 0.607 4.946 1.00 0.00 H new ATOM 0 HB VAL A 64 14.623 -1.626 3.067 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.502 0.140 1.298 1.00 0.00 H new ATOM 0 HG12 VAL A 64 12.927 -0.120 2.084 1.00 0.00 H new ATOM 0 HG13 VAL A 64 13.912 1.297 2.515 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.592 -0.174 2.517 1.00 0.00 H new ATOM 0 HG22 VAL A 64 16.086 0.966 3.786 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.601 -0.681 4.223 1.00 0.00 H new ATOM 460 N LEU A 65 11.457 -0.126 4.444 1.00 0.00 N ATOM 461 CA LEU A 65 10.064 -0.495 4.211 1.00 0.00 C ATOM 462 C LEU A 65 9.728 -0.289 2.733 1.00 0.00 C ATOM 463 O LEU A 65 9.710 0.839 2.250 1.00 0.00 O ATOM 464 CB LEU A 65 9.168 0.356 5.135 1.00 0.00 C ATOM 465 CG LEU A 65 7.850 -0.318 5.553 1.00 0.00 C ATOM 466 CD1 LEU A 65 6.972 -0.766 4.376 1.00 0.00 C ATOM 467 CD2 LEU A 65 8.129 -1.505 6.482 1.00 0.00 C ATOM 0 H LEU A 65 11.598 0.879 4.542 1.00 0.00 H new ATOM 0 HA LEU A 65 9.892 -1.546 4.444 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.732 0.608 6.033 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.936 1.294 4.630 1.00 0.00 H new ATOM 0 HG LEU A 65 7.281 0.448 6.080 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.063 -1.231 4.757 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.710 0.100 3.768 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.520 -1.485 3.767 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.187 -1.972 6.769 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.752 -2.234 5.964 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.647 -1.154 7.375 1.00 0.00 H new ATOM 479 N ASN A 66 9.460 -1.375 2.015 1.00 0.00 N ATOM 480 CA ASN A 66 9.117 -1.381 0.594 1.00 0.00 C ATOM 481 C ASN A 66 7.620 -1.665 0.385 1.00 0.00 C ATOM 482 O ASN A 66 7.009 -2.441 1.125 1.00 0.00 O ATOM 483 CB ASN A 66 9.972 -2.445 -0.108 1.00 0.00 C ATOM 484 CG ASN A 66 11.470 -2.198 0.035 1.00 0.00 C ATOM 485 OD1 ASN A 66 12.182 -2.927 0.712 1.00 0.00 O ATOM 486 ND2 ASN A 66 11.996 -1.160 -0.592 1.00 0.00 N ATOM 0 H ASN A 66 9.476 -2.311 2.420 1.00 0.00 H new ATOM 0 HA ASN A 66 9.321 -0.399 0.168 1.00 0.00 H new ATOM 0 HB2 ASN A 66 9.731 -3.425 0.303 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.713 -2.470 -1.167 1.00 0.00 H new ATOM 0 HD21 ASN A 66 12.994 -0.968 -0.511 1.00 0.00 H new ATOM 0 HD22 ASN A 66 11.403 -0.551 -1.157 1.00 0.00 H new ATOM 493 N TRP A 67 7.034 -1.055 -0.646 1.00 0.00 N ATOM 494 CA TRP A 67 5.640 -1.255 -1.050 1.00 0.00 C ATOM 495 C TRP A 67 5.557 -1.910 -2.435 1.00 0.00 C ATOM 496 O TRP A 67 6.285 -1.521 -3.353 1.00 0.00 O ATOM 497 CB TRP A 67 4.951 0.112 -1.043 1.00 0.00 C ATOM 498 CG TRP A 67 3.492 0.137 -1.379 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.592 -0.858 -1.202 1.00 0.00 C ATOM 500 CD2 TRP A 67 2.733 1.258 -1.915 1.00 0.00 C ATOM 501 NE1 TRP A 67 1.352 -0.453 -1.652 1.00 0.00 N ATOM 502 CE2 TRP A 67 1.375 0.855 -2.081 1.00 0.00 C ATOM 503 CE3 TRP A 67 3.061 2.591 -2.238 1.00 0.00 C ATOM 504 CZ2 TRP A 67 0.383 1.734 -2.537 1.00 0.00 C ATOM 505 CZ3 TRP A 67 2.072 3.486 -2.675 1.00 0.00 C ATOM 506 CH2 TRP A 67 0.740 3.063 -2.813 1.00 0.00 C ATOM 0 H TRP A 67 7.529 -0.390 -1.240 1.00 0.00 H new ATOM 0 HA TRP A 67 5.140 -1.929 -0.354 1.00 0.00 H new ATOM 0 HB2 TRP A 67 5.079 0.551 -0.054 1.00 0.00 H new ATOM 0 HB3 TRP A 67 5.473 0.758 -1.749 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.811 -1.824 -0.773 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.523 -1.047 -1.665 1.00 0.00 H new ATOM 0 HE3 TRP A 67 4.084 2.927 -2.148 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -0.634 1.396 -2.673 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 2.337 4.507 -2.907 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -0.015 3.765 -3.134 1.00 0.00 H new ATOM 517 N TYR A 68 4.670 -2.896 -2.589 1.00 0.00 N ATOM 518 CA TYR A 68 4.549 -3.730 -3.781 1.00 0.00 C ATOM 519 C TYR A 68 3.115 -3.844 -4.321 1.00 0.00 C ATOM 520 O TYR A 68 2.141 -3.924 -3.567 1.00 0.00 O ATOM 521 CB TYR A 68 5.064 -5.144 -3.468 1.00 0.00 C ATOM 522 CG TYR A 68 6.481 -5.212 -2.934 1.00 0.00 C ATOM 523 CD1 TYR A 68 7.568 -5.272 -3.828 1.00 0.00 C ATOM 524 CD2 TYR A 68 6.710 -5.228 -1.544 1.00 0.00 C ATOM 525 CE1 TYR A 68 8.884 -5.350 -3.337 1.00 0.00 C ATOM 526 CE2 TYR A 68 8.024 -5.307 -1.047 1.00 0.00 C ATOM 527 CZ TYR A 68 9.116 -5.371 -1.943 1.00 0.00 C ATOM 528 OH TYR A 68 10.388 -5.453 -1.463 1.00 0.00 O ATOM 0 H TYR A 68 3.997 -3.141 -1.863 1.00 0.00 H new ATOM 0 HA TYR A 68 5.144 -3.242 -4.553 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.396 -5.604 -2.740 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.006 -5.744 -4.376 1.00 0.00 H new ATOM 0 HD1 TYR A 68 7.391 -5.258 -4.893 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.876 -5.180 -0.859 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.716 -5.394 -4.024 1.00 0.00 H new ATOM 0 HE2 TYR A 68 8.198 -5.319 0.019 1.00 0.00 H new ATOM 0 HH TYR A 68 10.368 -5.455 -0.483 1.00 0.00 H new ATOM 538 N ARG A 69 3.015 -3.920 -5.650 1.00 0.00 N ATOM 539 CA ARG A 69 1.819 -4.298 -6.414 1.00 0.00 C ATOM 540 C ARG A 69 1.987 -5.756 -6.847 1.00 0.00 C ATOM 541 O ARG A 69 3.106 -6.159 -7.174 1.00 0.00 O ATOM 542 CB ARG A 69 1.727 -3.392 -7.649 1.00 0.00 C ATOM 543 CG ARG A 69 0.534 -3.676 -8.568 1.00 0.00 C ATOM 544 CD ARG A 69 0.604 -2.817 -9.839 1.00 0.00 C ATOM 545 NE ARG A 69 1.827 -3.064 -10.638 1.00 0.00 N ATOM 546 CZ ARG A 69 2.200 -4.192 -11.238 1.00 0.00 C ATOM 547 NH1 ARG A 69 1.461 -5.281 -11.247 1.00 0.00 N1+ ATOM 548 NH2 ARG A 69 3.366 -4.254 -11.841 1.00 0.00 N ATOM 0 H ARG A 69 3.807 -3.709 -6.257 1.00 0.00 H new ATOM 0 HA ARG A 69 0.913 -4.188 -5.819 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.674 -2.355 -7.318 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.645 -3.495 -8.227 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.521 -4.732 -8.838 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.396 -3.472 -8.037 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.273 -3.018 -10.455 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.564 -1.764 -9.562 1.00 0.00 H new ATOM 0 HE ARG A 69 2.461 -2.272 -10.741 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.555 -5.286 -10.779 1.00 0.00 H new ATOM 0 HH12 ARG A 69 1.794 -6.120 -11.722 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.981 -3.440 -11.848 1.00 0.00 H new ATOM 0 HH22 ARG A 69 3.656 -5.116 -12.302 1.00 0.00 H new ATOM 562 N MET A 70 0.913 -6.544 -6.890 1.00 0.00 N ATOM 563 CA MET A 70 0.952 -7.913 -7.424 1.00 0.00 C ATOM 564 C MET A 70 0.649 -7.958 -8.928 1.00 0.00 C ATOM 565 O MET A 70 -0.171 -7.194 -9.440 1.00 0.00 O ATOM 566 CB MET A 70 0.000 -8.834 -6.655 1.00 0.00 C ATOM 567 CG MET A 70 0.277 -8.802 -5.145 1.00 0.00 C ATOM 568 SD MET A 70 -0.286 -10.260 -4.233 1.00 0.00 S ATOM 569 CE MET A 70 1.030 -11.410 -4.719 1.00 0.00 C ATOM 0 H MET A 70 -0.008 -6.256 -6.558 1.00 0.00 H new ATOM 0 HA MET A 70 1.971 -8.275 -7.286 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.030 -8.531 -6.843 1.00 0.00 H new ATOM 0 HB3 MET A 70 0.104 -9.855 -7.023 1.00 0.00 H new ATOM 0 HG2 MET A 70 1.350 -8.687 -4.990 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.203 -7.920 -4.721 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.595 -12.381 -4.957 1.00 0.00 H new ATOM 0 HE2 MET A 70 1.549 -11.020 -5.595 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.738 -11.521 -3.898 1.00 0.00 H new ATOM 579 N SER A 71 1.292 -8.883 -9.632 1.00 0.00 N ATOM 580 CA SER A 71 1.064 -9.192 -11.052 1.00 0.00 C ATOM 581 C SER A 71 0.424 -10.589 -11.221 1.00 0.00 C ATOM 582 O SER A 71 0.696 -11.484 -10.406 1.00 0.00 O ATOM 583 CB SER A 71 2.398 -9.118 -11.811 1.00 0.00 C ATOM 584 OG SER A 71 2.843 -7.772 -11.937 1.00 0.00 O ATOM 0 H SER A 71 2.019 -9.467 -9.218 1.00 0.00 H new ATOM 0 HA SER A 71 0.371 -8.458 -11.464 1.00 0.00 H new ATOM 0 HB2 SER A 71 3.151 -9.706 -11.286 1.00 0.00 H new ATOM 0 HB3 SER A 71 2.282 -9.560 -12.801 1.00 0.00 H new ATOM 0 HG SER A 71 2.611 -7.433 -12.827 1.00 0.00 H new ATOM 590 N PRO A 72 -0.395 -10.810 -12.276 1.00 0.00 N ATOM 591 CA PRO A 72 -1.220 -12.012 -12.446 1.00 0.00 C ATOM 592 C PRO A 72 -0.417 -13.291 -12.732 1.00 0.00 C ATOM 593 O PRO A 72 -0.945 -14.389 -12.567 1.00 0.00 O ATOM 594 CB PRO A 72 -2.182 -11.685 -13.595 1.00 0.00 C ATOM 595 CG PRO A 72 -1.401 -10.677 -14.433 1.00 0.00 C ATOM 596 CD PRO A 72 -0.650 -9.880 -13.369 1.00 0.00 C ATOM 0 HA PRO A 72 -1.740 -12.239 -11.515 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -2.437 -12.574 -14.171 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.118 -11.263 -13.228 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -0.721 -11.168 -15.129 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.061 -10.043 -15.025 1.00 0.00 H new ATOM 0 HD2 PRO A 72 0.283 -9.480 -13.767 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.241 -9.030 -13.028 1.00 0.00 H new ATOM 604 N SER A 73 0.865 -13.179 -13.091 1.00 0.00 N ATOM 605 CA SER A 73 1.804 -14.310 -13.215 1.00 0.00 C ATOM 606 C SER A 73 2.311 -14.826 -11.846 1.00 0.00 C ATOM 607 O SER A 73 3.269 -15.599 -11.787 1.00 0.00 O ATOM 608 CB SER A 73 2.999 -13.886 -14.091 1.00 0.00 C ATOM 609 OG SER A 73 2.580 -13.332 -15.335 1.00 0.00 O ATOM 0 H SER A 73 1.294 -12.280 -13.310 1.00 0.00 H new ATOM 0 HA SER A 73 1.262 -15.134 -13.680 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.601 -13.154 -13.553 1.00 0.00 H new ATOM 0 HB3 SER A 73 3.637 -14.750 -14.276 1.00 0.00 H new ATOM 0 HG SER A 73 3.366 -13.074 -15.860 1.00 0.00 H new ATOM 615 N ASN A 74 1.705 -14.363 -10.740 1.00 0.00 N ATOM 616 CA ASN A 74 2.055 -14.652 -9.342 1.00 0.00 C ATOM 617 C ASN A 74 3.413 -14.022 -8.970 1.00 0.00 C ATOM 618 O ASN A 74 4.320 -14.682 -8.454 1.00 0.00 O ATOM 619 CB ASN A 74 1.929 -16.163 -9.038 1.00 0.00 C ATOM 620 CG ASN A 74 1.953 -16.468 -7.542 1.00 0.00 C ATOM 621 OD1 ASN A 74 2.861 -17.113 -7.029 1.00 0.00 O ATOM 622 ND2 ASN A 74 0.956 -16.024 -6.794 1.00 0.00 N ATOM 0 H ASN A 74 0.904 -13.735 -10.805 1.00 0.00 H new ATOM 0 HA ASN A 74 1.333 -14.173 -8.681 1.00 0.00 H new ATOM 0 HB2 ASN A 74 1.000 -16.539 -9.466 1.00 0.00 H new ATOM 0 HB3 ASN A 74 2.744 -16.697 -9.526 1.00 0.00 H new ATOM 0 HD21 ASN A 74 0.944 -16.218 -5.793 1.00 0.00 H new ATOM 0 HD22 ASN A 74 0.200 -15.487 -7.219 1.00 0.00 H new ATOM 629 N GLN A 75 3.579 -12.736 -9.297 1.00 0.00 N ATOM 630 CA GLN A 75 4.799 -11.948 -9.066 1.00 0.00 C ATOM 631 C GLN A 75 4.462 -10.608 -8.388 1.00 0.00 C ATOM 632 O GLN A 75 3.288 -10.281 -8.189 1.00 0.00 O ATOM 633 CB GLN A 75 5.528 -11.733 -10.412 1.00 0.00 C ATOM 634 CG GLN A 75 6.095 -13.013 -11.054 1.00 0.00 C ATOM 635 CD GLN A 75 7.290 -13.597 -10.294 1.00 0.00 C ATOM 636 OE1 GLN A 75 8.444 -13.276 -10.556 1.00 0.00 O ATOM 637 NE2 GLN A 75 7.079 -14.459 -9.319 1.00 0.00 N ATOM 0 H GLN A 75 2.841 -12.193 -9.746 1.00 0.00 H new ATOM 0 HA GLN A 75 5.461 -12.492 -8.392 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.835 -11.268 -11.114 1.00 0.00 H new ATOM 0 HB3 GLN A 75 6.345 -11.029 -10.257 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.306 -13.763 -11.108 1.00 0.00 H new ATOM 0 HG3 GLN A 75 6.397 -12.794 -12.078 1.00 0.00 H new ATOM 0 HE21 GLN A 75 6.127 -14.740 -9.084 1.00 0.00 H new ATOM 0 HE22 GLN A 75 7.868 -14.845 -8.800 1.00 0.00 H new ATOM 646 N THR A 76 5.494 -9.828 -8.039 1.00 0.00 N ATOM 647 CA THR A 76 5.403 -8.539 -7.334 1.00 0.00 C ATOM 648 C THR A 76 6.327 -7.505 -7.961 1.00 0.00 C ATOM 649 O THR A 76 7.381 -7.840 -8.501 1.00 0.00 O ATOM 650 CB THR A 76 5.730 -8.662 -5.837 1.00 0.00 C ATOM 651 OG1 THR A 76 6.812 -9.546 -5.620 1.00 0.00 O ATOM 652 CG2 THR A 76 4.524 -9.155 -5.042 1.00 0.00 C ATOM 0 H THR A 76 6.458 -10.088 -8.249 1.00 0.00 H new ATOM 0 HA THR A 76 4.367 -8.214 -7.431 1.00 0.00 H new ATOM 0 HB THR A 76 6.003 -7.664 -5.493 1.00 0.00 H new ATOM 0 HG1 THR A 76 7.000 -9.604 -4.660 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.790 -9.231 -3.988 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.699 -8.452 -5.159 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.221 -10.135 -5.411 1.00 0.00 H new ATOM 660 N ASP A 77 5.934 -6.239 -7.851 1.00 0.00 N ATOM 661 CA ASP A 77 6.631 -5.078 -8.412 1.00 0.00 C ATOM 662 C ASP A 77 6.734 -3.953 -7.375 1.00 0.00 C ATOM 663 O ASP A 77 5.729 -3.547 -6.792 1.00 0.00 O ATOM 664 CB ASP A 77 5.823 -4.591 -9.618 1.00 0.00 C ATOM 665 CG ASP A 77 6.503 -3.516 -10.479 1.00 0.00 C ATOM 666 OD1 ASP A 77 7.755 -3.453 -10.518 1.00 0.00 O1- ATOM 667 OD2 ASP A 77 5.756 -2.766 -11.152 1.00 0.00 O ATOM 0 H ASP A 77 5.086 -5.980 -7.348 1.00 0.00 H new ATOM 0 HA ASP A 77 7.643 -5.359 -8.705 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.596 -5.449 -10.251 1.00 0.00 H new ATOM 0 HB3 ASP A 77 4.871 -4.197 -9.261 1.00 0.00 H new ATOM 672 N LYS A 78 7.945 -3.442 -7.150 1.00 0.00 N ATOM 673 CA LYS A 78 8.212 -2.377 -6.172 1.00 0.00 C ATOM 674 C LYS A 78 7.710 -1.018 -6.695 1.00 0.00 C ATOM 675 O LYS A 78 8.051 -0.603 -7.807 1.00 0.00 O ATOM 676 CB LYS A 78 9.713 -2.330 -5.819 1.00 0.00 C ATOM 677 CG LYS A 78 10.001 -1.368 -4.645 1.00 0.00 C ATOM 678 CD LYS A 78 11.486 -0.994 -4.524 1.00 0.00 C ATOM 679 CE LYS A 78 12.353 -2.106 -3.915 1.00 0.00 C ATOM 680 NZ LYS A 78 13.800 -1.832 -4.118 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.780 -3.757 -7.645 1.00 0.00 H new ATOM 0 HA LYS A 78 7.663 -2.599 -5.257 1.00 0.00 H new ATOM 0 HB2 LYS A 78 10.056 -3.332 -5.560 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.282 -2.015 -6.694 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.413 -0.459 -4.775 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.672 -1.831 -3.715 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.871 -0.745 -5.513 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.577 -0.097 -3.911 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.143 -2.192 -2.849 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.094 -3.062 -4.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.361 -2.599 -3.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 14.003 -1.774 -5.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 14.050 -0.931 -3.663 1.00 0.00 H new ATOM 694 N LEU A 79 6.930 -0.312 -5.878 1.00 0.00 N ATOM 695 CA LEU A 79 6.270 0.952 -6.223 1.00 0.00 C ATOM 696 C LEU A 79 7.007 2.167 -5.652 1.00 0.00 C ATOM 697 O LEU A 79 7.272 3.127 -6.379 1.00 0.00 O ATOM 698 CB LEU A 79 4.842 0.892 -5.660 1.00 0.00 C ATOM 699 CG LEU A 79 3.989 -0.258 -6.224 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.694 -0.299 -5.412 1.00 0.00 C ATOM 701 CD2 LEU A 79 3.716 -0.070 -7.724 1.00 0.00 C ATOM 0 H LEU A 79 6.731 -0.612 -4.924 1.00 0.00 H new ATOM 0 HA LEU A 79 6.268 1.071 -7.306 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.895 0.792 -4.576 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.341 1.837 -5.869 1.00 0.00 H new ATOM 0 HG LEU A 79 4.518 -1.207 -6.135 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.058 -1.104 -5.781 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.928 -0.474 -4.362 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.171 0.652 -5.513 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.111 -0.899 -8.091 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.181 0.867 -7.882 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.662 -0.044 -8.265 1.00 0.00 H new ATOM 713 N ALA A 80 7.329 2.104 -4.358 1.00 0.00 N ATOM 714 CA ALA A 80 8.007 3.128 -3.570 1.00 0.00 C ATOM 715 C ALA A 80 8.492 2.515 -2.243 1.00 0.00 C ATOM 716 O ALA A 80 8.229 1.340 -1.958 1.00 0.00 O ATOM 717 CB ALA A 80 7.057 4.325 -3.372 1.00 0.00 C ATOM 0 H ALA A 80 7.107 1.280 -3.799 1.00 0.00 H new ATOM 0 HA ALA A 80 8.890 3.500 -4.089 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.558 5.094 -2.784 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.780 4.734 -4.344 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.160 3.995 -2.848 1.00 0.00 H new ATOM 723 N ALA A 81 9.195 3.301 -1.426 1.00 0.00 N ATOM 724 CA ALA A 81 9.779 2.847 -0.165 1.00 0.00 C ATOM 725 C ALA A 81 10.042 3.994 0.822 1.00 0.00 C ATOM 726 O ALA A 81 10.028 5.170 0.447 1.00 0.00 O ATOM 727 CB ALA A 81 11.079 2.088 -0.477 1.00 0.00 C ATOM 0 H ALA A 81 9.377 4.285 -1.625 1.00 0.00 H new ATOM 0 HA ALA A 81 9.061 2.191 0.327 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.530 1.741 0.453 1.00 0.00 H new ATOM 0 HB2 ALA A 81 10.857 1.232 -1.114 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.774 2.752 -0.991 1.00 0.00 H new ATOM 733 N PHE A 82 10.321 3.629 2.074 1.00 0.00 N ATOM 734 CA PHE A 82 10.815 4.512 3.125 1.00 0.00 C ATOM 735 C PHE A 82 11.898 3.774 3.950 1.00 0.00 C ATOM 736 O PHE A 82 11.568 2.771 4.591 1.00 0.00 O ATOM 737 CB PHE A 82 9.643 4.977 4.000 1.00 0.00 C ATOM 738 CG PHE A 82 10.038 6.087 4.950 1.00 0.00 C ATOM 739 CD1 PHE A 82 10.628 5.781 6.191 1.00 0.00 C ATOM 740 CD2 PHE A 82 9.877 7.432 4.564 1.00 0.00 C ATOM 741 CE1 PHE A 82 11.049 6.816 7.043 1.00 0.00 C ATOM 742 CE2 PHE A 82 10.280 8.466 5.427 1.00 0.00 C ATOM 743 CZ PHE A 82 10.865 8.158 6.667 1.00 0.00 C ATOM 0 H PHE A 82 10.203 2.668 2.394 1.00 0.00 H new ATOM 0 HA PHE A 82 11.274 5.399 2.689 1.00 0.00 H new ATOM 0 HB2 PHE A 82 8.830 5.321 3.361 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.262 4.131 4.572 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.757 4.751 6.488 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.443 7.669 3.604 1.00 0.00 H new ATOM 0 HE1 PHE A 82 11.515 6.580 7.988 1.00 0.00 H new ATOM 0 HE2 PHE A 82 10.140 9.497 5.137 1.00 0.00 H new ATOM 0 HZ PHE A 82 11.173 8.952 7.331 1.00 0.00 H new ATOM 753 N PRO A 83 13.170 4.231 3.977 1.00 0.00 N ATOM 754 CA PRO A 83 13.746 5.328 3.196 1.00 0.00 C ATOM 755 C PRO A 83 13.560 5.169 1.680 1.00 0.00 C ATOM 756 O PRO A 83 13.399 4.057 1.176 1.00 0.00 O ATOM 757 CB PRO A 83 15.235 5.367 3.562 1.00 0.00 C ATOM 758 CG PRO A 83 15.277 4.737 4.951 