USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=20 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= -0.554 X(o=-0.55,f=-0.41) 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 32:sc= 0.191 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.0503 X(o=-0.05,f=-0.05) USER MOD Single : A 55 SER OG : rot -71:sc= 1.31 USER MOD Single : A 66 ASN : amide:sc= -0.866 K(o=-0.87,f=-0.13) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl -136:sc= 0 (180deg=-0.0777) USER MOD Single : A 71 SER OG : rot 170:sc= 0.272 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,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 110:sc= 0.653 USER MOD Single : A 99 GLN : amide:sc= 0.749 K(o=0.75,f=-0.32) USER MOD Single : A 102 ASN : amide:sc= 0.851 K(o=0.85,f=-0.3) USER MOD Single : A 108 MET CE :methyl -166:sc= -0.0378 (180deg=-0.431) USER MOD Single : A 116 ASN : amide:sc= -0.0095 X(o=-0.0095,f=-0.0095) USER MOD Single : A 118 SER OG : rot 180:sc= 0.791 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot -5:sc= 0.496 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= 0.0751 X(o=0.075,f=-0.13) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot -93:sc= 0.122 USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 1.326 -6.812 8.335 1.00 0.00 N ATOM 49 CA THR A 36 -0.106 -6.614 8.063 1.00 0.00 C ATOM 50 C THR A 36 -0.279 -5.400 7.153 1.00 0.00 C ATOM 51 O THR A 36 0.500 -4.449 7.229 1.00 0.00 O ATOM 52 CB THR A 36 -0.870 -6.387 9.378 1.00 0.00 C ATOM 53 OG1 THR A 36 -0.570 -7.419 10.292 1.00 0.00 O ATOM 54 CG2 THR A 36 -2.392 -6.389 9.196 1.00 0.00 C ATOM 0 HA THR A 36 -0.506 -7.503 7.574 1.00 0.00 H new ATOM 0 HB THR A 36 -0.555 -5.408 9.740 1.00 0.00 H new ATOM 0 HG1 THR A 36 0.350 -7.726 10.149 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.874 -6.224 10.160 1.00 0.00 H new ATOM 0 HG22 THR A 36 -2.677 -5.594 8.507 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.709 -7.350 8.792 1.00 0.00 H new ATOM 62 N PHE A 37 -1.303 -5.428 6.297 1.00 0.00 N ATOM 63 CA PHE A 37 -1.585 -4.392 5.301 1.00 0.00 C ATOM 64 C PHE A 37 -3.099 -4.288 5.046 1.00 0.00 C ATOM 65 O PHE A 37 -3.738 -5.273 4.672 1.00 0.00 O ATOM 66 CB PHE A 37 -0.792 -4.717 4.027 1.00 0.00 C ATOM 67 CG PHE A 37 -0.809 -3.667 2.936 1.00 0.00 C ATOM 68 CD1 PHE A 37 -0.277 -2.393 3.195 1.00 0.00 C ATOM 69 CD2 PHE A 37 -1.271 -3.980 1.644 1.00 0.00 C ATOM 70 CE1 PHE A 37 -0.189 -1.437 2.170 1.00 0.00 C ATOM 71 CE2 PHE A 37 -1.197 -3.020 0.619 1.00 0.00 C ATOM 72 CZ PHE A 37 -0.653 -1.750 0.880 1.00 0.00 C ATOM 0 H PHE A 37 -1.977 -6.193 6.277 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.269 -3.414 5.663 1.00 0.00 H new ATOM 0 HB2 PHE A 37 0.245 -4.901 4.308 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.179 -5.647 3.612 1.00 0.00 H new ATOM 0 HD1 PHE A 37 0.067 -2.147 4.189 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.682 -4.957 1.440 1.00 0.00 H new ATOM 0 HE1 PHE A 37 0.234 -0.464 2.372 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -1.559 -3.259 -0.370 1.00 0.00 H new ATOM 0 HZ PHE A 37 -0.592 -1.016 0.090 1.00 0.00 H new ATOM 82 N SER A 38 -3.673 -3.105 5.274 1.00 0.00 N ATOM 83 CA SER A 38 -5.131 -2.875 5.303 1.00 0.00 C ATOM 84 C SER A 38 -5.546 -1.535 4.647 1.00 0.00 C ATOM 85 O SER A 38 -4.713 -0.628 4.553 1.00 0.00 O ATOM 86 CB SER A 38 -5.622 -2.899 6.764 1.00 0.00 C ATOM 87 OG SER A 38 -5.370 -4.150 7.394 1.00 0.00 O ATOM 0 H SER A 38 -3.132 -2.258 5.448 1.00 0.00 H new ATOM 0 HA SER A 38 -5.593 -3.674 4.722 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.128 -2.105 7.325 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.691 -2.690 6.790 1.00 0.00 H new ATOM 0 HG SER A 38 -5.695 -4.122 8.318 1.00 0.00 H new ATOM 93 N PRO A 39 -6.820 -1.356 4.227 1.00 0.00 N ATOM 94 CA PRO A 39 -7.900 -2.347 4.217 1.00 0.00 C ATOM 95 C PRO A 39 -7.656 -3.430 3.167 1.00 0.00 C ATOM 96 O PRO A 39 -6.927 -3.216 2.202 1.00 0.00 O ATOM 97 CB PRO A 39 -9.176 -1.565 3.887 1.00 0.00 C ATOM 98 CG PRO A 39 -8.660 -0.410 3.034 1.00 0.00 C ATOM 99 CD PRO A 39 -7.302 -0.101 3.660 1.00 0.00 C ATOM 0 HA PRO A 39 -7.968 -2.859 5.177 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -9.896 -2.178 3.344 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.676 -1.209 4.788 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.566 -0.693 1.986 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.328 0.451 3.073 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.607 0.281 2.912 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.394 0.664 4.431 1.00 0.00 H new ATOM 107 N ALA A 40 -8.300 -4.588 3.341 1.00 0.00 N ATOM 108 CA ALA A 40 -8.264 -5.680 2.363 1.00 0.00 C ATOM 109 C ALA A 40 -8.812 -5.265 0.979 1.00 0.00 C ATOM 110 O ALA A 40 -8.320 -5.749 -0.041 1.00 0.00 O ATOM 111 CB ALA A 40 -9.040 -6.870 2.945 1.00 0.00 C ATOM 0 H ALA A 40 -8.863 -4.795 4.166 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.225 -5.960 2.186 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.027 -7.696 2.234 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.574 -7.187 3.878 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.071 -6.573 3.137 1.00 0.00 H new ATOM 117 N LEU A 41 -9.772 -4.333 0.942 1.00 0.00 N ATOM 118 CA LEU A 41 -10.271 -3.672 -0.271 1.00 0.00 C ATOM 119 C LEU A 41 -10.385 -2.167 -0.006 1.00 0.00 C ATOM 120 O LEU A 41 -11.108 -1.747 0.900 1.00 0.00 O ATOM 121 CB LEU A 41 -11.623 -4.289 -0.693 1.00 0.00 C ATOM 122 CG LEU A 41 -12.402 -3.513 -1.785 1.00 0.00 C ATOM 123 CD1 LEU A 41 -11.657 -3.393 -3.122 1.00 0.00 C ATOM 124 CD2 LEU A 41 -13.757 -4.193 -2.028 1.00 0.00 C ATOM 0 H LEU A 41 -10.240 -4.006 1.787 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.577 -3.823 -1.097 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.443 -5.303 -1.051 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.256 -4.371 0.191 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.526 -2.499 -1.405 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.270 -2.837 -3.831 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.714 -2.868 -2.967 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.457 -4.389 -3.518 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.305 -3.647 -2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.595 -5.219 -2.358 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.334 -4.196 -1.103 1.00 0.00 H new ATOM 136 N LEU A 42 -9.708 -1.363 -0.826 1.00 0.00 N ATOM 137 CA LEU A 42 -9.842 0.092 -0.864 1.00 0.00 C ATOM 138 C LEU A 42 -10.575 0.499 -2.148 1.00 0.00 C ATOM 139 O LEU A 42 -10.120 0.162 -3.241 1.00 0.00 O ATOM 140 CB LEU A 42 -8.433 0.707 -0.795 1.00 0.00 C ATOM 141 CG LEU A 42 -8.397 2.246 -0.811 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.181 2.876 0.352 1.00 0.00 C ATOM 143 CD2 LEU A 42 -6.937 2.698 -0.727 1.00 0.00 C ATOM 0 H LEU A 42 -9.031 -1.717 -1.502 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.426 0.456 -0.019 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -7.943 0.356 0.113 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -7.848 0.335 -1.637 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.870 2.577 -1.735 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.119 3.962 0.287 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.225 2.568 0.296 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.756 2.545 1.299 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.892 3.787 -0.737 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.493 2.325 0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.385 2.304 -1.580 1.00 0.00 H new ATOM 155 N VAL A 43 -11.674 1.247 -2.027 1.00 0.00 N ATOM 156 CA VAL A 43 -12.404 1.827 -3.168 1.00 0.00 C ATOM 157 C VAL A 43 -12.201 3.343 -3.167 1.00 0.00 C ATOM 158 O VAL A 43 -12.498 4.008 -2.174 1.00 0.00 O ATOM 159 CB VAL A 43 -13.917 1.487 -3.162 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.575 1.921 -4.483 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.164 -0.020 -2.962 1.00 0.00 C ATOM 0 H VAL A 43 -12.091 1.473 -1.124 1.00 0.00 H new ATOM 0 HA VAL A 43 -11.998 1.385 -4.078 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.359 2.031 -2.327 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.636 1.674 -4.459 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.456 2.997 -4.613 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.100 1.400 -5.314 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.236 -0.216 -2.964 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.692 -0.577 -3.771 