1.00 0.00 C ATOM 759 CD PRO A 83 14.187 3.675 4.860 1.00 0.00 C ATOM 0 HA PRO A 83 13.233 6.258 3.438 1.00 0.00 H new ATOM 0 HB2 PRO A 83 15.839 4.806 2.848 1.00 0.00 H new ATOM 0 HB3 PRO A 83 15.619 6.387 3.572 1.00 0.00 H new ATOM 0 HG2 PRO A 83 16.252 4.301 5.170 1.00 0.00 H new ATOM 0 HG3 PRO A 83 15.070 5.466 5.734 1.00 0.00 H new ATOM 0 HD2 PRO A 83 14.583 2.740 4.462 1.00 0.00 H new ATOM 0 HD3 PRO A 83 13.773 3.453 5.844 1.00 0.00 H new ATOM 907 N ARG A 94 4.024 8.893 -8.636 1.00 0.00 N ATOM 908 CA ARG A 94 2.597 8.597 -8.414 1.00 0.00 C ATOM 909 C ARG A 94 2.356 7.686 -7.196 1.00 0.00 C ATOM 910 O ARG A 94 1.245 7.685 -6.661 1.00 0.00 O ATOM 911 CB ARG A 94 1.972 7.950 -9.664 1.00 0.00 C ATOM 912 CG ARG A 94 1.797 8.890 -10.869 1.00 0.00 C ATOM 913 CD ARG A 94 0.939 10.119 -10.544 1.00 0.00 C ATOM 914 NE ARG A 94 0.291 10.665 -11.750 1.00 0.00 N ATOM 915 CZ ARG A 94 -0.915 10.335 -12.199 1.00 0.00 C ATOM 916 NH1 ARG A 94 -1.652 9.425 -11.598 1.00 0.00 N1+ ATOM 917 NH2 ARG A 94 -1.409 10.932 -13.262 1.00 0.00 N ATOM 0 HA ARG A 94 2.118 9.555 -8.212 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.594 7.108 -9.967 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.997 7.545 -9.395 1.00 0.00 H new ATOM 0 HG2 ARG A 94 2.778 9.218 -11.214 1.00 0.00 H new ATOM 0 HG3 ARG A 94 1.338 8.339 -11.690 1.00 0.00 H new ATOM 0 HD2 ARG A 94 0.178 9.848 -9.813 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.562 10.887 -10.086 1.00 0.00 H new ATOM 0 HE ARG A 94 0.814 11.357 -12.287 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -1.301 8.953 -10.765 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -2.575 9.192 -11.965 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -0.866 11.649 -13.743 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.335 10.678 -13.606 1.00 0.00 H new ATOM 931 N PHE A 95 3.381 6.949 -6.753 1.00 0.00 N ATOM 932 CA PHE A 95 3.387 6.117 -5.549 1.00 0.00 C ATOM 933 C PHE A 95 4.337 6.715 -4.499 1.00 0.00 C ATOM 934 O PHE A 95 5.449 7.130 -4.836 1.00 0.00 O ATOM 935 CB PHE A 95 3.825 4.695 -5.934 1.00 0.00 C ATOM 936 CG PHE A 95 2.940 4.038 -6.979 1.00 0.00 C ATOM 937 CD1 PHE A 95 1.792 3.326 -6.585 1.00 0.00 C ATOM 938 CD2 PHE A 95 3.251 4.151 -8.348 1.00 0.00 C ATOM 939 CE1 PHE A 95 0.954 2.739 -7.550 1.00 0.00 C ATOM 940 CE2 PHE A 95 2.412 3.568 -9.315 1.00 0.00 C ATOM 941 CZ PHE A 95 1.261 2.864 -8.917 1.00 0.00 C ATOM 0 H PHE A 95 4.271 6.917 -7.250 1.00 0.00 H new ATOM 0 HA PHE A 95 2.388 6.081 -5.115 1.00 0.00 H new ATOM 0 HB2 PHE A 95 4.848 4.730 -6.309 1.00 0.00 H new ATOM 0 HB3 PHE A 95 3.835 4.074 -5.038 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.553 3.230 -5.536 1.00 0.00 H new ATOM 0 HD2 PHE A 95 4.136 4.687 -8.656 1.00 0.00 H new ATOM 0 HE1 PHE A 95 0.075 2.192 -7.242 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.652 3.661 -10.364 1.00 0.00 H new ATOM 0 HZ PHE A 95 0.614 2.420 -9.660 1.00 0.00 H new ATOM 951 N ARG A 96 3.913 6.757 -3.229 1.00 0.00 N ATOM 952 CA ARG A 96 4.702 7.279 -2.097 1.00 0.00 C ATOM 953 C ARG A 96 4.459 6.499 -0.794 1.00 0.00 C ATOM 954 O ARG A 96 3.356 5.997 -0.572 1.00 0.00 O ATOM 955 CB ARG A 96 4.407 8.786 -1.927 1.00 0.00 C ATOM 956 CG ARG A 96 5.592 9.648 -2.392 1.00 0.00 C ATOM 957 CD ARG A 96 5.202 11.119 -2.579 1.00 0.00 C ATOM 958 NE ARG A 96 4.522 11.337 -3.870 1.00 0.00 N ATOM 959 CZ ARG A 96 3.965 12.467 -4.287 1.00 0.00 C ATOM 960 NH1 ARG A 96 3.891 13.541 -3.528 1.00 0.00 N ATOM 961 NH2 ARG A 96 3.478 12.522 -5.505 1.00 0.00 N1+ ATOM 0 H ARG A 96 2.991 6.422 -2.950 1.00 0.00 H new ATOM 0 HA ARG A 96 5.759 7.142 -2.324 1.00 0.00 H new ATOM 0 HB2 ARG A 96 3.517 9.050 -2.498 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.189 8.999 -0.881 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.398 9.578 -1.662 1.00 0.00 H new ATOM 0 HG3 ARG A 96 5.978 9.254 -3.332 1.00 0.00 H new ATOM 0 HD2 ARG A 96 4.547 11.430 -1.765 1.00 0.00 H new ATOM 0 HD3 ARG A 96 6.094 11.743 -2.526 1.00 0.00 H new ATOM 0 HE ARG A 96 4.475 10.540 -4.505 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.270 13.524 -2.581 1.00 0.00 H new ATOM 0 HH12 ARG A 96 3.454 14.390 -3.887 1.00 0.00 H new ATOM 0 HH21 ARG A 96 3.532 11.705 -6.113 1.00 0.00 H new ATOM 0 HH22 ARG A 96 3.046 13.382 -5.843 1.00 0.00 H new ATOM 975 N VAL A 97 5.478 6.421 0.068 1.00 0.00 N ATOM 976 CA VAL A 97 5.428 5.799 1.410 1.00 0.00 C ATOM 977 C VAL A 97 5.927 6.801 2.463 1.00 0.00 C ATOM 978 O VAL A 97 7.000 7.381 2.283 1.00 0.00 O ATOM 979 CB VAL A 97 6.281 4.508 1.494 1.00 0.00 C ATOM 980 CG1 VAL A 97 6.138 3.823 2.866 1.00 0.00 C ATOM 981 CG2 VAL A 97 5.905 3.498 0.397 1.00 0.00 C ATOM 0 H VAL A 97 6.399 6.802 -0.151 1.00 0.00 H new ATOM 0 HA VAL A 97 4.390 5.526 1.601 1.00 0.00 H new ATOM 0 HB VAL A 97 7.315 4.821 1.350 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.750 2.921 2.888 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.468 4.505 3.649 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.094 3.557 3.033 1.00 0.00 H new ATOM 0 HG21 VAL A 97 6.527 2.608 0.493 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.856 3.221 0.502 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.065 3.948 -0.583 1.00 0.00 H new ATOM 991 N THR A 98 5.175 6.976 3.559 1.00 0.00 N ATOM 992 CA THR A 98 5.522 7.870 4.685 1.00 0.00 C ATOM 993 C THR A 98 5.384 7.130 6.015 1.00 0.00 C ATOM 994 O THR A 98 4.395 6.430 6.215 1.00 0.00 O ATOM 995 CB THR A 98 4.608 9.106 4.658 1.00 0.00 C ATOM 996 OG1 THR A 98 4.760 9.756 3.413 1.00 0.00 O ATOM 997 CG2 THR A 98 4.955 10.125 5.748 1.00 0.00 C ATOM 0 H THR A 98 4.288 6.491 3.695 1.00 0.00 H new ATOM 0 HA THR A 98 6.559 8.191 4.582 1.00 0.00 H new ATOM 0 HB THR A 98 3.590 8.754 4.825 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.180 10.546 3.383 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.277 10.976 5.680 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.854 9.658 6.728 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.981 10.467 5.613 1.00 0.00 H new ATOM 1005 N GLN A 99 6.340 7.287 6.936 1.00 0.00 N ATOM 1006 CA GLN A 99 6.254 6.713 8.290 1.00 0.00 C ATOM 1007 C GLN A 99 5.374 7.563 9.224 1.00 0.00 C ATOM 1008 O GLN A 99 5.418 8.796 9.185 1.00 0.00 O ATOM 1009 CB GLN A 99 7.650 6.446 8.893 1.00 0.00 C ATOM 1010 CG GLN A 99 8.336 7.667 9.543 1.00 0.00 C ATOM 1011 CD GLN A 99 9.698 7.362 10.179 1.00 0.00 C ATOM 1012 OE1 GLN A 99 10.646 8.132 10.075 1.00 0.00 O ATOM 1013 NE2 GLN A 99 9.862 6.258 10.883 1.00 0.00 N ATOM 0 H GLN A 99 7.196 7.815 6.768 1.00 0.00 H new ATOM 0 HA GLN A 99 5.762 5.745 8.192 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.559 5.660 9.643 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.299 6.062 8.106 1.00 0.00 H new ATOM 0 HG2 GLN A 99 8.467 8.441 8.787 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.675 8.076 10.307 1.00 0.00 H new ATOM 0 HE21 GLN A 99 9.090 5.599 10.986 1.00 0.00 H new ATOM 0 HE22 GLN A 99 10.761 6.063 11.324 1.00 0.00 H new ATOM 1022 N LEU A 100 4.594 6.910 10.090 1.00 0.00 N ATOM 1023 CA LEU A 100 3.866 7.563 11.185 1.00 0.00 C ATOM 1024 C LEU A 100 4.758 7.716 12.439 1.00 0.00 C ATOM 1025 O LEU A 100 5.700 6.931 12.612 1.00 0.00 O ATOM 1026 CB LEU A 100 2.595 6.754 11.519 1.00 0.00 C ATOM 1027 CG LEU A 100 1.612 6.520 10.354 1.00 0.00 C ATOM 1028 CD1 LEU A 100 0.281 6.008 10.923 1.00 0.00 C ATOM 1029 CD2 LEU A 100 1.342 7.781 9.520 1.00 0.00 C ATOM 0 H LEU A 100 4.448 5.901 10.051 1.00 0.00 H new ATOM 0 HA LEU A 100 3.580 8.564 10.861 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.900 5.783 11.911 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.062 7.268 12.319 1.00 0.00 H new ATOM 0 HG LEU A 100 2.074 5.791 9.689 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.422 5.839 10.108 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.449 5.073 11.457 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.130 6.748 11.609 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.643 7.544 8.718 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.914 8.554 10.158 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.277 8.141 9.091 1.00 0.00 H new ATOM 1041 N PRO A 101 4.435 8.649 13.362 1.00 0.00 N ATOM 1042 CA PRO A 101 5.134 8.802 14.642 1.00 0.00 C ATOM 1043 C PRO A 101 4.958 7.610 15.605 1.00 0.00 C ATOM 1044 O PRO A 101 5.605 7.586 16.652 1.00 0.00 O ATOM 1045 CB PRO A 101 4.607 10.112 15.243 1.00 0.00 C ATOM 1046 CG PRO A 101 3.211 10.245 14.641 1.00 0.00 C ATOM 1047 CD PRO A 101 3.406 9.679 13.238 1.00 0.00 C ATOM 0 HA PRO A 101 6.211 8.829 14.477 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.572 10.069 16.332 1.00 0.00 H new ATOM 0 HB3 PRO A 101 5.241 10.958 14.978 1.00 0.00 H new ATOM 0 HG2 PRO A 101 2.469 9.682 15.207 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.875 11.282 14.618 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.477 9.259 12.854 1.00 0.00 H new ATOM 0 HD3 PRO A 101 3.715 10.458 12.542 1.00 0.00 H new ATOM 1055 N ASN A 102 4.139 6.602 15.266 1.00 0.00 N ATOM 1056 CA ASN A 102 4.068 5.329 16.001 1.00 0.00 C ATOM 1057 C ASN A 102 5.414 4.558 16.001 1.00 0.00 C ATOM 1058 O ASN A 102 5.696 3.793 16.925 1.00 0.00 O ATOM 1059 CB ASN A 102 2.956 4.483 15.361 1.00 0.00 C ATOM 1060 CG ASN A 102 2.786 3.131 16.050 1.00 0.00 C ATOM 1061 OD1 ASN A 102 3.360 2.130 15.637 1.00 0.00 O ATOM 1062 ND2 ASN A 102 2.020 3.068 17.124 1.00 0.00 N ATOM 0 H ASN A 102 3.504 6.647 14.469 1.00 0.00 H new ATOM 0 HA ASN A 102 3.848 5.538 17.048 1.00 0.00 H new ATOM 0 HB2 ASN A 102 2.015 5.031 15.405 1.00 0.00 H new ATOM 0 HB3 ASN A 102 3.184 4.325 14.307 1.00 0.00 H new ATOM 0 HD21 ASN A 102 1.903 2.182 17.616 1.00 0.00 H new ATOM 0 HD22 ASN A 102 1.545 3.905 17.462 1.00 0.00 H new ATOM 1069 N GLY A 103 6.257 4.781 14.983 1.00 0.00 N ATOM 1070 CA GLY A 103 7.633 4.274 14.870 1.00 0.00 C ATOM 1071 C GLY A 103 7.772 3.023 13.998 1.00 0.00 C ATOM 1072 O GLY A 103 8.766 2.913 13.279 1.00 0.00 O ATOM 0 H GLY A 103 5.986 5.346 14.178 1.00 0.00 H new ATOM 0 HA2 GLY A 103 8.266 5.061 14.460 1.00 0.00 H new ATOM 0 HA3 GLY A 103 8.009 4.051 15.868 1.00 0.00 H new ATOM 1076 N ARG A 104 6.770 2.129 13.997 1.00 0.00 N ATOM 1077 CA ARG A 104 6.659 1.004 13.050 1.00 0.00 C ATOM 1078 C ARG A 104 5.216 0.908 12.531 1.00 0.00 C ATOM 1079 O ARG A 104 4.455 -0.007 12.850 1.00 0.00 O ATOM 1080 CB ARG A 104 7.147 -0.318 13.687 1.00 0.00 C ATOM 1081 CG ARG A 104 8.619 -0.250 14.137 1.00 0.00 C ATOM 1082 CD ARG A 104 9.278 -1.619 14.350 1.00 0.00 C ATOM 1083 NE ARG A 104 8.683 -2.392 15.457 1.00 0.00 N ATOM 1084 CZ ARG A 104 9.142 -3.552 15.916 1.00 0.00 C ATOM 1085 NH1 ARG A 104 10.242 -4.102 15.442 1.00 0.00 N1+ ATOM 1086 NH2 ARG A 104 8.483 -4.195 16.853 1.00 0.00 N ATOM 0 H ARG A 104 6.000 2.167 14.665 1.00 0.00 H new ATOM 0 HA ARG A 104 7.312 1.188 12.197 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.519 -0.557 14.545 1.00 0.00 H new ATOM 0 HB3 ARG A 104 7.027 -1.129 12.969 1.00 0.00 H new ATOM 0 HG2 ARG A 104 9.190 0.303 13.391 1.00 0.00 H new ATOM 0 HG3 ARG A 104 8.677 0.317 15.066 1.00 0.00 H new ATOM 0 HD2 ARG A 104 9.200 -2.198 13.430 1.00 0.00 H new ATOM 0 HD3 ARG A 104 10.340 -1.475 14.547 1.00 0.00 H new ATOM 0 HE ARG A 104 7.853 -2.005 15.906 1.00 0.00 H new ATOM 0 HH11 ARG A 104 10.767 -3.636 14.702 1.00 0.00 H new ATOM 0 HH12 ARG A 104 10.568 -4.993 15.815 1.00 0.00 H new ATOM 0 HH21 ARG A 104 7.619 -3.804 17.228 1.00 0.00 H new ATOM 0 HH22 ARG A 104 8.835 -5.085 17.205 1.00 0.00 H new ATOM 1100 N ASP A 105 4.882 1.857 11.659 1.00 0.00 N ATOM 1101 CA ASP A 105 3.588 2.038 10.994 1.00 0.00 C ATOM 1102 C ASP A 105 3.755 3.068 9.866 1.00 0.00 C ATOM 1103 O ASP A 105 4.537 4.015 10.000 1.00 0.00 O ATOM 1104 CB ASP A 105 2.497 2.469 11.986 1.00 0.00 C ATOM 1105 CG ASP A 105 1.098 2.042 11.521 1.00 0.00 C ATOM 1106 OD1 ASP A 105 0.528 2.713 10.634 1.00 0.00 O1- ATOM 1107 OD2 ASP A 105 0.574 1.042 12.066 1.00 0.00 O ATOM 0 H ASP A 105 5.554 2.571 11.377 1.00 0.00 H new ATOM 0 HA ASP A 105 3.264 1.086 10.574 1.00 0.00 H new ATOM 0 HB2 ASP A 105 2.703 2.033 12.964 1.00 0.00 H new ATOM 0 HB3 ASP A 105 2.524 3.552 12.107 1.00 0.00 H new ATOM 1112 N PHE A 106 3.050 2.867 8.754 1.00 0.00 N ATOM 1113 CA PHE A 106 3.281 3.591 7.503 1.00 0.00 C ATOM 1114 C PHE A 106 1.990 3.846 6.716 1.00 0.00 C ATOM 1115 O PHE A 106 1.067 3.033 6.719 1.00 0.00 O ATOM 1116 CB PHE A 106 4.263 2.780 6.634 1.00 0.00 C ATOM 1117 CG PHE A 106 5.620 2.505 7.262 1.00 0.00 C ATOM 1118 CD1 PHE A 106 5.791 1.409 8.134 1.00 0.00 C ATOM 1119 CD2 PHE A 106 6.716 3.345 6.980 1.00 0.00 C ATOM 1120 CE1 PHE A 106 7.033 1.181 8.754 1.00 0.00 C ATOM 1121 CE2 PHE A 106 7.962 3.105 7.586 1.00 0.00 C ATOM 1122 CZ PHE A 106 8.120 2.031 8.481 1.00 0.00 C ATOM 0 H PHE A 106 2.292 2.188 8.695 1.00 0.00 H new ATOM 0 HA PHE A 106 3.695 4.567 7.757 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.798 1.826 6.385 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.418 3.314 5.697 1.00 0.00 H new ATOM 0 HD1 PHE A 106 4.964 0.742 8.326 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.599 4.174 6.298 1.00 0.00 H new ATOM 0 HE1 PHE A 106 7.152 0.354 9.439 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.801 3.748 7.364 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.074 1.860 8.957 1.00 0.00 H new ATOM 1132 N HIS A 107 1.952 4.966 5.993 1.00 0.00 N ATOM 1133 CA HIS A 107 0.929 5.290 4.996 1.00 0.00 C ATOM 1134 C HIS A 107 1.485 5.116 3.570 1.00 0.00 C ATOM 1135 O HIS A 107 2.537 5.667 3.236 1.00 0.00 O ATOM 1136 CB HIS A 107 0.418 6.724 5.219 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.665 6.870 6.261 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.409 8.036 6.464 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -1.129 5.904 7.108 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.298 7.739 7.427 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -2.155 6.466 7.831 1.00 0.00 N ATOM 0 H HIS A 107 2.656 5.698 6.088 1.00 0.00 H new ATOM 0 HA HIS A 107 0.092 4.602 5.111 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.262 7.352 5.506 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.041 7.109 4.271 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -0.761 4.892 7.194 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -3.028 8.430 7.822 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -2.710 5.998 8.548 1.00 0.00 H new ATOM 1149 N MET A 108 0.756 4.376 2.731 1.00 0.00 N ATOM 1150 CA MET A 108 1.094 4.055 1.338 1.00 0.00 C ATOM 1151 C MET A 108 0.086 4.738 0.411 1.00 0.00 C ATOM 1152 O MET A 108 -1.094 4.399 0.442 1.00 0.00 O ATOM 1153 CB MET A 108 1.019 2.534 1.135 1.00 0.00 C ATOM 1154 CG MET A 108 2.235 1.757 1.650 1.00 0.00 C ATOM 1155 SD MET A 108 2.493 1.739 3.441 1.00 0.00 S ATOM 1156 CE MET A 108 3.998 0.740 3.461 1.00 0.00 C ATOM 0 H MET A 108 -0.131 3.963 3.017 1.00 0.00 H new ATOM 0 HA MET A 108 2.101 4.404 1.112 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.127 2.158 1.636 1.00 0.00 H new ATOM 0 HB3 MET A 108 0.898 2.329 0.071 1.00 0.00 H new ATOM 0 HG2 MET A 108 2.148 0.725 1.309 1.00 0.00 H new ATOM 0 HG3 MET A 108 3.127 2.173 1.182 1.00 0.00 H new ATOM 0 HE1 MET A 108 3.854 -0.122 4.113 1.00 0.00 H new ATOM 0 HE2 MET A 108 4.221 0.398 2.450 1.00 0.00 H new ATOM 0 HE3 MET A 108 4.829 1.341 3.832 1.00 0.00 H new ATOM 1166 N SER A 109 0.523 5.702 -0.398 1.00 0.00 N ATOM 1167 CA SER A 109 -0.361 6.589 -1.169 1.00 0.00 C ATOM 1168 C SER A 109 -0.170 6.483 -2.695 1.00 0.00 C ATOM 1169 O SER A 109 0.948 6.644 -3.193 1.00 0.00 O ATOM 1170 CB SER A 109 -0.125 8.039 -0.725 1.00 0.00 C ATOM 1171 OG SER A 109 -1.008 8.927 -1.395 1.00 0.00 O ATOM 0 H SER A 109 1.514 5.895 -0.542 1.00 0.00 H new ATOM 0 HA SER A 109 -1.383 6.272 -0.964 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.269 8.121 0.352 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.907 8.323 -0.931 1.00 0.00 H new ATOM 0 HG SER A 109 -0.840 9.844 -1.094 1.00 0.00 H new ATOM 1177 N VAL A 110 -1.265 6.245 -3.431 1.00 0.00 N ATOM 1178 CA VAL A 110 -1.357 6.356 -4.899 1.00 0.00 C ATOM 1179 C VAL A 110 -2.040 7.694 -5.191 1.00 0.00 C ATOM 1180 O VAL A 110 -3.218 7.854 -4.873 1.00 0.00 O ATOM 1181 CB VAL A 110 -2.195 5.232 -5.570 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -2.081 5.328 -7.103 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -1.796 3.817 -5.135 1.00 0.00 C ATOM 0 H VAL A 110 -2.147 5.959 -3.006 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.349 6.273 -5.306 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.222 5.394 -5.241 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.672 4.536 -7.562 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.453 6.297 -7.436 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.037 5.219 -7.398 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.425 3.088 -5.646 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.752 3.638 -5.392 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.927 3.717 -4.057 1.00 0.00 H new ATOM 1193 N VAL A 111 -1.331 8.654 -5.786 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.900 9.967 -6.119 1.00 0.00 C ATOM 1195 C VAL A 111 -2.535 9.977 -7.516 1.00 0.00 C ATOM 1196 O VAL A 111 -1.981 9.410 -8.460 1.00 0.00 O ATOM 1197 CB VAL A 111 -0.878 11.112 -5.966 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.671 11.480 -4.488 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.479 10.872 -6.626 1.00 0.00 C ATOM 0 H VAL A 111 -0.352 8.548 -6.051 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.692 10.147 -5.392 1.00 0.00 H new ATOM 0 HB VAL A 111 -1.331 11.942 -6.507 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.055 12.290 -4.413 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.619 11.801 -4.057 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.302 10.610 -3.945 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.122 11.736 -6.460 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.942 