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.739 -0.335 -2.009 1.00 0.00 H new ATOM 171 N VAL A 44 -11.705 3.878 -4.283 1.00 0.00 N ATOM 172 CA VAL A 44 -11.593 5.330 -4.549 1.00 0.00 C ATOM 173 C VAL A 44 -12.234 5.703 -5.892 1.00 0.00 C ATOM 174 O VAL A 44 -12.552 4.822 -6.688 1.00 0.00 O ATOM 175 CB VAL A 44 -10.129 5.824 -4.519 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.493 5.599 -3.140 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.270 5.184 -5.623 1.00 0.00 C ATOM 0 H VAL A 44 -11.358 3.306 -5.053 1.00 0.00 H new ATOM 0 HA VAL A 44 -12.133 5.828 -3.744 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.160 6.896 -4.715 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.463 5.957 -3.151 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -10.059 6.145 -2.385 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.505 4.535 -2.903 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.251 5.565 -5.558 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.262 4.101 -5.496 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.688 5.432 -6.599 1.00 0.00 H new ATOM 187 N THR A 45 -12.386 7.007 -6.154 1.00 0.00 N ATOM 188 CA THR A 45 -12.877 7.556 -7.430 1.00 0.00 C ATOM 189 C THR A 45 -11.705 8.041 -8.283 1.00 0.00 C ATOM 190 O THR A 45 -10.696 8.502 -7.753 1.00 0.00 O ATOM 191 CB THR A 45 -13.883 8.682 -7.162 1.00 0.00 C ATOM 192 OG1 THR A 45 -14.929 8.154 -6.373 1.00 0.00 O ATOM 193 CG2 THR A 45 -14.530 9.234 -8.432 1.00 0.00 C ATOM 0 H THR A 45 -12.166 7.730 -5.469 1.00 0.00 H new ATOM 0 HA THR A 45 -13.390 6.772 -7.987 1.00 0.00 H new ATOM 0 HB THR A 45 -13.334 9.490 -6.678 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.585 8.857 -6.187 1.00 0.00 H new ATOM 0 HG21 THR A 45 -15.230 10.027 -8.169 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.758 9.635 -9.089 1.00 0.00 H new ATOM 0 HG23 THR A 45 -15.064 8.434 -8.945 1.00 0.00 H new ATOM 201 N GLU A 46 -11.836 7.943 -9.605 1.00 0.00 N ATOM 202 CA GLU A 46 -10.824 8.359 -10.574 1.00 0.00 C ATOM 203 C GLU A 46 -10.409 9.828 -10.385 1.00 0.00 C ATOM 204 O GLU A 46 -11.226 10.746 -10.503 1.00 0.00 O ATOM 205 CB GLU A 46 -11.339 8.052 -11.988 1.00 0.00 C ATOM 206 CG GLU A 46 -10.316 8.348 -13.088 1.00 0.00 C ATOM 207 CD GLU A 46 -10.416 9.788 -13.616 1.00 0.00 C ATOM 208 OE1 GLU A 46 -11.354 10.088 -14.387 1.00 0.00 O ATOM 209 OE2 GLU A 46 -9.540 10.616 -13.277 1.00 0.00 O1- ATOM 0 H GLU A 46 -12.674 7.561 -10.044 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.908 7.791 -10.411 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.625 7.002 -12.042 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -12.240 8.637 -12.173 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.312 8.176 -12.701 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.463 7.651 -13.913 1.00 0.00 H new ATOM 216 N GLY A 47 -9.116 10.026 -10.098 1.00 0.00 N ATOM 217 CA GLY A 47 -8.478 11.315 -9.809 1.00 0.00 C ATOM 218 C GLY A 47 -8.348 11.645 -8.320 1.00 0.00 C ATOM 219 O GLY A 47 -7.783 12.687 -7.991 1.00 0.00 O ATOM 0 H GLY A 47 -8.454 9.251 -10.059 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.484 11.322 -10.257 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.051 12.105 -10.294 1.00 0.00 H new ATOM 223 N ASP A 48 -8.826 10.785 -7.416 1.00 0.00 N ATOM 224 CA ASP A 48 -8.601 10.896 -5.968 1.00 0.00 C ATOM 225 C ASP A 48 -7.336 10.124 -5.547 1.00 0.00 C ATOM 226 O ASP A 48 -6.940 9.155 -6.198 1.00 0.00 O ATOM 227 CB ASP A 48 -9.845 10.388 -5.215 1.00 0.00 C ATOM 228 CG ASP A 48 -9.842 10.704 -3.708 1.00 0.00 C ATOM 229 OD1 ASP A 48 -9.233 11.719 -3.295 1.00 0.00 O ATOM 230 OD2 ASP A 48 -10.492 9.948 -2.948 1.00 0.00 O1- ATOM 0 H ASP A 48 -9.391 9.976 -7.673 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.440 11.943 -5.710 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.734 10.829 -5.666 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.922 9.309 -5.349 1.00 0.00 H new ATOM 235 N ASN A 49 -6.698 10.532 -4.448 1.00 0.00 N ATOM 236 CA ASN A 49 -5.594 9.781 -3.854 1.00 0.00 C ATOM 237 C ASN A 49 -6.106 8.613 -2.988 1.00 0.00 C ATOM 238 O ASN A 49 -7.100 8.724 -2.267 1.00 0.00 O ATOM 239 CB ASN A 49 -4.617 10.707 -3.108 1.00 0.00 C ATOM 240 CG ASN A 49 -5.260 11.506 -1.978 1.00 0.00 C ATOM 241 OD1 ASN A 49 -5.423 11.029 -0.861 1.00 0.00 O ATOM 242 ND2 ASN A 49 -5.626 12.749 -2.236 1.00 0.00 N ATOM 0 H ASN A 49 -6.932 11.389 -3.948 1.00 0.00 H new ATOM 0 HA ASN A 49 -5.021 9.328 -4.664 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -3.805 10.107 -2.698 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -4.172 11.400 -3.822 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -6.048 13.319 -1.503 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -5.487 13.139 -3.168 1.00 0.00 H new ATOM 249 N ALA A 50 -5.412 7.480 -3.087 1.00 0.00 N ATOM 250 CA ALA A 50 -5.704 6.223 -2.396 1.00 0.00 C ATOM 251 C ALA A 50 -4.583 5.880 -1.405 1.00 0.00 C ATOM 252 O ALA A 50 -3.414 5.886 -1.802 1.00 0.00 O ATOM 253 CB ALA A 50 -5.841 5.127 -3.462 1.00 0.00 C ATOM 0 H ALA A 50 -4.587 7.410 -3.683 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.628 6.310 -1.824 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.059 4.175 -2.979 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.652 5.382 -4.144 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.909 5.045 -4.021 1.00 0.00 H new ATOM 259 N THR A 51 -4.925 5.558 -0.149 1.00 0.00 N ATOM 260 CA THR A 51 -3.949 5.280 0.918 1.00 0.00 C ATOM 261 C THR A 51 -4.300 4.009 1.683 1.00 0.00 C ATOM 262 O THR A 51 -5.391 3.895 2.242 1.00 0.00 O ATOM 263 CB THR A 51 -3.826 6.474 1.875 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.558 7.637 1.118 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.678 6.286 2.868 1.00 0.00 C ATOM 0 H THR A 51 -5.895 5.482 0.159 1.00 0.00 H new ATOM 0 HA THR A 51 -2.982 5.122 0.441 1.00 0.00 H new ATOM 0 HB THR A 51 -4.761 6.559 2.429 1.00 0.00 H new ATOM 0 HG1 THR A 51 -3.479 8.407 1.719 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.623 7.151 3.528 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.853 5.388 3.461 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.739 6.184 2.324 1.00 0.00 H new ATOM 273 N PHE A 52 -3.343 3.081 1.736 1.00 0.00 N ATOM 274 CA PHE A 52 -3.350 1.882 2.580 1.00 0.00 C ATOM 275 C PHE A 52 -2.450 2.091 3.813 1.00 0.00 C ATOM 276 O PHE A 52 -1.543 2.927 3.785 1.00 0.00 O ATOM 277 CB PHE A 52 -2.834 0.683 1.772 1.00 0.00 C ATOM 278 CG PHE A 52 -3.685 0.254 0.593 1.00 0.00 C ATOM 279 CD1 PHE A 52 -4.712 -0.692 0.774 1.00 0.00 C ATOM 280 CD2 PHE A 52 -3.417 0.756 -0.697 1.00 0.00 C ATOM 281 CE1 PHE A 52 -5.467 -1.132 -0.325 1.00 0.00 C ATOM 282 CE2 PHE A 52 -4.171 0.311 -1.797 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.193 -0.636 -1.609 1.00 0.00 C ATOM 0 H PHE A 52 -2.501 3.147 1.164 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.370 1.692 2.913 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.836 0.921 1.405 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.731 -0.166 2.447 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -4.919 -1.080 1.760 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.632 1.483 -0.840 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -6.259 -1.852 -0.182 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.965 0.696 -2.785 1.00 0.00 H new ATOM 0 HZ PHE A 52 -5.769 -0.983 -2.455 1.00 0.00 H new ATOM 293 N THR A 53 -2.659 1.300 4.870 1.00 0.00 N ATOM 294 CA THR A 53 -1.838 1.278 6.096 1.00 0.00 C ATOM 295 C THR A 53 -1.093 -0.048 6.203 1.00 0.00 C ATOM 296 O THR A 53 -1.708 -1.106 6.075 1.00 0.00 O ATOM 297 CB THR A 53 -2.713 1.482 7.341 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.518 2.630 7.171 1.00 0.00 O ATOM 299 CG2 THR A 53 -1.867 1.693 8.600 1.00 0.00 C ATOM 0 H THR A 53 -3.430 0.633 4.902 1.00 0.00 H new ATOM 0 HA THR A 53 -1.117 2.094 6.039 1.00 0.00 H new ATOM 0 HB THR A 53 -3.319 0.584 7.461 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.077 2.758 7.966 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.522 1.834 9.459 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.235 0.820 8.764 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.240 2.576 8.473 1.00 0.00 H new ATOM 307 N CYS A 54 0.212 0.005 6.481 1.00 0.00 N ATOM 308 CA CYS A 54 1.067 -1.148 6.790 1.00 0.00 C ATOM 309 C CYS A 54 1.592 -1.108 8.237 1.00 0.00 C ATOM 310 O CYS A 54 1.998 -0.056 8.733 1.00 0.00 O ATOM 311 CB CYS A 54 2.247 -1.202 5.810 1.00 0.00 C ATOM 312 SG CYS A 54 3.223 -2.725 5.942 1.00 0.00 S ATOM 0 H CYS A 54 0.724 0.887 6.498 1.00 0.00 H new ATOM 0 HA CYS A 54 0.457 -2.045 6.685 1.00 0.00 H new ATOM 0 HB2 CYS A 54 1.869 -1.109 4.792 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.897 -0.346 5.988 1.00 0.00 H new ATOM 317 N SER A 55 1.645 -2.270 8.887 1.00 0.00 N ATOM 318 CA SER A 55 2.186 -2.480 10.240 1.00 0.00 C ATOM 319 C SER A 55 3.091 -3.725 10.211 1.00 0.00 C ATOM 320 O SER A 55 2.687 -4.738 9.645 1.00 0.00 O ATOM 321 CB SER A 55 1.040 -2.711 11.244 1.00 0.00 C ATOM 322 OG SER A 55 0.043 -1.698 11.207 1.00 0.00 O ATOM 0 H SER A 55 1.297 -3.134 8.470 1.00 0.00 H new ATOM 0 HA SER A 55 2.750 -1.600 10.549 1.00 0.00 H new ATOM 0 HB2 SER A 55 0.575 -3.675 11.038 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.454 -2.766 12.251 1.00 0.00 H new ATOM 0 HG SER A 55 0.401 -0.872 11.594 1.00 0.00 H new ATOM 328 N PHE A 56 4.313 -3.676 10.759 1.00 0.00 N ATOM 329 CA PHE A 56 5.327 -4.731 10.578 1.00 0.00 C ATOM 330 C PHE A 56 6.439 -4.704 11.641 1.00 0.00 C ATOM 331 O PHE A 56 6.735 -3.667 12.235 1.00 0.00 O ATOM 332 CB PHE A 56 5.925 -4.656 9.159 1.00 0.00 C ATOM 333 CG PHE A 56 6.578 -3.323 8.848 1.00 0.00 C ATOM 334 CD1 PHE A 56 5.783 -2.248 8.411 1.00 0.00 C ATOM 335 CD2 PHE A 56 7.958 -3.132 9.050 1.00 0.00 C ATOM 336 CE1 PHE A 56 6.353 -0.983 8.203 1.00 0.00 C ATOM 337 CE2 PHE A 56 8.533 -1.867 8.835 1.00 0.00 C ATOM 338 CZ PHE A 56 7.728 -0.789 8.426 1.00 0.00 C ATOM 0 H PHE A 56 4.630 -2.902 11.343 1.00 0.00 H new ATOM 0 HA PHE A 56 4.812 -5.683 10.708 1.00 0.00 H new ATOM 0 HB2 PHE A 56 6.663 -5.449 9.042 1.00 0.00 H new ATOM 0 HB3 PHE A 56 5.136 -4.844 8.430 1.00 0.00 H new ATOM 0 HD1 PHE A 56 4.728 -2.397 8.235 1.00 0.00 H new ATOM 0 HD2 PHE A 56 8.576 -3.958 9.370 1.00 0.00 H new ATOM 0 HE1 PHE A 56 5.737 -0.160 7.872 1.00 0.00 H new ATOM 0 HE2 PHE A 56 9.593 -1.723 8.984 1.00 0.00 H new ATOM 0 HZ PHE A 56 8.166 0.188 8.283 1.00 0.00 H new ATOM 424 N PHE A 63 16.151 -0.588 8.905 1.00 0.00 N ATOM 425 CA PHE A 63 15.460 -1.451 7.944 1.00 0.00 C ATOM 426 C PHE A 63 15.205 -0.776 6.587 1.00 0.00 C ATOM 427 O PHE A 63 15.243 0.449 6.471 1.00 0.00 O ATOM 428 CB PHE A 63 14.129 -1.925 8.568 1.00 0.00 C ATOM 429 CG PHE A 63 13.136 -0.820 8.888 1.00 0.00 C ATOM 430 CD1 PHE A 63 13.175 -0.188 10.142 1.00 0.00 C ATOM 431 CD2 PHE A 63 12.158 -0.440 7.947 1.00 0.00 C ATOM 432 CE1 PHE A 63 12.239 0.808 10.464 1.00 0.00 C ATOM 433 CE2 PHE A 63 11.230 0.569 8.264 1.00 0.00 C ATOM 434 CZ PHE A 63 11.267 1.191 9.524 1.00 0.00 C ATOM 0 HA PHE A 63 16.113 -2.299 7.736 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.656 -2.630 7.884 1.00 0.00 H new ATOM 0 HB3 PHE A 63 14.350 -2.470 9.486 1.00 0.00 H new ATOM 0 HD1 PHE A 63 13.929 -0.470 10.862 1.00 0.00 H new ATOM 0 HD2 PHE A 63 12.121 -0.924 6.982 1.00 0.00 H new ATOM 0 HE1 PHE A 63 12.266 1.280 11.435 1.00 0.00 H new ATOM 0 HE2 PHE A 63 10.488 0.866 7.538 1.00 0.00 H new ATOM 0 HZ PHE A 63 10.550 1.961 9.769 1.00 0.00 H new ATOM 444 N VAL A 64 14.910 -1.597 5.576 1.00 0.00 N ATOM 445 CA VAL A 64 14.382 -1.184 4.266 1.00 0.00 C ATOM 446 C VAL A 64 12.911 -1.598 4.224 1.00 0.00 C ATOM 447 O VAL A 64 12.585 -2.770 4.409 1.00 0.00 O ATOM 448 CB VAL A 64 15.141 -1.814 3.069 1.00 0.00 C ATOM 449 CG1 VAL A 64 14.553 -1.352 1.724 1.00 0.00 C ATOM 450 CG2 VAL A 64 16.630 -1.434 3.105 1.00 0.00 C ATOM 0 H VAL A 64 15.036 -2.607 5.646 1.00 0.00 H new ATOM 0 HA VAL A 64 14.510 -0.106 4.164 1.00 0.00 H new ATOM 0 HB VAL A 64 15.031 -2.895 3.158 1.00 0.00 H new ATOM 0 HG11 VAL A 64 15.108 -1.812 0.907 1.00 0.00 H new ATOM 0 HG12 VAL A 64 13.506 -1.649 1.664 1.00 0.00 H new ATOM 0 HG13 VAL A 64 14.628 -0.267 1.648 1.00 0.00 H new ATOM 0 HG21 VAL A 64 17.142 -1.887 2.256 1.00 0.00 H new ATOM 0 HG22 VAL A 64 16.730 -0.350 3.053 1.00 0.00 H new ATOM 0 HG23 VAL A 64 17.075 -1.795 4.032 1.00 0.00 H new ATOM 460 N LEU A 65 12.030 -0.632 3.968 1.00 0.00 N ATOM 461 CA LEU A 65 10.609 -0.832 3.693 1.00 0.00 C ATOM 462 C LEU A 65 10.407 -0.772 2.175 1.00 0.00 C ATOM 463 O LEU A 65 11.012 0.069 1.514 1.00 0.00 O ATOM 464 CB LEU A 65 9.812 0.293 4.388 1.00 0.00 C ATOM 465 CG LEU A 65 8.440 -0.112 4.957 1.00 0.00 C ATOM 466 CD1 LEU A 65 7.732 1.152 5.456 1.00 0.00 C ATOM 467 CD2 LEU A 65 7.515 -0.832 3.970 1.00 0.00 C ATOM 0 H LEU A 65 12.299 0.352 3.946 1.00 0.00 H new ATOM 0 HA LEU A 65 10.263 -1.795 4.068 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.418 0.693 5.201 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.663 1.102 3.673 1.00 0.00 H new ATOM 0 HG LEU A 65 8.642 -0.828 5.754 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.757 0.886 5.863 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.334 1.623 6.233 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.601 1.847 4.627 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.575 -1.076 4.464 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.319 -0.184 3.116 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.993 -1.750 3.627 1.00 0.00 H new ATOM 479 N ASN A 66 9.544 -1.624 1.627 1.00 0.00 N ATOM 480 CA ASN A 66 9.153 -1.648 0.219 1.00 0.00 C ATOM 481 C ASN A 66 7.632 -1.844 0.067 1.00 0.00 C ATOM 482 O ASN A 66 6.982 -2.511 0.877 1.00 0.00 O ATOM 483 CB ASN A 66 9.893 -2.786 -0.503 1.00 0.00 C ATOM 484 CG ASN A 66 11.415 -2.710 -0.409 1.00 0.00 C ATOM 485 OD1 ASN A 66 12.072 -3.622 0.078 1.00 0.00 O ATOM 486 ND2 ASN A 66 12.024 -1.634 -0.877 1.00 0.00 N ATOM 0 H ASN A 66 9.078 -2.347 2.175 1.00 0.00 H new ATOM 0 HA ASN A 66 9.421 -0.690 -0.226 1.00 0.00 H new ATOM 0 HB2 ASN A 66 9.563 -3.738 -0.088 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.606 -2.780 -1.554 1.00 0.00 H new ATOM 0 HD21 ASN A 66 13.041 -1.563 -0.833 1.00 0.00 H new ATOM 0 HD22 ASN A 66 11.477 -0.874 -1.283 1.00 0.00 H new ATOM 493 N TRP A 67 7.066 -1.285 -1.002 1.00 0.00 N ATOM 494 CA TRP A 67 5.660 -1.453 -1.381 1.00 0.00 C ATOM 495 C TRP A 67 5.544 -1.983 -2.816 1.00 0.00 C ATOM 496 O TRP A 67 6.288 -1.543 -3.695 1.00 0.00 O ATOM 497 CB TRP A 67 4.972 -0.096 -1.212 1.00 0.00 C ATOM 498 CG TRP A 67 3.520 -0.028 -1.566 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.595 -1.002 -1.405 1.00 0.00 C ATOM 500 CD2 TRP A 67 2.797 1.113 -2.111 1.00 0.00 C ATOM 501 NE1 TRP A 67 1.370 -0.562 -1.860 1.00 0.00 N ATOM 502 CE2 TRP A 67 1.430 0.746 -2.291 1.00 0.00 C ATOM 503 CE3 TRP A 67 3.160 2.438 -2.430 1.00 0.00 C ATOM 504 CZ2 TRP A 67 0.467 1.653 -2.755 1.00 0.00 C ATOM 505 CZ3 TRP A 67 2.202 3.361 -2.879 1.00 0.00 C ATOM 506 CH2 TRP A 67 0.862 2.971 -3.033 1.00 0.00 C ATOM 0 H TRP A 67 7.584 -0.687 -1.646 1.00 0.00 H new ATOM 0 HA TRP A 67 5.172 -2.190 -0.744 1.00 0.00 H new ATOM 0 HB2 TRP A 67 5.083 0.215 -0.173 1.00 0.00 H new ATOM 0 HB3 TRP A 67 5.505 0.634 -1.822 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.787 -1.978 -0.983 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.525 -1.133 -1.876 1.00 0.00 H new ATOM 0 HE3 TRP A 67 4.190 2.747 -2.327 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -0.558 1.344 -2.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 2.497 4.375 -3.107 1.00 0.00 H new ATOM 0 HH2 TRP A 67 0.130 3.691 -3.368 1.00 0.00 H new ATOM 517 N TYR A 68 4.629 -2.929 -3.055 1.00 0.00 N ATOM 518 CA TYR A 68 4.516 -3.673 -4.311 1.00 0.00 C ATOM 519 C TYR A 68 3.084 -3.758 -4.870 1.00 0.00 C ATOM 520 O TYR A 68 2.112 -3.857 -4.114 1.00 0.00 O ATOM 521 CB TYR A 68 5.024 -5.107 -4.095 1.00 0.00 C ATOM 522 CG TYR A 68 6.429 -5.232 -3.539 1.00 0.00 C ATOM 523 CD1 TYR A 68 7.534 -5.213 -4.411 1.00 0.00 C ATOM 524 CD2 TYR A 68 6.627 -5.401 -2.154 1.00 0.00 C ATOM 525 CE1 TYR A 68 8.837 -5.371 -3.904 1.00 0.00 C ATOM 526 CE2 TYR A 68 7.928 -5.564 -1.640 1.00 0.00 C ATOM 527 CZ TYR A 68 9.039 -5.557 -2.518 1.00 0.00 C ATOM 528 OH TYR A 68 10.303 -5.732 -2.040 1.00 0.00 O ATOM 0 H TYR A 68 3.931 -3.204 -2.364 1.00 0.00 H new ATOM 0 HA TYR A 68 5.114 -3.123 -5.038 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.339 -5.617 -3.418 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.982 -5.635 -5.048 1.00 0.00 H new ATOM 0 HD1 TYR A 68 7.381 -5.077 -5.471 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.779 -5.406 -1.485 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.683 -5.350 -4.575 1.00 0.00 H new ATOM 0 HE2 TYR A 68 8.078 -5.694 -0.578 1.00 0.00 H new ATOM 0 HH TYR A 68 10.272 -5.845 -1.067 1.00 0.00 H new ATOM 538 N ARG A 69 2.977 -3.794 -6.204 1.00 0.00 N ATOM 539 CA ARG A 69 1.761 -4.137 -6.962 1.00 0.00 C ATOM 540 C ARG A 69 1.970 -5.506 -7.615 1.00 0.00 C ATOM 