9.986 -6.193 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.341 10.723 -7.697 1.00 0.00 H new ATOM 1209 N ARG A 112 -3.698 10.638 -7.638 1.00 0.00 N ATOM 1210 CA ARG A 112 -4.424 10.896 -8.896 1.00 0.00 C ATOM 1211 C ARG A 112 -4.730 9.586 -9.659 1.00 0.00 C ATOM 1212 O ARG A 112 -4.369 9.430 -10.829 1.00 0.00 O ATOM 1213 CB ARG A 112 -3.630 11.944 -9.714 1.00 0.00 C ATOM 1214 CG ARG A 112 -4.422 12.645 -10.830 1.00 0.00 C ATOM 1215 CD ARG A 112 -5.422 13.662 -10.267 1.00 0.00 C ATOM 1216 NE ARG A 112 -6.182 14.325 -11.340 1.00 0.00 N ATOM 1217 CZ ARG A 112 -7.370 14.912 -11.225 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -8.066 14.884 -10.107 1.00 0.00 N1+ ATOM 1219 NH2 ARG A 112 -7.881 15.548 -12.256 1.00 0.00 N ATOM 0 H ARG A 112 -4.181 11.025 -6.827 1.00 0.00 H new ATOM 0 HA ARG A 112 -5.408 11.317 -8.690 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -3.250 12.702 -9.030 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -2.764 11.453 -10.159 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -3.730 13.150 -11.504 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -4.955 11.900 -11.420 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -6.112 13.159 -9.589 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -4.889 14.411 -9.681 1.00 0.00 H new ATOM 0 HE ARG A 112 -5.754 14.335 -12.266 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -7.697 14.400 -9.289 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -8.974 15.347 -10.060 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -7.367 15.589 -13.136 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -8.792 16.001 -12.176 1.00 0.00 H new ATOM 1233 N ALA A 113 -5.324 8.607 -8.972 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.470 7.233 -9.466 1.00 0.00 C ATOM 1235 C ALA A 113 -6.374 7.090 -10.708 1.00 0.00 C ATOM 1236 O ALA A 113 -7.216 7.939 -11.001 1.00 0.00 O ATOM 1237 CB ALA A 113 -5.927 6.336 -8.308 1.00 0.00 C ATOM 0 H ALA A 113 -5.723 8.747 -8.044 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.492 6.910 -9.823 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -6.039 5.312 -8.664 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.184 6.364 -7.511 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.883 6.694 -7.926 1.00 0.00 H new ATOM 1243 N ARG A 114 -6.185 5.981 -11.426 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.773 5.640 -12.734 1.00 0.00 C ATOM 1245 C ARG A 114 -7.255 4.181 -12.718 1.00 0.00 C ATOM 1246 O ARG A 114 -6.696 3.368 -11.981 1.00 0.00 O ATOM 1247 CB ARG A 114 -5.734 5.903 -13.854 1.00 0.00 C ATOM 1248 CG ARG A 114 -4.322 5.385 -13.513 1.00 0.00 C ATOM 1249 CD ARG A 114 -3.224 5.721 -14.524 1.00 0.00 C ATOM 1250 NE ARG A 114 -3.199 4.817 -15.685 1.00 0.00 N ATOM 1251 CZ ARG A 114 -2.713 3.578 -15.710 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -2.354 2.919 -14.627 1.00 0.00 N ATOM 1253 NH2 ARG A 114 -2.593 2.955 -16.861 1.00 0.00 N1+ ATOM 0 H ARG A 114 -5.572 5.239 -11.088 1.00 0.00 H new ATOM 0 HA ARG A 114 -7.640 6.269 -12.935 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -6.075 5.428 -14.774 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.683 6.974 -14.048 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -4.032 5.790 -12.543 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -4.370 4.301 -13.405 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -3.363 6.744 -14.873 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -2.256 5.684 -14.024 1.00 0.00 H new ATOM 0 HE ARG A 114 -3.592 5.175 -16.555 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -2.443 3.357 -13.710 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -1.987 1.970 -14.705 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -2.871 3.421 -17.725 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -2.222 2.005 -16.891 1.00 0.00 H new ATOM 1267 N ARG A 115 -8.279 3.819 -13.508 1.00 0.00 N ATOM 1268 CA ARG A 115 -8.959 2.504 -13.404 1.00 0.00 C ATOM 1269 C ARG A 115 -8.013 1.292 -13.475 1.00 0.00 C ATOM 1270 O ARG A 115 -8.179 0.333 -12.720 1.00 0.00 O ATOM 1271 CB ARG A 115 -10.091 2.370 -14.432 1.00 0.00 C ATOM 1272 CG ARG A 115 -11.199 3.410 -14.186 1.00 0.00 C ATOM 1273 CD ARG A 115 -12.587 2.901 -14.583 1.00 0.00 C ATOM 1274 NE ARG A 115 -13.076 1.887 -13.634 1.00 0.00 N ATOM 1275 CZ ARG A 115 -14.171 1.149 -13.765 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -15.014 1.301 -14.765 1.00 0.00 N ATOM 1277 NH2 ARG A 115 -14.437 0.231 -12.861 1.00 0.00 N1+ ATOM 0 H ARG A 115 -8.662 4.422 -14.236 1.00 0.00 H new ATOM 0 HA ARG A 115 -9.387 2.490 -12.402 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.689 2.496 -15.437 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -10.514 1.367 -14.381 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -11.206 3.685 -13.131 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -10.974 4.315 -14.750 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -13.287 3.736 -14.619 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -12.548 2.475 -15.586 1.00 0.00 H new ATOM 0 HE ARG A 115 -12.518 1.737 -12.793 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -14.837 2.008 -15.478 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -15.844 0.711 -14.826 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -13.805 0.094 -12.072 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -15.275 -0.344 -12.949 1.00 0.00 H new ATOM 1291 N ASN A 116 -6.978 1.370 -14.313 1.00 0.00 N ATOM 1292 CA ASN A 116 -5.943 0.342 -14.472 1.00 0.00 C ATOM 1293 C ASN A 116 -5.054 0.123 -13.219 1.00 0.00 C ATOM 1294 O ASN A 116 -4.374 -0.900 -13.136 1.00 0.00 O ATOM 1295 CB ASN A 116 -5.128 0.727 -15.717 1.00 0.00 C ATOM 1296 CG ASN A 116 -3.968 -0.217 -16.026 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -2.804 0.136 -15.872 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -4.245 -1.428 -16.479 1.00 0.00 N ATOM 0 H ASN A 116 -6.831 2.176 -14.920 1.00 0.00 H new ATOM 0 HA ASN A 116 -6.420 -0.630 -14.599 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -5.795 0.758 -16.578 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.735 1.735 -15.582 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -3.488 -2.074 -16.702 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -5.215 -1.716 -16.605 1.00 0.00 H new ATOM 1305 N ASP A 117 -5.073 1.019 -12.217 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.376 0.806 -10.937 1.00 0.00 C ATOM 1307 C ASP A 117 -5.068 -0.252 -10.051 1.00 0.00 C ATOM 1308 O ASP A 117 -4.459 -0.751 -9.108 1.00 0.00 O ATOM 1309 CB ASP A 117 -4.276 2.120 -10.141 1.00 0.00 C ATOM 1310 CG ASP A 117 -3.546 3.276 -10.845 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -2.696 3.036 -11.739 1.00 0.00 O ATOM 1312 OD2 ASP A 117 -3.833 4.436 -10.474 1.00 0.00 O1- ATOM 0 H ASP A 117 -5.570 1.908 -12.271 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.381 0.443 -11.195 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -5.285 2.450 -9.893 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.767 1.914 -9.199 1.00 0.00 H new ATOM 1317 N SER A 118 -6.329 -0.603 -10.321 1.00 0.00 N ATOM 1318 CA SER A 118 -7.089 -1.560 -9.500 1.00 0.00 C ATOM 1319 C SER A 118 -6.449 -2.964 -9.485 1.00 0.00 C ATOM 1320 O SER A 118 -6.094 -3.513 -10.535 1.00 0.00 O ATOM 1321 CB SER A 118 -8.549 -1.657 -9.970 1.00 0.00 C ATOM 1322 OG SER A 118 -9.167 -0.378 -10.070 1.00 0.00 O ATOM 0 H SER A 118 -6.854 -0.234 -11.114 1.00 0.00 H new ATOM 0 HA SER A 118 -7.066 -1.174 -8.481 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.585 -2.153 -10.940 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.113 -2.278 -9.274 1.00 0.00 H new ATOM 0 HG SER A 118 -8.950 0.023 -10.937 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.312 -3.563 -8.293 1.00 0.00 N ATOM 1329 CA GLY A 119 -5.623 -4.848 -8.086 1.00 0.00 C ATOM 1330 C GLY A 119 -5.170 -5.087 -6.644 1.00 0.00 C ATOM 1331 O GLY A 119 -5.607 -4.379 -5.735 1.00 0.00 O ATOM 0 H GLY A 119 -6.682 -3.163 -7.431 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.288 -5.658 -8.386 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.753 -4.892 -8.741 1.00 0.00 H new ATOM 1335 N THR A 120 -4.314 -6.095 -6.432 1.00 0.00 N ATOM 1336 CA THR A 120 -3.794 -6.510 -5.112 1.00 0.00 C ATOM 1337 C THR A 120 -2.450 -5.847 -4.821 1.00 0.00 C ATOM 1338 O THR A 120 -1.622 -5.678 -5.718 1.00 0.00 O ATOM 1339 CB THR A 120 -3.633 -8.034 -5.030 1.00 0.00 C ATOM 1340 OG1 THR A 120 -4.711 -8.686 -5.669 1.00 0.00 O ATOM 1341 CG2 THR A 120 -3.563 -8.545 -3.591 1.00 0.00 C ATOM 0 H THR A 120 -3.950 -6.665 -7.195 1.00 0.00 H new ATOM 0 HA THR A 120 -4.522 -6.191 -4.366 1.00 0.00 H new ATOM 0 HB THR A 120 -2.691 -8.260 -5.529 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.589 -9.656 -5.607 1.00 0.00 H new ATOM 0 HG21 THR A 120 -3.449 -9.629 -3.595 1.00 0.00 H new ATOM 0 HG22 THR A 120 -2.710 -8.092 -3.085 1.00 0.00 H new ATOM 0 HG23 THR A 120 -4.480 -8.278 -3.065 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.220 -5.510 -3.553 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.045 -4.780 -3.063 1.00 0.00 C ATOM 1351 C TYR A 121 -0.611 -5.266 -1.663 1.00 0.00 C ATOM 1352 O TYR A 121 -1.440 -5.754 -0.892 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.372 -3.274 -2.995 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.557 -2.549 -4.320 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.777 -2.614 -5.020 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.510 -1.753 -4.823 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -2.933 -1.936 -6.246 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.674 -1.044 -6.028 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.877 -1.146 -6.752 1.00 0.00 C ATOM 1360 OH TYR A 121 -2.001 -0.477 -7.930 1.00 0.00 O ATOM 0 H TYR A 121 -2.873 -5.747 -2.806 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.224 -4.964 -3.755 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.284 -3.151 -2.411 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.572 -2.778 -2.446 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.598 -3.187 -4.615 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.422 -1.686 -4.282 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -3.858 -2.020 -6.797 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.126 -0.420 -6.398 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.842 -0.732 -8.364 1.00 0.00 H new ATOM 1370 N LEU A 122 0.669 -5.094 -1.305 1.00 0.00 N ATOM 1371 CA LEU A 122 1.243 -5.490 -0.006 1.00 0.00 C ATOM 1372 C LEU A 122 2.560 -4.778 0.321 1.00 0.00 C ATOM 1373 O LEU A 122 3.238 -4.254 -0.557 1.00 0.00 O ATOM 1374 CB LEU A 122 1.380 -7.026 0.122 1.00 0.00 C ATOM 1375 CG LEU A 122 2.514 -7.707 -0.681 1.00 0.00 C ATOM 1376 CD1 LEU A 122 2.647 -9.166 -0.220 1.00 0.00 C ATOM 1377 CD2 LEU A 122 2.253 -7.691 -2.195 1.00 0.00 C ATOM 0 H LEU A 122 1.355 -4.664 -1.926 1.00 0.00 H new ATOM 0 HA LEU A 122 0.526 -5.157 0.745 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.522 -7.265 1.176 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.435 -7.475 -0.182 1.00 0.00 H new ATOM 0 HG LEU A 122 3.430 -7.146 -0.494 1.00 0.00 H new ATOM 0 HD11 LEU A 122 3.444 -9.654 -0.781 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.884 -9.191 0.844 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.707 -9.690 -0.395 1.00 0.00 H new ATOM 0 HD21 LEU A 122 3.078 -8.181 -2.712 1.00 0.00 H new ATOM 0 HD22 LEU A 122 1.325 -8.221 -2.410 1.00 0.00 H new ATOM 0 HD23 LEU A 122 2.170 -6.660 -2.539 1.00 0.00 H new ATOM 1389 N CYS A 123 2.931 -4.788 1.599 1.00 0.00 N ATOM 1390 CA CYS A 123 4.162 -4.186 2.132 1.00 0.00 C ATOM 1391 C CYS A 123 5.214 -5.258 2.465 1.00 0.00 C ATOM 1392 O CYS A 123 4.874 -6.430 2.653 1.00 0.00 O ATOM 1393 CB CYS A 123 3.814 -3.411 3.410 1.00 0.00 C ATOM 1394 SG CYS A 123 2.243 -2.517 3.403 1.00 0.00 S ATOM 0 H CYS A 123 2.365 -5.231 2.323 1.00 0.00 H new ATOM 0 HA CYS A 123 4.581 -3.523 1.375 1.00 0.00 H new ATOM 0 HB2 CYS A 123 3.804 -4.113 4.244 1.00 0.00 H new ATOM 0 HB3 CYS A 123 4.613 -2.696 3.605 1.00 0.00 H new ATOM 1399 N GLY A 124 6.479 -4.855 2.617 1.00 0.00 N ATOM 1400 CA GLY A 124 7.551 -5.707 3.140 1.00 0.00 C ATOM 1401 C GLY A 124 8.674 -4.922 3.815 1.00 0.00 C ATOM 1402 O GLY A 124 9.155 -3.938 3.261 1.00 0.00 O ATOM 0 H GLY A 124 6.792 -3.914 2.377 1.00 0.00 H new ATOM 0 HA2 GLY A 124 7.128 -6.411 3.856 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.969 -6.295 2.323 1.00 0.00 H new ATOM 1406 N ALA A 125 9.119 -5.373 4.991 1.00 0.00 N ATOM 1407 CA ALA A 125 10.276 -4.814 5.699 1.00 0.00 C ATOM 1408 C ALA A 125 11.529 -5.673 5.460 1.00 0.00 C ATOM 1409 O ALA A 125 11.498 -6.874 5.713 1.00 0.00 O ATOM 1410 CB ALA A 125 9.943 -4.735 7.195 1.00 0.00 C ATOM 0 H ALA A 125 8.679 -6.149 5.486 1.00 0.00 H new ATOM 0 HA ALA A 125 10.491 -3.815 5.320 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.794 -4.321 7.736 1.00 0.00 H new ATOM 0 HB2 ALA A 125 9.074 -4.094 7.341 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.724 -5.734 7.572 1.00 0.00 H new ATOM 1416 N ILE A 126 12.640 -5.089 5.011 1.00 0.00 N ATOM 1417 CA ILE A 126 13.930 -5.791 4.849 1.00 0.00 C ATOM 1418 C ILE A 126 15.030 -5.108 5.670 1.00 0.00 C ATOM 1419 O ILE A 126 15.175 -3.886 5.627 1.00 0.00 O ATOM 1420 CB ILE A 126 14.289 -5.928 3.350 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.461 -6.918 3.175 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.595 -4.576 2.681 1.00 0.00 C ATOM 1423 CD1 ILE A 126 15.809 -7.237 1.716 1.00 0.00 C ATOM 0 H ILE A 126 12.679 -4.105 4.745 1.00 0.00 H new ATOM 0 HA ILE A 126 13.837 -6.803 5.243 1.00 0.00 H new ATOM 0 HB ILE A 126 13.410 -6.323 2.840 1.00 0.00 H new ATOM 0 HG12 ILE A 126 16.344 -6.507 3.665 1.00 0.00 H new ATOM 0 HG13 ILE A 126 15.215 -7.847 3.689 1.00 0.00 H new ATOM 0 HG21 ILE A 126 14.840 -4.737 1.631 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.722 -3.928 2.755 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.440 -4.105 3.183 1.00 0.00 H new ATOM 0 HD11 ILE A 126 16.642 -7.939 1.686 1.00 0.00 H new ATOM 0 HD12 ILE A 126 14.943 -7.680 1.224 1.00 0.00 H new ATOM 0 HD13 ILE A 126 16.089 -6.319 1.200 1.00 0.00 H new ATOM 1435 N SER A 127 15.788 -5.884 6.438 1.00 0.00 N ATOM 1436 CA SER A 127 16.857 -5.393 7.322 1.00 0.00 C ATOM 1437 C SER A 127 17.987 -4.666 6.562 1.00 0.00 C ATOM 1438 O SER A 127 18.202 -4.899 5.369 1.00 0.00 O ATOM 1439 CB SER A 127 17.449 -6.553 8.144 1.00 0.00 C ATOM 1440 OG SER A 127 16.473 -7.522 8.519 1.00 0.00 O ATOM 0 H SER A 127 15.679 -6.898 6.469 1.00 0.00 H new ATOM 0 HA SER A 127 16.394 -4.662 7.986 1.00 0.00 H new ATOM 0 HB2 SER A 127 18.233 -7.040 7.564 1.00 0.00 H new ATOM 0 HB3 SER A 127 17.919 -6.152 9.042 1.00 0.00 H new ATOM 0 HG SER A 127 16.902 -8.235 9.036 1.00 0.00 H new ATOM 1446 N LEU A 128 18.754 -3.807 7.251 1.00 0.00 N ATOM 1447 CA LEU A 128 19.846 -3.034 6.629 1.00 0.00 C ATOM 1448 C LEU A 128 21.096 -3.875 6.282 1.00 0.00 C ATOM 1449 O LEU A 128 21.956 -3.414 5.527 1.00 0.00 O ATOM 1450 CB LEU A 128 20.216 -1.833 7.524 1.00 0.00 C ATOM 1451 CG LEU A 128 19.062 -0.868 7.879 1.00 0.00 C ATOM 1452 CD1 LEU A 128 19.631 0.361 8.601 1.00 0.00 C ATOM 1453 CD2 LEU A 128 18.258 -0.407 6.654 1.00 0.00 C ATOM 0 H LEU A 128 18.638 -3.628 8.248 1.00 0.00 H new ATOM 0 HA LEU A 128 19.466 -2.677 5.672 1.00 0.00 H new ATOM 0 HB2 LEU A 128 20.641 -2.215 8.452 1.00 0.00 H new ATOM 0 HB3 LEU A 128 20.999 -1.262 7.025 1.00 0.00 H new ATOM 0 HG LEU A 128 18.376 -1.419 8.522 1.00 0.00 H new ATOM 0 HD11 LEU A 128 18.819 1.043 8.853 1.00 0.00 H new ATOM 0 HD12 LEU A 128 20.136 0.045 9.514 1.00 0.00 H new ATOM 0 HD13 LEU A 128 20.343 0.868 7.950 1.00 0.00 H new ATOM 0 HD21 LEU A 128 17.464 0.268 6.973 1.00 0.00 H new ATOM 0 HD22 LEU A 128 18.919 0.112 5.960 1.00 0.00 H new ATOM 0 HD23 LEU A 128 17.820 -1.274 6.159 1.00 0.00 H new ATOM 1465 N ALA A 129 21.211 -5.099 6.812 1.00 0.00 N ATOM 1466 CA ALA A 129 22.291 -6.047 6.517 1.00 0.00 C ATOM 1467 C ALA A 129 22.220 -6.610 5.072 1.00 0.00 C ATOM 1468 O ALA A 129 21.123 -6.706 4.511 1.00 0.00 O ATOM 1469 CB ALA A 129 22.219 -7.172 7.564 1.00 0.00 C ATOM 0 H ALA A 129 20.533 -5.468 7.479 1.00 0.00 H new ATOM 0 HA ALA A 129 23.249 -5.530 6.574 1.00 0.00 H new ATOM 0 HB1 ALA A 129 23.010 -7.897 7.374 1.00 0.00 H new ATOM 0 HB2 ALA A 129 22.345 -6.750 8.561 1.00 0.00 H new ATOM 0 HB3 ALA A 129 21.250 -7.667 7.500 1.00 0.00 H new ATOM 1475 N PRO A 130 23.348 -7.048 4.473 1.00 0.00 N ATOM 1476 CA PRO A 130 23.360 -7.653 3.138 1.00 0.00 C ATOM 1477 C PRO A 130 22.725 -9.056 3.108 1.00 0.00 C ATOM 1478 O PRO A 130 22.230 -9.478 2.066 1.00 0.00 O ATOM 1479 CB PRO A 130 24.837 -7.696 2.733 1.00 0.00 C ATOM 1480 CG PRO A 130 25.573 -7.802 4.067 1.00 0.00 C ATOM 1481 CD PRO A 130 24.705 -6.960 5.001 1.00 0.00 C ATOM 0 HA PRO A 130 22.757 -7.069 2.442 1.00 0.00 H new ATOM 0 HB2 PRO A 130 25.051 -8.548 2.088 1.00 0.00 H new ATOM 0 HB3 PRO A 130 25.128 -6.800 2.184 1.00 0.00 H new ATOM 0 HG2 PRO A 130 25.648 -8.835 4.406 1.00 0.00 H new ATOM 0 HG3 PRO A 130 26.589 -7.414 4.000 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.752 -7.336 6.023 1.00 0.00 H new ATOM 0 HD3 PRO A 130 25.048 -5.926 5.026 1.00 0.00 H new ATOM 1489 N LYS A 131 22.705 -9.771 4.242 1.00 0.00 N ATOM 1490 CA LYS A 131 22.148 -11.130 4.382 1.00 0.00 C ATOM 1491 C LYS A 131 20.638 -11.145 4.746 1.00 0.00 C ATOM 1492 O LYS A 131 20.105 -12.163 5.197 1.00 0.00 O ATOM 1493 CB LYS A 131 23.030 -11.888 5.399 1.00 0.00 C ATOM 1494 CG LYS A 131 23.037 -13.411 5.165 1.00 0.00 C ATOM 1495 CD LYS A 131 23.940 -14.163 6.157 1.00 0.00 C ATOM 1496 CE LYS A 131 23.507 -14.046 7.630 1.00 0.00 C ATOM 1497 NZ LYS A 131 22.185 -14.676 7.889 1.00 0.00 N1+ ATOM 0 H LYS A 131 23.087 -9.411 5.116 1.00 0.00 H new ATOM 0 HA LYS A 131 22.177 -11.638 3.418 1.00 0.00 H new ATOM 0 HB2 LYS A 131 24.051 -11.511 5.339 1.00 0.00 H new ATOM 0 HB3 LYS A 131 22.673 -11.682 6.408 1.00 0.00 H new ATOM 0 HG2 LYS A 131 22.019 -13.791 5.248 1.00 0.00 H new ATOM 0 HG3 LYS A 131 23.372 -13.616 4.148 1.00 0.00 H new ATOM 0 HD2 LYS A 131 23.963 -15.217 5.881 1.00 0.00 H new ATOM 0 HD3 LYS A 131 24.958 -13.786 6.060 1.00 0.00 H new ATOM 0 HE2 LYS A 131 24.259 -14.515 8.264 1.00 0.00 H new ATOM 0 HE3 LYS A 131 23.465 -12.993 7.