541 O ARG A 69 3.070 -5.776 -8.098 1.00 0.00 O ATOM 542 CB ARG A 69 1.486 -3.082 -8.047 1.00 0.00 C ATOM 543 CG ARG A 69 0.175 -3.355 -8.797 1.00 0.00 C ATOM 544 CD ARG A 69 -0.139 -2.261 -9.820 1.00 0.00 C ATOM 545 NE ARG A 69 -1.449 -2.498 -10.450 1.00 0.00 N ATOM 546 CZ ARG A 69 -1.941 -1.861 -11.505 1.00 0.00 C ATOM 547 NH1 ARG A 69 -1.269 -0.927 -12.145 1.00 0.00 N1+ ATOM 548 NH2 ARG A 69 -3.140 -2.143 -11.956 1.00 0.00 N ATOM 0 H ARG A 69 3.766 -3.576 -6.812 1.00 0.00 H new ATOM 0 HA ARG A 69 0.905 -4.164 -6.287 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.442 -2.094 -7.589 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.313 -3.068 -8.757 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.241 -4.317 -9.304 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.644 -3.428 -8.081 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.136 -1.287 -9.331 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.638 -2.236 -10.584 1.00 0.00 H new ATOM 0 HE ARG A 69 -2.035 -3.222 -10.035 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -0.333 -0.669 -11.834 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -1.685 -0.462 -12.952 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -3.703 -2.858 -11.495 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -3.509 -1.648 -12.768 1.00 0.00 H new ATOM 562 N MET A 70 0.948 -6.360 -7.664 1.00 0.00 N ATOM 563 CA MET A 70 1.029 -7.663 -8.339 1.00 0.00 C ATOM 564 C MET A 70 0.704 -7.569 -9.837 1.00 0.00 C ATOM 565 O MET A 70 -0.156 -6.791 -10.251 1.00 0.00 O ATOM 566 CB MET A 70 0.121 -8.699 -7.673 1.00 0.00 C ATOM 567 CG MET A 70 0.394 -8.826 -6.168 1.00 0.00 C ATOM 568 SD MET A 70 -0.152 -10.391 -5.444 1.00 0.00 S ATOM 569 CE MET A 70 1.184 -11.457 -6.051 1.00 0.00 C ATOM 0 H MET A 70 0.040 -6.172 -7.239 1.00 0.00 H new ATOM 0 HA MET A 70 2.065 -7.989 -8.242 1.00 0.00 H new ATOM 0 HB2 MET A 70 -0.921 -8.420 -7.829 1.00 0.00 H new ATOM 0 HB3 MET A 70 0.267 -9.668 -8.150 1.00 0.00 H new ATOM 0 HG2 MET A 70 1.464 -8.712 -5.993 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.103 -8.006 -5.650 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.763 -12.391 -6.424 1.00 0.00 H new ATOM 0 HE2 MET A 70 1.715 -10.951 -6.857 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.877 -11.671 -5.237 1.00 0.00 H new ATOM 579 N SER A 71 1.361 -8.388 -10.652 1.00 0.00 N ATOM 580 CA SER A 71 1.081 -8.512 -12.091 1.00 0.00 C ATOM 581 C SER A 71 -0.002 -9.577 -12.399 1.00 0.00 C ATOM 582 O SER A 71 -0.290 -10.425 -11.542 1.00 0.00 O ATOM 583 CB SER A 71 2.382 -8.817 -12.853 1.00 0.00 C ATOM 584 OG SER A 71 2.754 -10.188 -12.772 1.00 0.00 O ATOM 0 H SER A 71 2.115 -8.996 -10.333 1.00 0.00 H new ATOM 0 HA SER A 71 0.679 -7.557 -12.430 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.260 -8.539 -13.900 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.187 -8.201 -12.451 1.00 0.00 H new ATOM 0 HG SER A 71 3.488 -10.365 -13.397 1.00 0.00 H new ATOM 590 N PRO A 72 -0.578 -9.593 -13.624 1.00 0.00 N ATOM 591 CA PRO A 72 -1.461 -10.667 -14.093 1.00 0.00 C ATOM 592 C PRO A 72 -0.794 -12.051 -14.091 1.00 0.00 C ATOM 593 O PRO A 72 -1.471 -13.060 -13.907 1.00 0.00 O ATOM 594 CB PRO A 72 -1.875 -10.275 -15.518 1.00 0.00 C ATOM 595 CG PRO A 72 -1.689 -8.761 -15.549 1.00 0.00 C ATOM 596 CD PRO A 72 -0.478 -8.558 -14.645 1.00 0.00 C ATOM 0 HA PRO A 72 -2.312 -10.763 -13.418 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -1.254 -10.769 -16.265 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -2.908 -10.555 -15.726 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.507 -8.395 -16.560 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.568 -8.237 -15.174 1.00 0.00 H new ATOM 0 HD2 PRO A 72 0.451 -8.649 -15.207 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -0.484 -7.564 -14.198 1.00 0.00 H new ATOM 604 N SER A 73 0.532 -12.110 -14.266 1.00 0.00 N ATOM 605 CA SER A 73 1.336 -13.343 -14.206 1.00 0.00 C ATOM 606 C SER A 73 1.662 -13.789 -12.764 1.00 0.00 C ATOM 607 O SER A 73 2.379 -14.774 -12.568 1.00 0.00 O ATOM 608 CB SER A 73 2.642 -13.149 -14.998 1.00 0.00 C ATOM 609 OG SER A 73 2.394 -12.738 -16.340 1.00 0.00 O ATOM 0 H SER A 73 1.093 -11.280 -14.459 1.00 0.00 H new ATOM 0 HA SER A 73 0.733 -14.135 -14.651 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.262 -12.404 -14.499 1.00 0.00 H new ATOM 0 HB3 SER A 73 3.206 -14.082 -15.002 1.00 0.00 H new ATOM 0 HG SER A 73 3.246 -12.624 -16.810 1.00 0.00 H new ATOM 615 N ASN A 74 1.170 -13.062 -11.750 1.00 0.00 N ATOM 616 CA ASN A 74 1.355 -13.292 -10.307 1.00 0.00 C ATOM 617 C ASN A 74 2.769 -12.929 -9.810 1.00 0.00 C ATOM 618 O ASN A 74 3.205 -13.399 -8.755 1.00 0.00 O ATOM 619 CB ASN A 74 0.906 -14.705 -9.872 1.00 0.00 C ATOM 620 CG ASN A 74 -0.500 -15.055 -10.348 1.00 0.00 C ATOM 621 OD1 ASN A 74 -1.496 -14.623 -9.776 1.00 0.00 O ATOM 622 ND2 ASN A 74 -0.626 -15.847 -11.399 1.00 0.00 N ATOM 0 H ASN A 74 0.592 -12.241 -11.927 1.00 0.00 H new ATOM 0 HA ASN A 74 0.686 -12.593 -9.805 1.00 0.00 H new ATOM 0 HB2 ASN A 74 1.610 -15.440 -10.262 1.00 0.00 H new ATOM 0 HB3 ASN A 74 0.943 -14.774 -8.785 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -1.554 -16.101 -11.738 1.00 0.00 H new ATOM 0 HD22 ASN A 74 0.205 -16.204 -11.871 1.00 0.00 H new ATOM 629 N GLN A 75 3.488 -12.085 -10.559 1.00 0.00 N ATOM 630 CA GLN A 75 4.746 -11.475 -10.115 1.00 0.00 C ATOM 631 C GLN A 75 4.447 -10.159 -9.369 1.00 0.00 C ATOM 632 O GLN A 75 3.280 -9.850 -9.107 1.00 0.00 O ATOM 633 CB GLN A 75 5.704 -11.286 -11.310 1.00 0.00 C ATOM 634 CG GLN A 75 5.992 -12.597 -12.066 1.00 0.00 C ATOM 635 CD GLN A 75 6.978 -12.389 -13.218 1.00 0.00 C ATOM 636 OE1 GLN A 75 6.607 -12.277 -14.381 1.00 0.00 O ATOM 637 NE2 GLN A 75 8.269 -12.314 -12.950 1.00 0.00 N ATOM 0 H GLN A 75 3.210 -11.804 -11.499 1.00 0.00 H new ATOM 0 HA GLN A 75 5.255 -12.137 -9.414 1.00 0.00 H new ATOM 0 HB2 GLN A 75 5.274 -10.561 -12.002 1.00 0.00 H new ATOM 0 HB3 GLN A 75 6.644 -10.866 -10.952 1.00 0.00 H new ATOM 0 HG2 GLN A 75 6.395 -13.335 -11.372 1.00 0.00 H new ATOM 0 HG3 GLN A 75 5.059 -13.003 -12.456 1.00 0.00 H new ATOM 0 HE21 GLN A 75 8.596 -12.405 -11.988 1.00 0.00 H new ATOM 0 HE22 GLN A 75 8.939 -12.165 -13.705 1.00 0.00 H new ATOM 646 N THR A 76 5.478 -9.380 -9.017 1.00 0.00 N ATOM 647 CA THR A 76 5.382 -8.152 -8.211 1.00 0.00 C ATOM 648 C THR A 76 6.323 -7.085 -8.740 1.00 0.00 C ATOM 649 O THR A 76 7.446 -7.389 -9.144 1.00 0.00 O ATOM 650 CB THR A 76 5.702 -8.398 -6.726 1.00 0.00 C ATOM 651 OG1 THR A 76 6.791 -9.288 -6.578 1.00 0.00 O ATOM 652 CG2 THR A 76 4.501 -8.965 -5.973 1.00 0.00 C ATOM 0 H THR A 76 6.436 -9.593 -9.294 1.00 0.00 H new ATOM 0 HA THR A 76 4.348 -7.815 -8.291 1.00 0.00 H new ATOM 0 HB THR A 76 5.961 -7.428 -6.302 1.00 0.00 H new ATOM 0 HG1 THR A 76 6.974 -9.425 -5.625 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.769 -9.124 -4.928 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.670 -8.262 -6.032 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.206 -9.914 -6.421 1.00 0.00 H new ATOM 660 N ASP A 77 5.877 -5.832 -8.696 1.00 0.00 N ATOM 661 CA ASP A 77 6.667 -4.657 -9.068 1.00 0.00 C ATOM 662 C ASP A 77 6.746 -3.662 -7.908 1.00 0.00 C ATOM 663 O ASP A 77 5.726 -3.317 -7.308 1.00 0.00 O ATOM 664 CB ASP A 77 6.020 -3.994 -10.287 1.00 0.00 C ATOM 665 CG ASP A 77 6.924 -2.948 -10.964 1.00 0.00 C ATOM 666 OD1 ASP A 77 8.141 -3.205 -11.120 1.00 0.00 O ATOM 667 OD2 ASP A 77 6.399 -1.887 -11.376 1.00 0.00 O1- ATOM 0 H ASP A 77 4.932 -5.598 -8.393 1.00 0.00 H new ATOM 0 HA ASP A 77 7.683 -4.970 -9.309 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.759 -4.763 -11.014 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.090 -3.516 -9.981 1.00 0.00 H new ATOM 672 N LYS A 78 7.956 -3.193 -7.602 1.00 0.00 N ATOM 673 CA LYS A 78 8.208 -2.208 -6.543 1.00 0.00 C ATOM 674 C LYS A 78 7.697 -0.812 -6.965 1.00 0.00 C ATOM 675 O LYS A 78 7.844 -0.402 -8.119 1.00 0.00 O ATOM 676 CB LYS A 78 9.706 -2.219 -6.177 1.00 0.00 C ATOM 677 CG LYS A 78 10.020 -1.463 -4.869 1.00 0.00 C ATOM 678 CD LYS A 78 11.530 -1.228 -4.685 1.00 0.00 C ATOM 679 CE LYS A 78 12.305 -2.474 -4.225 1.00 0.00 C ATOM 680 NZ LYS A 78 13.726 -2.411 -4.659 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.802 -3.489 -8.088 1.00 0.00 H new ATOM 0 HA LYS A 78 7.651 -2.475 -5.645 1.00 0.00 H new ATOM 0 HB2 LYS A 78 10.042 -3.251 -6.081 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.275 -1.773 -6.992 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.502 -0.504 -4.872 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.636 -2.031 -4.021 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.951 -0.879 -5.628 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.677 -0.431 -3.956 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.256 -2.556 -3.139 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.836 -3.369 -4.