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 21.941 -14.569 8.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 21.459 -14.213 7.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 22.229 -15.687 7.649 1.00 0.00 H new ATOM 1511 N ALA A 132 19.954 -10.002 4.625 1.00 0.00 N ATOM 1512 CA ALA A 132 18.564 -9.791 5.044 1.00 0.00 C ATOM 1513 C ALA A 132 17.516 -10.590 4.236 1.00 0.00 C ATOM 1514 O ALA A 132 17.799 -11.135 3.166 1.00 0.00 O ATOM 1515 CB ALA A 132 18.286 -8.283 4.979 1.00 0.00 C ATOM 0 H ALA A 132 20.370 -9.165 4.216 1.00 0.00 H new ATOM 0 HA ALA A 132 18.459 -10.175 6.059 1.00 0.00 H new ATOM 0 HB1 ALA A 132 17.258 -8.089 5.285 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.969 -7.758 5.647 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.434 -7.929 3.959 1.00 0.00 H new ATOM 1521 N GLN A 133 16.282 -10.611 4.748 1.00 0.00 N ATOM 1522 CA GLN A 133 15.106 -11.249 4.148 1.00 0.00 C ATOM 1523 C GLN A 133 13.865 -10.379 4.417 1.00 0.00 C ATOM 1524 O GLN A 133 13.784 -9.711 5.451 1.00 0.00 O ATOM 1525 CB GLN A 133 14.959 -12.667 4.737 1.00 0.00 C ATOM 1526 CG GLN A 133 13.844 -13.497 4.080 1.00 0.00 C ATOM 1527 CD GLN A 133 13.822 -14.936 4.602 1.00 0.00 C ATOM 1528 OE1 GLN A 133 14.339 -15.861 3.986 1.00 0.00 O ATOM 1529 NE2 GLN A 133 13.244 -15.186 5.761 1.00 0.00 N ATOM 0 H GLN A 133 16.065 -10.161 5.637 1.00 0.00 H new ATOM 0 HA GLN A 133 15.217 -11.340 3.067 1.00 0.00 H new ATOM 0 HB2 GLN A 133 15.906 -13.196 4.628 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.759 -12.588 5.806 1.00 0.00 H new ATOM 0 HG2 GLN A 133 12.880 -13.026 4.272 1.00 0.00 H new ATOM 0 HG3 GLN A 133 13.986 -13.505 2.999 1.00 0.00 H new ATOM 0 HE21 GLN A 133 12.809 -14.429 6.288 1.00 0.00 H new ATOM 0 HE22 GLN A 133 13.232 -16.137 6.131 1.00 0.00 H new ATOM 1538 N ILE A 134 12.900 -10.372 3.490 1.00 0.00 N ATOM 1539 CA ILE A 134 11.704 -9.513 3.552 1.00 0.00 C ATOM 1540 C ILE A 134 10.640 -10.116 4.484 1.00 0.00 C ATOM 1541 O ILE A 134 10.181 -11.241 4.278 1.00 0.00 O ATOM 1542 CB ILE A 134 11.108 -9.266 2.138 1.00 0.00 C ATOM 1543 CG1 ILE A 134 12.161 -8.781 1.110 1.00 0.00 C ATOM 1544 CG2 ILE A 134 9.966 -8.230 2.235 1.00 0.00 C ATOM 1545 CD1 ILE A 134 11.658 -8.765 -0.340 1.00 0.00 C ATOM 0 H ILE A 134 12.925 -10.969 2.664 1.00 0.00 H new ATOM 0 HA ILE A 134 12.015 -8.551 3.959 1.00 0.00 H new ATOM 0 HB ILE A 134 10.732 -10.224 1.779 1.00 0.00 H new ATOM 0 HG12 ILE A 134 12.484 -7.776 1.383 1.00 0.00 H new ATOM 0 HG13 ILE A 134 13.038 -9.425 1.172 1.00 0.00 H new ATOM 0 HG21 ILE A 134 9.547 -8.056 1.244 1.00 0.00 H new ATOM 0 HG22 ILE A 134 9.187 -8.608 2.897 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.357 -7.294 2.633 1.00 0.00 H new ATOM 0 HD11 ILE A 134 12.454 -8.414 -0.997 1.00 0.00 H new ATOM 0 HD12 ILE A 134 11.363 -9.772 -0.634 1.00 0.00 H new ATOM 0 HD13 ILE A 134 10.800 -8.098 -0.420 1.00 0.00 H new ATOM 1557 N LYS A 135 10.193 -9.342 5.475 1.00 0.00 N ATOM 1558 CA LYS A 135 9.035 -9.647 6.323 1.00 0.00 C ATOM 1559 C LYS A 135 7.775 -9.086 5.629 1.00 0.00 C ATOM 1560 O LYS A 135 7.491 -7.891 5.732 1.00 0.00 O ATOM 1561 CB LYS A 135 9.230 -9.072 7.749 1.00 0.00 C ATOM 1562 CG LYS A 135 10.643 -9.160 8.358 1.00 0.00 C ATOM 1563 CD LYS A 135 11.283 -10.558 8.320 1.00 0.00 C ATOM 1564 CE LYS A 135 12.677 -10.584 8.968 1.00 0.00 C ATOM 1565 NZ LYS A 135 13.629 -9.636 8.327 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.640 -8.458 5.718 1.00 0.00 H new ATOM 0 HA LYS A 135 8.922 -10.724 6.446 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.934 -8.023 7.733 1.00 0.00 H new ATOM 0 HB3 LYS A 135 8.541 -9.588 8.418 1.00 0.00 H new ATOM 0 HG2 LYS A 135 11.294 -8.465 7.828 1.00 0.00 H new ATOM 0 HG3 LYS A 135 10.597 -8.827 9.395 1.00 0.00 H new ATOM 0 HD2 LYS A 135 10.633 -11.266 8.835 1.00 0.00 H new ATOM 0 HD3 LYS A 135 11.361 -10.891 7.285 1.00 0.00 H new ATOM 0 HE2 LYS A 135 12.585 -10.340 10.026 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.082 -11.594 8.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 14.594 -9.835 8.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 13.588 -9.749 7.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 13.370 -8.661 8.579 1.00 0.00 H new ATOM 1579 N GLU A 136 7.078 -9.912 4.845 1.00 0.00 N ATOM 1580 CA GLU A 136 5.932 -9.485 4.026 1.00 0.00 C ATOM 1581 C GLU A 136 4.647 -9.349 4.859 1.00 0.00 C ATOM 1582 O GLU A 136 4.346 -10.188 5.709 1.00 0.00 O ATOM 1583 CB GLU A 136 5.697 -10.465 2.864 1.00 0.00 C ATOM 1584 CG GLU A 136 6.793 -10.380 1.795 1.00 0.00 C ATOM 1585 CD GLU A 136 6.598 -11.455 0.716 1.00 0.00 C ATOM 1586 OE1 GLU A 136 6.918 -12.641 0.974 1.00 0.00 O1- ATOM 1587 OE2 GLU A 136 6.139 -11.124 -0.402 1.00 0.00 O ATOM 0 H GLU A 136 7.292 -10.905 4.757 1.00 0.00 H new ATOM 0 HA GLU A 136 6.178 -8.502 3.624 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.652 -11.482 3.254 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.730 -10.256 2.406 1.00 0.00 H new ATOM 0 HG2 GLU A 136 6.780 -9.392 1.335 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.771 -10.502 2.262 1.00 0.00 H new ATOM 1594 N SER A 137 3.863 -8.309 4.586 1.00 0.00 N ATOM 1595 CA SER A 137 2.550 -8.074 5.204 1.00 0.00 C ATOM 1596 C SER A 137 1.406 -8.823 4.505 1.00 0.00 C ATOM 1597 O SER A 137 1.471 -9.118 3.306 1.00 0.00 O ATOM 1598 CB SER A 137 2.216 -6.576 5.200 1.00 0.00 C ATOM 1599 OG SER A 137 3.095 -5.869 6.053 1.00 0.00 O ATOM 0 H SER A 137 4.124 -7.587 3.915 1.00 0.00 H new ATOM 0 HA SER A 137 2.630 -8.455 6.222 1.00 0.00 H new ATOM 0 HB2 SER A 137 2.291 -6.184 4.186 1.00 0.00 H new ATOM 0 HB3 SER A 137 1.186 -6.426 5.525 1.00 0.00 H new ATOM 0 HG SER A 137 2.873 -4.915 6.033 1.00 0.00 H new ATOM 1605 N LEU A 138 0.315 -9.077 5.239 1.00 0.00 N ATOM 1606 CA LEU A 138 -0.946 -9.557 4.660 1.00 0.00 C ATOM 1607 C LEU A 138 -1.496 -8.501 3.682 1.00 0.00 C ATOM 1608 O LEU A 138 -1.472 -7.307 3.990 1.00 0.00 O ATOM 1609 CB LEU A 138 -1.960 -9.860 5.781 1.00 0.00 C ATOM 1610 CG LEU A 138 -1.515 -10.918 6.813 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -2.590 -11.053 7.901 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -1.263 -12.289 6.166 1.00 0.00 C ATOM 0 H LEU A 138 0.282 -8.955 6.251 1.00 0.00 H new ATOM 0 HA LEU A 138 -0.770 -10.481 4.109 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -2.179 -8.932 6.309 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -2.892 -10.193 5.324 1.00 0.00 H new ATOM 0 HG LEU A 138 -0.574 -10.582 7.248 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -2.277 -11.800 8.631 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -2.726 -10.093 8.399 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -3.531 -11.362 7.446 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -0.952 -13.001 6.931 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -2.179 -12.642 5.693 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -0.479 -12.198 5.415 1.00 0.00 H new ATOM 1624 N ARG A 139 -1.965 -8.931 2.504 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.315 -8.034 1.391 1.00 0.00 C ATOM 1626 C ARG A 139 -3.608 -7.217 1.581 1.00 0.00 C ATOM 1627 O ARG A 139 -4.462 -7.540 2.411 1.00 0.00 O ATOM 1628 CB ARG A 139 -2.283 -8.791 0.044 1.00 0.00 C ATOM 1629 CG ARG A 139 -3.056 -10.115 -0.116 1.00 0.00 C ATOM 1630 CD ARG A 139 -4.570 -10.079 0.140 1.00 0.00 C ATOM 1631 NE ARG A 139 -4.900 -10.180 1.575 1.00 0.00 N ATOM 1632 CZ ARG A 139 -4.995 -11.282 2.311 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -4.791 -12.483 1.811 1.00 0.00 N ATOM 1634 NH2 ARG A 139 -5.296 -11.179 3.586 1.00 0.00 N1+ ATOM 0 H ARG A 139 -2.114 -9.918 2.293 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.537 -7.271 1.380 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -2.651 -8.107 -0.721 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -1.238 -8.996 -0.188 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -2.893 -10.481 -1.130 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -2.616 -10.847 0.561 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -4.982 -9.153 -0.260 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -5.046 -10.898 -0.398 1.00 0.00 H new ATOM 0 HE ARG A 139 -5.076 -9.300 2.059 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -4.551 -12.591 0.826 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -4.873 -13.305 2.409 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -5.454 -10.260 4.000 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -5.372 -12.018 4.161 1.00 0.00 H new ATOM 1648 N ALA A 140 -3.769 -6.195 0.742 1.00 0.00 N ATOM 1649 CA ALA A 140 -4.978 -5.391 0.552 1.00 0.00 C ATOM 1650 C ALA A 140 -5.334 -5.294 -0.946 1.00 0.00 C ATOM 1651 O ALA A 140 -4.532 -5.668 -1.804 1.00 0.00 O ATOM 1652 CB ALA A 140 -4.725 -3.998 1.142 1.00 0.00 C ATOM 0 H ALA A 140 -3.009 -5.885 0.136 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.822 -5.860 1.059 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.614 -3.381 1.012 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.499 -4.088 2.204 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -3.882 -3.534 0.630 1.00 0.00 H new ATOM 1658 N GLU A 141 -6.521 -4.778 -1.263 1.00 0.00 N ATOM 1659 CA GLU A 141 -6.995 -4.546 -2.632 1.00 0.00 C ATOM 1660 C GLU A 141 -7.361 -3.072 -2.858 1.00 0.00 C ATOM 1661 O GLU A 141 -7.942 -2.424 -1.987 1.00 0.00 O ATOM 1662 CB GLU A 141 -8.216 -5.430 -2.935 1.00 0.00 C ATOM 1663 CG GLU A 141 -7.899 -6.927 -2.846 1.00 0.00 C ATOM 1664 CD GLU A 141 -9.092 -7.774 -3.315 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -9.247 -7.980 -4.542 1.00 0.00 O1- ATOM 1666 OE2 GLU A 141 -9.877 -8.252 -2.461 1.00 0.00 O ATOM 0 H GLU A 141 -7.201 -4.501 -0.555 1.00 0.00 H new ATOM 0 HA GLU A 141 -6.181 -4.806 -3.308 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -9.016 -5.190 -2.235 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.587 -5.200 -3.934 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -7.025 -7.154 -3.457 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -7.646 -7.188 -1.818 1.00 0.00 H new ATOM 1673 N LEU A 142 -7.058 -2.560 -4.053 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.456 -1.241 -4.549 1.00 0.00 C ATOM 1675 C LEU A 142 -8.487 -1.395 -5.671 1.00 0.00 C ATOM 1676 O LEU A 142 -8.288 -2.194 -6.590 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.198 -0.515 -5.073 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.438 0.902 -5.638 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -7.015 1.869 -4.593 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.114 1.454 -6.179 1.00 0.00 C ATOM 0 H LEU A 142 -6.502 -3.079 -4.733 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.909 -0.659 -3.746 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.474 -0.446 -4.261 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.745 -1.127 -5.853 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.177 0.819 -6.435 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.163 2.849 -5.047 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.971 1.488 -4.233 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.321 1.957 -3.757 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.274 2.455 -6.580 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.382 1.499 -5.373 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.743 0.801 -6.969 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.536 -0.570 -5.631 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.527 -0.397 -6.694 1.00 0.00 C ATOM 1694 C ARG A 143 -10.665 1.092 -7.037 1.00 0.00 C ATOM 1695 O ARG A 143 -11.010 1.905 -6.177 1.00 0.00 O ATOM 1696 CB ARG A 143 -11.861 -1.001 -6.221 1.00 0.00 C ATOM 1697 CG ARG A 143 -12.963 -0.946 -7.291 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.269 -1.537 -6.749 1.00 0.00 C ATOM 1699 NE ARG A 143 -15.341 -1.479 -7.759 1.00 0.00 N ATOM 1700 CZ ARG A 143 -16.650 -1.520 -7.528 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -17.145 -1.632 -6.312 1.00 0.00 N1+ ATOM 1702 NH2 ARG A 143 -17.493 -1.449 -8.535 1.00 0.00 N ATOM 0 H ARG A 143 -9.725 0.021 -4.821 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.214 -0.912 -7.602 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.699 -2.038 -5.928 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.199 -0.468 -5.332 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.125 0.086 -7.601 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -12.647 -1.499 -8.176 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.105 -2.572 -6.448 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.576 -0.990 -5.857 1.00 0.00 H new ATOM 0 HE ARG A 143 -15.049 -1.399 -8.733 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.518 -1.690 -5.510 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.155 -1.660 -6.173 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.142 -1.363 -9.489 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -18.498 -1.480 -8.362 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.419 1.444 -8.295 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.642 2.786 -8.854 1.00 0.00 C ATOM 1718 C VAL A 144 -11.855 2.731 -9.793 1.00 0.00 C ATOM 1719 O VAL A 144 -11.812 2.090 -10.847 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.393 3.327 -9.583 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -9.640 4.767 -10.071 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.130 3.299 -8.708 1.00 0.00 C ATOM 0 H VAL A 144 -10.047 0.787 -8.981 1.00 0.00 H new ATOM 0 HA VAL A 144 -10.840 3.480 -8.037 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.221 2.664 -10.431 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -8.751 5.135 -10.583 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.486 4.778 -10.759 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -9.859 5.408 -9.217 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.286 3.691 -9.275 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.288 3.913 -7.821 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -7.919 2.273 -8.406 1.00 0.00 H new ATOM 1732 N THR A 145 -12.947 3.388 -9.390 1.00 0.00 N ATOM 1733 CA THR A 145 -14.222 3.469 -10.116 1.00 0.00 C ATOM 1734 C THR A 145 -14.240 4.685 -11.042 1.00 0.00 C ATOM 1735 O THR A 145 -13.505 5.653 -10.838 1.00 0.00 O ATOM 1736 CB THR A 145 -15.408 3.495 -9.135 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.305 4.614 -8.285 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.456 2.229 -8.275 1.00 0.00 C ATOM 0 H THR A 145 -12.969 3.902 -8.509 1.00 0.00 H new ATOM 0 HA THR A 145 -14.323 2.577 -10.735 1.00 0.00 H new ATOM 0 HB THR A 145 -16.321 3.551 -9.728 1.00 0.00 H new ATOM 0 HG1 THR A 145 -16.064 4.625 -7.665 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.306 2.283 -7.595 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.561 1.356 -8.919 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.535 2.146 -7.698 1.00 0.00 H new ATOM 1746 N GLU A 146 -15.054 4.620 -12.096 1.00 0.00 N ATOM 1747 CA GLU A 146 -15.084 5.614 -13.166 1.00 0.00 C ATOM 1748 C GLU A 146 -15.555 7.000 -12.698 1.00 0.00 C ATOM 1749 O GLU A 146 -16.385 7.127 -11.790 1.00 0.00 O ATOM 1750 CB GLU A 146 -15.954 5.082 -14.316 1.00 0.00 C ATOM 1751 CG GLU A 146 -15.365 5.411 -15.688 1.00 0.00 C ATOM 1752 CD GLU A 146 -15.841 4.407 -16.746 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -15.292 3.279 -16.775 1.00 0.00 O1- ATOM 1754 OE2 GLU A 146 -16.757 4.732 -17.539 1.00 0.00 O ATOM 0 H GLU A 146 -15.722 3.861 -12.231 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.061 5.764 -13.513 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -16.061 4.002 -14.218 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -16.954 5.509 -14.240 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.657 6.419 -15.981 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -14.276 5.398 -15.633 1.00 0.00 H new ATOM 1761 N ARG A 147 -15.035 8.046 -13.347 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.277 9.448 -12.995 1.00 0.00 C ATOM 1763 C ARG A 147 -16.749 9.796 -13.231 1.00 0.00 C ATOM 1764 O ARG A 147 -17.248 9.705 -14.358 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.328 10.360 -13.789 1.00 0.00 C ATOM 1766 CG ARG A 147 -14.373 11.810 -13.276 1.00 0.00 C ATOM 1767 CD ARG A 147 -13.316 12.701 -13.942 1.00 0.00 C ATOM 1768 NE ARG A 147 -13.584 12.900 -15.381 1.00 0.00 N ATOM 1769 CZ ARG A 147 -12.972 12.317 -16.408 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -12.004 11.436 -16.248 1.00 0.00 N ATOM 1771 NH2 ARG A 147 -13.338 12.615 -17.636 1.00 0.00 N1+ ATOM 0 H ARG A 147 -14.418 7.938 -14.152 1.00 0.00 H new ATOM 0 HA ARG A 147 -15.069 9.606 -11.937 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.310 9.979 -13.715 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -14.600 10.338 -14.844 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -15.363 12.227 -13.460 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -14.220 11.815 -12.197 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -13.291 13.669 -13.441 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -12.331 12.251 -13.816 1.00 0.00 H new ATOM 0 HE ARG A 147 -14.325 13.561 -15.614 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.699 11.179 -15.309 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -11.561 11.012 -17.063 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -14.087 13.289 -17.796 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.873 12.172 -18.428 1.00 0.00 H new