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.226 -3.264 -4.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.770 -2.356 -5.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 14.177 -1.569 -4.249 1.00 0.00 H new ATOM 694 N LEU A 79 7.056 -0.110 -6.026 1.00 0.00 N ATOM 695 CA LEU A 79 6.341 1.158 -6.234 1.00 0.00 C ATOM 696 C LEU A 79 7.005 2.319 -5.489 1.00 0.00 C ATOM 697 O LEU A 79 7.198 3.395 -6.049 1.00 0.00 O ATOM 698 CB LEU A 79 4.911 0.986 -5.697 1.00 0.00 C ATOM 699 CG LEU A 79 4.102 -0.164 -6.322 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.841 -0.314 -5.470 1.00 0.00 C ATOM 701 CD2 LEU A 79 3.762 0.112 -7.792 1.00 0.00 C ATOM 0 H LEU A 79 7.018 -0.422 -5.056 1.00 0.00 H new ATOM 0 HA LEU A 79 6.352 1.393 -7.298 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.963 0.827 -4.620 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.368 1.917 -5.856 1.00 0.00 H new ATOM 0 HG LEU A 79 4.681 -1.087 -6.328 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.226 -1.120 -5.869 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.122 -0.546 -4.443 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.276 0.618 -5.490 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.191 -0.724 -8.196 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.170 1.025 -7.863 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.683 0.231 -8.362 1.00 0.00 H new ATOM 713 N ALA A 80 7.355 2.089 -4.222 1.00 0.00 N ATOM 714 CA ALA A 80 8.003 3.034 -3.321 1.00 0.00 C ATOM 715 C ALA A 80 8.749 2.268 -2.216 1.00 0.00 C ATOM 716 O ALA A 80 8.575 1.054 -2.057 1.00 0.00 O ATOM 717 CB ALA A 80 6.957 4.010 -2.756 1.00 0.00 C ATOM 0 H ALA A 80 7.183 1.188 -3.776 1.00 0.00 H new ATOM 0 HA ALA A 80 8.742 3.626 -3.862 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.444 4.715 -2.083 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.488 4.555 -3.575 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.197 3.452 -2.209 1.00 0.00 H new ATOM 723 N ALA A 81 9.579 2.984 -1.458 1.00 0.00 N ATOM 724 CA ALA A 81 10.453 2.420 -0.435 1.00 0.00 C ATOM 725 C ALA A 81 10.840 3.461 0.628 1.00 0.00 C ATOM 726 O ALA A 81 10.704 4.665 0.400 1.00 0.00 O ATOM 727 CB ALA A 81 11.694 1.836 -1.132 1.00 0.00 C ATOM 0 H ALA A 81 9.663 3.997 -1.542 1.00 0.00 H new ATOM 0 HA ALA A 81 9.923 1.631 0.099 1.00 0.00 H new ATOM 0 HB1 ALA A 81 12.363 1.408 -0.385 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.386 1.059 -1.832 1.00 0.00 H new ATOM 0 HB3 ALA A 81 12.213 2.627 -1.673 1.00 0.00 H new ATOM 733 N PHE A 82 11.346 2.993 1.771 1.00 0.00 N ATOM 734 CA PHE A 82 11.871 3.839 2.844 1.00 0.00 C ATOM 735 C PHE A 82 13.007 3.115 3.604 1.00 0.00 C ATOM 736 O PHE A 82 12.708 2.147 4.309 1.00 0.00 O ATOM 737 CB PHE A 82 10.720 4.261 3.769 1.00 0.00 C ATOM 738 CG PHE A 82 11.091 5.414 4.676 1.00 0.00 C ATOM 739 CD1 PHE A 82 11.157 6.719 4.149 1.00 0.00 C ATOM 740 CD2 PHE A 82 11.388 5.186 6.032 1.00 0.00 C ATOM 741 CE1 PHE A 82 11.506 7.795 4.986 1.00 0.00 C ATOM 742 CE2 PHE A 82 11.732 6.263 6.867 1.00 0.00 C ATOM 743 CZ PHE A 82 11.791 7.568 6.344 1.00 0.00 C ATOM 0 H PHE A 82 11.403 1.996 1.980 1.00 0.00 H new ATOM 0 HA PHE A 82 12.309 4.743 2.421 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.858 4.543 3.164 1.00 0.00 H new ATOM 0 HB3 PHE A 82 10.417 3.409 4.377 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.940 6.893 3.105 1.00 0.00 H new ATOM 0 HD2 PHE A 82 11.352 4.183 6.431 1.00 0.00 H new ATOM 0 HE1 PHE A 82 11.555 8.797 4.585 1.00 0.00 H new ATOM 0 HE2 PHE A 82 11.951 6.089 7.910 1.00 0.00 H new ATOM 0 HZ PHE A 82 12.055 8.395 6.986 1.00 0.00 H new ATOM 753 N PRO A 83 14.287 3.536 3.494 1.00 0.00 N ATOM 754 CA PRO A 83 14.822 4.596 2.634 1.00 0.00 C ATOM 755 C PRO A 83 14.420 4.454 1.162 1.00 0.00 C ATOM 756 O PRO A 83 14.297 3.345 0.644 1.00 0.00 O ATOM 757 CB PRO A 83 16.345 4.542 2.795 1.00 0.00 C ATOM 758 CG PRO A 83 16.528 3.951 4.190 1.00 0.00 C ATOM 759 CD PRO A 83 15.369 2.963 4.285 1.00 0.00 C ATOM 0 HA PRO A 83 14.408 5.557 2.938 1.00 0.00 H new ATOM 0 HB2 PRO A 83 16.809 3.919 2.030 1.00 0.00 H new ATOM 0 HB3 PRO A 83 16.794 5.532 2.715 1.00 0.00 H new ATOM 0 HG2 PRO A 83 17.493 3.456 4.297 1.00 0.00 H new ATOM 0 HG3 PRO A 83 16.474 4.716 4.965 1.00 0.00 H new ATOM 0 HD2 PRO A 83 15.658 1.985 3.901 1.00 0.00 H new ATOM 0 HD3 PRO A 83 15.062 2.820 5.321 1.00 0.00 H new ATOM 907 N ARG A 94 4.091 9.343 -8.412 1.00 0.00 N ATOM 908 CA ARG A 94 2.698 9.122 -7.990 1.00 0.00 C ATOM 909 C ARG A 94 2.594 8.257 -6.728 1.00 0.00 C ATOM 910 O ARG A 94 1.608 8.375 -5.997 1.00 0.00 O ATOM 911 CB ARG A 94 1.901 8.439 -9.107 1.00 0.00 C ATOM 912 CG ARG A 94 1.706 9.342 -10.333 1.00 0.00 C ATOM 913 CD ARG A 94 1.038 8.554 -11.463 1.00 0.00 C ATOM 914 NE ARG A 94 -0.388 8.306 -11.175 1.00 0.00 N ATOM 915 CZ ARG A 94 -1.016 7.138 -11.101 1.00 0.00 C ATOM 916 NH1 ARG A 94 -0.413 5.974 -11.228 1.00 0.00 N ATOM 917 NH2 ARG A 94 -2.309 7.126 -10.895 1.00 0.00 N1+ ATOM 0 HA ARG A 94 2.287 10.107 -7.769 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.416 7.528 -9.410 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.926 8.141 -8.722 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.093 10.203 -10.067 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.669 9.728 -10.668 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.131 9.106 -12.398 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.554 7.604 -11.601 1.00 0.00 H new ATOM 0 HE ARG A 94 -0.962 9.133 -11.013 1.00 0.00 H new ATOM 0 HH11 ARG A 94 0.593 5.936 -11.393 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -0.952 5.111 -11.161 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -2.818 8.004 -10.794 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.808 6.238 -10.835 1.00 0.00 H new ATOM 931 N PHE A 95 3.574 7.386 -6.479 1.00 0.00 N ATOM 932 CA PHE A 95 3.642 6.513 -5.305 1.00 0.00 C ATOM 933 C PHE A 95 4.494 7.147 -4.193 1.00 0.00 C ATOM 934 O PHE A 95 5.569 7.691 -4.465 1.00 0.00 O ATOM 935 CB PHE A 95 4.203 5.146 -5.728 1.00 0.00 C ATOM 936 CG PHE A 95 3.445 4.496 -6.871 1.00 0.00 C ATOM 937 CD1 PHE A 95 2.102 4.107 -6.697 1.00 0.00 C ATOM 938 CD2 PHE A 95 4.068 4.312 -8.120 1.00 0.00 C ATOM 939 CE1 PHE A 95 1.382 3.554 -7.772 1.00 0.00 C ATOM 940 CE2 PHE A 95 3.348 3.759 -9.194 1.00 0.00 C ATOM 941 CZ PHE A 95 2.003 3.384 -9.022 1.00 0.00 C ATOM 0 H PHE A 95 4.367 7.265 -7.109 1.00 0.00 H new ATOM 0 HA PHE A 95 2.640 6.376 -4.899 1.00 0.00 H new ATOM 0 HB2 PHE A 95 5.246 5.267 -6.020 1.00 0.00 H new ATOM 0 HB3 PHE A 95 4.188 4.476 -4.868 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.624 4.234 -5.737 1.00 0.00 H new ATOM 0 HD2 PHE A 95 5.101 4.596 -8.254 1.00 0.00 H new ATOM 0 HE1 PHE A 95 0.352 3.260 -7.637 1.00 0.00 H new ATOM 0 HE2 PHE A 95 3.828 3.622 -10.152 1.00 0.00 H new ATOM 0 HZ PHE A 95 1.448 2.966 -9.849 1.00 0.00 H new ATOM 951 N ARG A 96 4.035 7.055 -2.937 1.00 0.00 N ATOM 952 CA ARG A 96 4.753 7.559 -1.753 1.00 0.00 C ATOM 953 C ARG A 96 4.544 6.656 -0.528 1.00 0.00 C ATOM 954 O ARG A 96 3.494 6.027 -0.398 1.00 0.00 O ATOM 955 CB ARG A 96 4.293 9.005 -1.454 1.00 0.00 C ATOM 956 CG ARG A 96 5.343 9.817 -0.674 1.00 0.00 C ATOM 957 CD ARG A 96 4.841 11.218 -0.295 1.00 0.00 C ATOM 958 NE ARG A 96 3.956 11.177 0.884 1.00 0.00 N ATOM 959 CZ ARG A 96 2.975 12.020 1.182 1.00 0.00 C ATOM 960 NH1 ARG A 96 2.629 13.017 0.393 1.00 0.00 N1+ ATOM 961 NH2 ARG A 96 2.324 11.859 2.312 1.00 0.00 N ATOM 0 H ARG A 96 3.140 6.622 -2.709 1.00 0.00 H new ATOM 0 HA ARG A 96 5.821 7.553 -1.970 1.00 0.00 H new ATOM 0 HB2 ARG A 96 4.072 9.513 -2.393 1.00 0.00 H new ATOM 0 HB3 ARG A 96 3.365 8.975 -0.882 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.617 9.276 0.231 1.00 0.00 H new ATOM 0 HG3 ARG A 96 6.247 9.909 -1.276 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.692 11.867 -0.089 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.305 11.653 -1.138 1.00 0.00 H new ATOM 0 HE ARG A 96 4.116 10.416 1.544 1.00 0.00 H new ATOM 0 HH11 ARG A 96 3.122 13.165 -0.488 1.00 0.00 H new ATOM 0 HH12 ARG A 96 1.868 13.640 0.663 1.00 0.00 H new ATOM 0 HH21 ARG A 96 2.576 11.097 2.942 1.00 0.00 H new ATOM 0 HH22 ARG A 96 1.567 12.496 2.560 1.00 0.00 H new ATOM 975 N VAL A 97 5.521 6.627 0.382 1.00 0.00 N ATOM 976 CA VAL A 97 5.412 6.015 1.721 1.00 0.00 C ATOM 977 C VAL A 97 5.718 7.042 2.813 1.00 0.00 C ATOM 978 O VAL A 97 6.686 7.798 2.698 1.00 0.00 O ATOM 979 CB VAL A 97 6.290 4.756 1.919 1.00 0.00 C ATOM 980 CG1 VAL A 97 5.531 3.521 1.433 1.00 0.00 C ATOM 981 CG2 VAL A 97 7.648 4.800 1.214 1.00 0.00 C ATOM 0 H VAL A 97 6.438 7.039 0.209 1.00 0.00 H new ATOM 0 HA VAL A 97 4.378 5.680 1.801 1.00 0.00 H new ATOM 0 HB VAL A 97 6.498 4.715 2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.150 2.635 1.573 1.00 0.00 H new ATOM 0 HG12 VAL A 97 4.609 3.413 2.004 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.292 3.633 0.375 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.190 3.875 1.411 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.497 4.910 0.140 1.00 0.00 H new ATOM 0 HG23 VAL A 97 8.225 5.646 1.588 1.00 0.00 H new ATOM 991 N THR A 98 4.869 7.077 3.850 1.00 0.00 N ATOM 992 CA THR A 98 4.895 8.077 4.934 1.00 0.00 C ATOM 993 C THR A 98 4.845 7.375 6.289 1.00 0.00 C ATOM 994 O THR A 98 3.979 6.532 6.499 1.00 0.00 O ATOM 995 CB THR A 98 3.700 9.035 4.802 1.00 0.00 C ATOM 996 OG1 THR A 98 3.571 9.469 3.462 1.00 0.00 O ATOM 997 CG2 THR A 98 3.870 10.281 5.671 1.00 0.00 C ATOM 0 H THR A 98 4.122 6.391 3.964 1.00 0.00 H new ATOM 0 HA THR A 98 5.819 8.651 4.860 1.00 0.00 H new ATOM 0 HB THR A 98 2.818 8.483 5.126 1.00 0.00 H new ATOM 0 HG1 THR A 98 2.770 9.069 3.064 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.004 10.931 5.548 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.957 9.986 6.717 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.771 10.815 5.369 1.00 0.00 H new ATOM 1005 N GLN A 99 5.741 7.709 7.217 1.00 0.00 N ATOM 1006 CA GLN A 99 5.767 7.121 8.565 1.00 0.00 C ATOM 1007 C GLN A 99 4.705 7.777 9.468 1.00 0.00 C ATOM 1008 O GLN A 99 4.567 9.004 9.473 1.00 0.00 O ATOM 1009 CB GLN A 99 7.182 7.285 9.149 1.00 0.00 C ATOM 1010 CG GLN A 99 7.410 6.474 10.437 1.00 0.00 C ATOM 1011 CD GLN A 99 8.869 6.513 10.913 1.00 0.00 C ATOM 1012 OE1 GLN A 99 9.659 7.385 10.569 1.00 0.00 O ATOM 1013 NE2 GLN A 99 9.297 5.573 11.731 1.00 0.00 N ATOM 0 H GLN A 99 6.476 8.399 7.058 1.00 0.00 H new ATOM 0 HA GLN A 99 5.525 6.060 8.509 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.913 6.978 8.401 1.00 0.00 H new ATOM 0 HB3 GLN A 99 7.361 8.340 9.356 1.00 0.00 H new ATOM 0 HG2 GLN A 99 6.765 6.863 11.225 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.116 5.438 10.266 1.00 0.00 H new ATOM 0 HE21 GLN A 99 8.663 4.834 12.035 1.00 0.00 H new ATOM 0 HE22 GLN A 99 10.262 5.584 12.060 1.00 0.00 H new ATOM 1022 N LEU A 100 3.966 6.980 10.252 1.00 0.00 N ATOM 1023 CA LEU A 100 2.955 7.495 11.191 1.00 0.00 C ATOM 1024 C LEU A 100 3.600 8.016 12.493 1.00 0.00 C ATOM 1025 O LEU A 100 4.698 7.564 12.839 1.00 0.00 O ATOM 1026 CB LEU A 100 1.913 6.399 11.511 1.00 0.00 C ATOM 1027 CG LEU A 100 1.147 5.785 10.319 1.00 0.00 C ATOM 1028 CD1 LEU A 100 -0.190 5.203 10.806 1.00 0.00 C ATOM 1029 CD2 LEU A 100 0.854 6.758 9.179 1.00 0.00 C ATOM 0 H LEU A 100 4.050 5.963 10.255 1.00 0.00 H new ATOM 0 HA LEU A 100 2.454 8.335 10.710 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.422 5.592 12.037 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.182 6.819 12.202 1.00 0.00 H new ATOM 0 HG LEU A 100 1.809 5.017 9.919 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.728 4.771 9.962 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -0.001 4.429 11.550 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.791 5.996 11.251 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.314 6.239 8.387 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.247 7.583 9.552 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.792 7.148 8.783 1.00 0.00 H new ATOM 1041 N PRO A 101 2.910 8.876 13.275 1.00 0.00 N ATOM 1042 CA PRO A 101 3.354 9.274 14.614 1.00 0.00 C ATOM 1043 C PRO A 101 3.425 8.104 15.615 1.00 0.00 C ATOM 1044 O PRO A 101 4.107 8.228 16.631 1.00 0.00 O ATOM 1045 CB PRO A 101 2.372 10.360 15.070 1.00 0.00 C ATOM 1046 CG PRO A 101 1.105 10.062 14.273 1.00 0.00 C ATOM 1047 CD PRO A 101 1.663 9.559 12.944 1.00 0.00 C ATOM 0 HA PRO A 101 4.379 9.642 14.576 1.00 0.00 H new ATOM 0 HB2 PRO A 101 2.190 10.310 16.144 1.00 0.00 H new ATOM 0 HB3 PRO A 101 2.753 11.359 14.857 1.00 0.00 H new ATOM 0 HG2 PRO A 101 0.484 9.312 14.763 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.488 10.951 14.144 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.962 8.881 12.456 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.839 10.385 12.255 1.00 0.00 H new ATOM 1055 N ASN A 102 2.786 6.957 15.330 1.00 0.00 N ATOM 1056 CA ASN A 102 2.968 5.718 16.105 1.00 0.00 C ATOM 1057 C ASN A 102 4.398 5.143 15.972 1.00 0.00 C ATOM 1058 O ASN A 102 4.876 4.439 16.864 1.00 0.00 O ATOM 1059 CB ASN A 102 1.961 4.662 15.619 1.00 0.00 C ATOM 1060 CG ASN A 102 0.491 4.981 15.885 1.00 0.00 C ATOM 1061 OD1 ASN A 102 0.126 5.920 16.586 1.00 0.00 O ATOM 1062 ND2 ASN A 102 -0.398 4.185 15.322 1.00 0.00 N ATOM 0 H ASN A 102 2.129 6.863 14.556 1.00 0.00 H new ATOM 0 HA ASN A 102 2.803 5.963 17.154 1.00 0.00 H new ATOM 0 HB2 ASN A 102 2.096 4.524 14.546 1.00 0.00 H new ATOM 0 HB3 ASN A 102 2.200 3.711 16.096 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -1.394 4.349 15.468 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.089 3.406 14.740 1.00 0.00 H new ATOM 1069 N GLY A 103 5.088 5.438 14.860 1.00 0.00 N ATOM 1070 CA GLY A 103 6.516 5.180 14.613 1.00 0.00 C ATOM 1071 C GLY A 103 6.820 3.786 14.064 1.00 0.00 C ATOM 1072 O GLY A 103 7.695 3.657 13.205 1.00 0.00 O ATOM 0 H GLY A 103 4.639 5.889 14.063 1.00 0.00 H new ATOM 0 HA2 GLY A 103 6.891 5.924 13.910 1.00 0.00 H new ATOM 0 HA3 GLY A 103 7.064 5.318 15.545 1.00 0.00 H new ATOM 1076 N ARG A 104 6.058 2.766 14.476 1.00 0.00 N ATOM 1077 CA ARG A 104 6.073 1.421 13.884 1.00 0.00 C ATOM 1078 C ARG A 104 4.737 1.198 13.170 1.00 0.00 C ATOM 1079 O ARG A 104 3.866 0.464 13.629 1.00 0.00 O ATOM 1080 CB ARG A 104 6.347 0.367 14.976 1.00 0.00 C ATOM 1081 CG ARG A 104 7.748 0.491 15.600 1.00 0.00 C ATOM 1082 CD ARG A 104 8.862 0.176 14.596 1.00 0.00 C ATOM 1083 NE ARG A 104 10.201 0.253 15.209 1.00 0.00 N ATOM 1084 CZ ARG A 104 11.021 -0.764 15.457 1.00 0.00 C ATOM 1085 NH1 ARG A 104 10.615 -2.017 15.439 1.00 0.00 N ATOM 1086 NH2 ARG A 104 12.289 -0.528 15.708 1.00 0.00 N1+ ATOM 0 H ARG A 104 5.398 2.854 15.249 1.00 0.00 H new ATOM 0 HA ARG A 104 6.874 1.323 13.152 1.00 0.00 H new ATOM 0 HB2 ARG A 104 5.597 0.463 15.761 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.234 -0.629 14.547 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.884 1.502 15.985 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.826 -0.187 16.450 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.708 -0.822 14.187 1.00 0.00 H new ATOM 0 HD3 ARG A 104 8.805 0.875 13.762 1.00 0.00 H new ATOM 0 HE ARG A 104 10.532 1.182 15.470 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.641 -2.234 15.229 1.00 0.00 H new ATOM 0 HH12 ARG A 104 11.275 -2.770 15.635 1.00 0.00 H new ATOM 0 HH21 ARG A 104 12.638 0.430 15.712 1.00 0.00 H new ATOM 0 HH22 ARG A 104 12.924 -1.303 15.899 1.00 0.00 H new ATOM 1100 N ASP A 105 4.615 1.870 12.028 1.00 0.00 N ATOM 1101 CA ASP A 105 3.422 2.039 11.195 1.00 0.00 C ATOM 1102 C ASP A 105 3.733 2.993 10.030 1.00 0.00 C ATOM 1103 O ASP A 105 4.410 4.009 10.220 1.00 0.00 O ATOM 1104 CB ASP A 105 2.261 2.647 11.990 1.00 0.00 C ATOM 1105 CG ASP A 105 1.325 1.672 12.726 1.00 0.00 C ATOM 1106 OD1 ASP A 105 1.011 0.592 12.171 1.00 0.00 O ATOM 1107 OD2 ASP A 105 0.844 2.039 13.826 1.00 0.00 O1- ATOM 0 H ASP A 105 5.417 2.353 11.625 1.00 0.00 H new ATOM 0 HA ASP A 105 3.138 1.051 10.834 1.00 0.00 H new ATOM 0 HB2 ASP A 105 2.679 3.334 12.726 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.657 3.242 11.305 1.00 0.00 H new ATOM 1112 N PHE A 106 3.193 2.696 8.843 1.00 0.00 N ATOM 1113 CA PHE A 106 3.362 3.501 7.631 1.00 0.00 C ATOM 1114 C PHE A 106 2.083 3.555 6.782 1.00 0.00 C ATOM 1115 O PHE A 106 1.297 2.611 6.745 1.00 0.00 O ATOM 1116 CB PHE A 106 4.513 2.929 6.780 1.00 0.00 C ATOM 1117 CG PHE A 106 5.911 3.348 7.204 1.00 0.00 C ATOM 1118 CD1 PHE A 106 6.533 2.753 8.319 1.00 0.00 C ATOM 1119 CD2 PHE A 106 6.614 4.310 6.453 1.00 0.00 C ATOM 1120 CE1 PHE A 106 7.831 3.135 8.697 1.00 0.00 C ATOM 1121 CE2 PHE A 106 7.919 4.681 6.820 1.00 0.00 C ATOM 1122 CZ PHE A 106 8.526 4.099 7.946 1.00 0.00 C ATOM 0 H PHE A 106 2.613 1.870 8.696 1.00 0.00 H new ATOM 0 HA PHE A 106 3.593 4.518 7.949 1.00 0.00 H new ATOM 0 HB2 PHE A 106 4.455 1.841 6.806 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.361 3.231 5.744 1.00 0.00 H new ATOM 0 HD1 PHE A 106 6.009 1.999 8.887 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.148 4.765 5.591 1.00 0.00 H new ATOM 0 HE1 PHE A 106 8.295 2.688 9.564 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.456 5.414 6.236 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.525 4.392 8.234 1.00 0.00 H new ATOM 1132 N HIS A 107 1.903 4.662 6.061 1.00 0.00 N ATOM 1133 CA HIS A 107 0.918 4.824 4.990 1.00 0.00 C ATOM 1134 C HIS A 107 1.587 4.627 3.617 1.00 0.00 C ATOM 1135 O HIS A 107 2.689 5.130 3.388 1.00 0.00 O ATOM 1136 CB HIS A 107 0.273 6.220 5.064 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.896 6.362 6.006 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.353 7.576 6.527 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -1.728 5.366 6.432 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.432 7.274 7.268 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -2.680 5.954 7.231 1.00 0.00 N ATOM 0 H HIS A 107 2.460 5.503 6.212 1.00 0.00 H new ATOM 0 HA HIS A 107 0.141 4.070 5.116 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.040 6.937 5.358 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -0.057 6.499 4.063 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -1.652 4.317 6.188 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -3.020 7.994 7.818 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -3.441 5.473 7.711 1.00 0.00 H new ATOM 1149 N MET A 108 0.899 3.939 2.705 1.00 0.00 N ATOM 1150 CA MET A 108 1.289 3.694 1.310 1.00 0.00 C ATOM 1151 C MET A 108 0.276 4.399 0.403 1.00 0.00 C ATOM 1152 O MET A 108 -0.891 4.012 0.369 1.00 0.00 O ATOM 1153 CB MET A 108 1.285 2.183 1.033 1.00 0.00 C ATOM 1154 CG MET A 108 2.525 1.451 1.558 1.00 0.00 C ATOM 1155 SD MET A 108 2.670 1.327 3.362 1.00 0.00 S ATOM 1156 CE MET A 108 4.322 0.604 3.462 1.00 0.00 C ATOM 0 H MET A 108 0.001 3.511 2.931 1.00 0.00 H new ATOM 0 HA MET A 108 2.291 4.078 1.119 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.397 1.743 1.486 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.208 2.021 -0.042 1.00 0.00 H new ATOM 0 HG2 MET A 108 2.531 0.443 1.143 1.00 0.00 H new ATOM 0 HG3 MET A 108 3.411 1.958 1.176 1.00 0.00 H new ATOM 0 HE1 MET A 108 4.493 0.224 4.469 1.00 0.00 H new ATOM 0 HE2 MET A 108 4.405 -0.214 2.747 1.00 0.00 H new ATOM 0 HE3 MET A 108 5.067 1.365 3.230 1.00 0.00 H new ATOM 1166 N SER A 109 0.706 5.429 -0.322 1.00 0.00 N ATOM 1167 CA SER A 109 -0.191 6.361 -1.022 1.00 0.00 C ATOM 1168 C SER A 109 -0.009 6.389 -2.552 1.00 0.00 C ATOM 1169 O SER A 109 1.103 6.607 -3.037 1.00 0.00 O ATOM 1170 CB SER A 109 0.046 7.786 -0.490 1.00 0.00 C ATOM 1171 OG SER A 109 -0.050 7.856 0.928 1.00 0.00 O ATOM 0 H SER A 109 1.695 5.647 -0.445 1.00 0.00 H new ATOM 0 HA SER A 109 -1.202 6.005 -0.826 1.00 0.00 H new ATOM 0 HB2 SER A 109 1.032 8.129 -0.802 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.683 8.463 -0.935 1.00 0.00 H new ATOM 0 HG SER A 109 0.109 8.777 1.222 1.00 0.00 H new ATOM 1177 N VAL A 110 -1.104 6.232 -3.311 1.00 0.00 N ATOM 1178 CA VAL A 110 -1.193 6.482 -4.764 1.00 0.00 C ATOM 1179 C VAL A 110 -1.823 7.867 -4.941 1.00 0.00 C ATOM 1180 O VAL A 110 -2.971 8.066 -4.552 1.00 0.00 O ATOM 1181 CB VAL A 110 -2.084 5.461 -5.529 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -2.011 5.707 -7.048 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -1.737 3.992 -5.252 1.00 0.00 C ATOM 0 H VAL A 110 -1.989 5.915 -2.917 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.187 6.396 -5.174 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.094 5.630 -5.154 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.641 4.983 -7.565 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.360 6.715 -7.270 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.980 5.597 -7.385 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.404 3.347 -5.823 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.705 3.800 -5.547 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.855 3.785 -4.188 1.00 0.00 H new ATOM 1193 N VAL A 111 -1.104 8.816 -5.536 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.626 10.154 -5.873 1.00 0.00 C ATOM 1195 C VAL A 111 -2.385 10.100 -7.208 1.00 0.00 C ATOM 1196 O VAL A 111 -1.836 9.645 -8.213 1.00 0.00 O ATOM 1197 CB VAL A 111 -0.490 11.205 -5.908 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.991 12.592 -6.349 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.170 11.340 -4.524 1.00 0.00 C ATOM 0 H VAL A 111 -0.129 8.683 -5.804 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.323 10.463 -5.094 1.00 0.00 H new ATOM 0 HB VAL A 111 0.236 10.848 -6.639 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -0.157 13.294 -6.358 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.418 12.523 -7.350 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.753 12.942 -5.653 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.966 12.084 -4.571 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.576 11.653 -3.794 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.589 10.379 -4.225 1.00 0.00 H new ATOM 1209 N ARG A 112 -3.642 10.574 -7.206 1.00 0.00 N ATOM 1210 CA ARG A 112 -4.535 10.681 -8.380 1.00 0.00 C ATOM 1211 C ARG A 112 -4.679 9.337 -9.105 1.00 0.00 C ATOM 1212 O ARG A 112 -4.201 9.148 -10.227 1.00 0.00 O ATOM 1213 CB ARG A 112 -4.085 11.820 -9.314 1.00 0.00 C ATOM 1214 CG ARG A 112 -4.225 13.176 -8.612 1.00 0.00 C ATOM 1215 CD ARG A 112 -3.848 14.334 -9.543 1.00 0.00 C ATOM 1216 NE ARG A 112 -4.010 15.637 -8.870 1.00 0.00 N ATOM 1217 CZ ARG A 112 -3.108 16.276 -8.131 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -1.903 15.791 -7.913 1.00 0.00 N ATOM 1219 NH2 ARG A 112 -3.417 17.434 -7.590 1.00 0.00 N1+ ATOM 0 H ARG A 112 -4.086 10.908 -6.351 1.00 0.00 H new ATOM 0 HA ARG A 112 -5.532 10.941 -8.025 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -3.049 11.664 -9.614 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -4.685 11.811 -10.224 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -5.251 13.304 -8.268 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -3.588 13.196 -7.728 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.815 14.218 -9.872 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -4.472 14.303 -10.436 1.00 0.00 H new ATOM 0 HE ARG A 112 -4.913 16.098 -8.984 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.633 14.894 -8.317 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -1.239 16.312 -7.340 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -4.343 17.836 -7.739 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.731 17.931 -7.022 1.00 0.00 H new ATOM 1233 N ALA A 113 -5.304 8.376 -8.429 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.486 7.012 -8.911 1.00 0.00 C ATOM 1235 C ALA A 113 -6.446 6.967 -10.112 1.00 0.00 C ATOM 1236 O ALA A 113 -7.477 7.641 -10.122 1.00 0.00 O ATOM 1237 CB ALA A 113 -5.977 6.163 -7.737 1.00 0.00 C ATOM 0 H ALA A 113 -5.708 8.530 -7.505 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.542 6.608 -9.276 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -6.123 5.135 -8.068 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.237 6.186 -6.937 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.922 6.563 -7.369 1.00 0.00 H new ATOM 1243 N ARG A 114 -6.087 6.188 -11.132 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.809 6.004 -12.398 1.00 0.00 C ATOM 1245 C ARG A 114 -7.238 4.540 -12.563 1.00 0.00 C ATOM 1246 O ARG A 114 -6.719 3.654 -11.888 1.00 0.00 O ATOM 1247 CB ARG A 114 -5.904 6.458 -13.570 1.00 0.00 C ATOM 1248 CG ARG A 114 -6.281 7.847 -14.106 1.00 0.00 C ATOM 1249 CD ARG A 114 -6.020 9.002 -13.129 1.00 0.00 C ATOM 1250 NE ARG A 114 -6.807 10.178 -13.519 1.00 0.00 N ATOM 1251 CZ ARG A 114 -6.494 11.141 -14.371 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -5.289 11.285 -14.884 1.00 0.00 N ATOM 1253 NH2 ARG A 114 -7.451 11.968 -14.717 1.00 0.00 N1+ ATOM 0 H ARG A 114 -5.232 5.633 -11.098 1.00 0.00 H new ATOM 0 HA ARG A 114 -7.713 6.612 -12.395 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -4.866 6.471 -13.238 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.971 5.730 -14.379 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -5.722 8.032 -15.024 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -7.338 7.845 -14.371 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -6.283 8.698 -12.116 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -4.959 9.251 -13.122 1.00 0.00 H new ATOM 0 HE ARG A 114 -7.720 10.265 -13.072 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -4.545 10.636 -14.628 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -5.100 12.045 -15.537 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -8.388 11.853 -14.332 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -7.258 12.726 -15.371 1.00 0.00 H new ATOM 1267 N ARG A 115 -8.148 4.262 -13.504 1.00 0.00 N ATOM 1268 CA ARG A 115 -8.639 2.900 -13.815 1.00 0.00 C ATOM 1269 C ARG A 115 -7.499 1.894 -14.090 1.00 0.00 C ATOM 1270 O ARG A 115 -7.629 0.710 -13.779 1.00 0.00 O ATOM 1271 CB ARG A 115 -9.605 2.975 -15.016 1.00 0.00 C ATOM 1272 CG ARG A 115 -10.909 3.743 -14.716 1.00 0.00 C ATOM 1273 CD ARG A 115 -11.896 2.946 -13.853 1.00 0.00 C ATOM 1274 NE ARG A 115 -12.555 1.880 -14.630 1.00 0.00 N ATOM 1275 CZ ARG A 115 -13.218 0.833 -14.149 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -13.337 0.608 -12.857 1.00 0.00 N ATOM 1277 NH2 ARG A 115 -13.778 -0.018 -14.979 1.00 0.00 N1+ ATOM 0 H ARG A 115 -8.575 4.984 -14.084 1.00 0.00 H new ATOM 0 HA ARG A 115 -9.162 2.526 -12.935 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.095 3.455 -15.852 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -9.855 1.963 -15.334 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -10.665 4.676 -14.209 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -11.391 4.008 -15.657 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -11.368 2.507 -13.006 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -12.650 3.619 -13.445 1.00 0.00 H new ATOM 0 HE ARG A 115 -12.496 1.954 -15.646 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -12.912 1.249 -12.187 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -13.854 -0.207 -12.527 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -13.703 0.127 -15.986 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -14.288 -0.823 -14.616 1.00 0.00 H new ATOM 1291 N ASN A 116 -6.358 2.377 -14.596 1.00 0.00 N ATOM 1292 CA ASN A 116 -5.120 1.615 -14.794 1.00 0.00 C ATOM 1293 C ASN A 116 -4.468 1.084 -13.493 1.00 0.00 C ATOM 1294 O ASN A 116 -3.726 0.104 -13.557 1.00 0.00 O ATOM 1295 CB ASN A 116 -4.143 2.524 -15.561 1.00 0.00 C ATOM 1296 CG ASN A 116 -2.846 1.812 -15.941 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -2.817 0.969 -16.829 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -1.743 2.122 -15.280 1.00 0.00 N ATOM 0 H ASN A 116 -6.269 3.349 -14.891 1.00 0.00 H new ATOM 0 HA ASN A 116 -5.369 0.714 -15.354 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -4.629 2.891 -16.465 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -3.908 3.395 -14.949 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -0.864 1.658 -15.509 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -1.772 2.825 -14.541 1.00 0.00 H new ATOM 1305 N ASP A 117 -4.709 1.692 -12.322 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.090 1.305 -11.044 1.00 0.00 C ATOM 1307 C ASP A 117 -4.844 0.179 -10.306 1.00 0.00 C ATOM 1308 O ASP A 117 -4.270 -0.463 -9.433 1.00 0.00 O ATOM 1309 CB ASP A 117 -3.972 2.530 -10.123 1.00 0.00 C ATOM 1310 CG ASP A 117 -3.119 3.656 -10.717 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -1.888 3.492 -10.891 1.00 0.00 O1- ATOM 1312 OD2 ASP A 117 -3.681 4.740 -10.980 1.00 0.00 O ATOM 0 H ASP A 117 -5.351 2.480 -12.234 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.103 0.914 -11.292 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.970 2.913 -9.910 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.540 2.220 -9.171 1.00 0.00 H new ATOM 1317 N SER A 118 -6.110 -0.096 -10.637 1.00 0.00 N ATOM 1318 CA SER A 118 -6.901 -1.138 -9.958 1.00 0.00 C ATOM 1319 C SER A 118 -6.240 -2.533 -10.035 1.00 0.00 C ATOM 1320 O SER A 118 -5.781 -2.964 -11.100 1.00 0.00 O ATOM 1321 CB SER A 118 -8.321 -1.208 -10.540 1.00 0.00 C ATOM 1322 OG SER A 118 -9.027 0.025 -10.415 1.00 0.00 O ATOM 0 H SER A 118 -6.616 0.391 -11.377 1.00 0.00 H new ATOM 0 HA SER A 118 -6.948 -0.853 -8.907 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.265 -1.485 -11.593 1.00 0.00 H new ATOM 0 HB3 SER A 118 -8.879 -1.995 -10.033 1.00 0.00 H new ATOM 0 HG SER A 118 -9.923 -0.070 -10.801 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.183 -3.253 -8.907 1.00 0.00 N ATOM 1329 CA GLY A 119 -5.515 -4.561 -8.791 1.00 0.00 C ATOM 1330 C GLY A 119 -5.022 -4.879 -7.378 1.00 0.00 C ATOM 1331 O GLY A 119 -5.412 -4.204 -6.427 1.00 0.00 O ATOM 0 H GLY A 119 -6.606 -2.940 -8.033 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.207 -5.341 -9.109 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.668 -4.588 -9.476 1.00 0.00 H new ATOM 1335 N THR A 120 -4.187 -5.916 -7.239 1.00 0.00 N ATOM 1336 CA THR A 120 -3.674 -6.430 -5.950 1.00 0.00 C ATOM 1337 C THR A 120 -2.360 -5.754 -5.582 1.00 0.00 C ATOM 1338 O THR A 120 -1.515 -5.507 -6.441 1.00 0.00 O ATOM 1339 CB THR A 120 -3.469 -7.952 -5.980 1.00 0.00 C ATOM 1340 OG1 THR A 120 -4.541 -8.562 -6.670 1.00 0.00 O ATOM 1341 CG2 THR A 120 -3.399 -8.580 -4.584 1.00 0.00 C ATOM 0 H THR A 120 -3.836 -6.440 -8.040 1.00 0.00 H new ATOM 0 HA THR A 120 -4.427 -6.199 -5.197 1.00 0.00 H new ATOM 0 HB THR A 120 -2.515 -8.121 -6.479 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.407 -9.533 -6.689 1.00 0.00 H new ATOM 0 HG21 THR A 120 -3.253 -9.656 -4.676 1.00 0.00 H new ATOM 0 HG22 THR A 120 -2.565 -8.147 -4.032 1.00 0.00 H new ATOM 0 HG23 THR A 120 -4.329 -8.384 -4.050 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.173 -5.496 -4.292 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.020 -4.817 -3.699 1.00 0.00 C ATOM 1351 C TYR A 121 -0.594 -5.478 -2.372 1.00 0.00 C ATOM 1352 O TYR A 121 -1.413 -6.100 -1.690 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.380 -3.342 -3.428 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.492 -2.429 -4.638 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.630 -2.463 -5.468 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.476 -1.489 -4.898 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -2.733 -1.599 -6.574 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.599 -0.584 -5.967 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.723 -0.641 -6.817 1.00 0.00 C ATOM 1360 OH TYR A 121 -1.820 0.230 -7.858 1.00 0.00 O ATOM 0 H TYR A 121 -2.860 -5.770 -3.590 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.190 -4.888 -4.402 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.330 -3.317 -2.895 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.627 -2.927 -2.758 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.429 -3.157 -5.254 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.404 -1.463 -4.272 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -3.583 -1.668 -7.236 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.169 0.156 -6.138 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.608 0.009 -8.397 1.00 0.00 H new ATOM 1370 N LEU A 122 0.668 -5.283 -1.965 1.00 0.00 N ATOM 1371 CA LEU A 122 1.194 -5.713 -0.663 1.00 0.00 C ATOM 1372 C LEU A 122 2.426 -4.918 -0.215 1.00 0.00 C ATOM 1373 O LEU A 122 3.238 -4.463 -1.020 1.00 0.00 O ATOM 1374 CB LEU A 122 1.420 -7.243 -0.584 1.00 0.00 C ATOM 1375 CG LEU A 122 2.600 -7.836 -1.387 1.00 0.00 C ATOM 1376 CD1 LEU A 122 2.833 -9.284 -0.931 1.00 0.00 C ATOM 1377 CD2 LEU A 122 2.342 -7.835 -2.903 1.00 0.00 C ATOM 0 H LEU A 122 1.365 -4.813 -2.543 1.00 0.00 H new ATOM 0 HA LEU A 122 0.410 -5.479 0.057 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.560 -7.508 0.464 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.506 -7.735 -0.917 1.00 0.00 H new ATOM 0 HG LEU A 122 3.473 -7.211 -1.197 1.00 0.00 H new ATOM 0 HD11 LEU A 122 3.664 -9.713 -1.491 1.00 0.00 H new ATOM 0 HD12 LEU A 122 3.068 -9.297 0.133 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.933 -9.871 -1.111 1.00 0.00 H new ATOM 0 HD21 LEU A 122 3.202 -8.262 -3.419 1.00 0.00 H new ATOM 0 HD22 LEU A 122 1.456 -8.430 -3.122 1.00 0.00 H new ATOM 0 HD23 LEU A 122 2.185 -6.812 -3.245 1.00 0.00 H new ATOM 1389 N CYS A 123 2.560 -4.780 1.100 1.00 0.00 N ATOM 1390 CA CYS A 123 3.717 -4.215 1.801 1.00 0.00 C ATOM 1391 C CYS A 123 4.749 -5.313 2.133 1.00 0.00 C ATOM 1392 O CYS A 123 4.382 -6.479 2.304 1.00 0.00 O ATOM 1393 CB CYS A 123 3.157 -3.559 3.069 1.00 0.00 C ATOM 1394 SG CYS A 123 4.331 -2.838 4.238 1.00 0.00 S ATOM 0 H CYS A 123 1.826 -5.074 1.744 1.00 0.00 H new ATOM 0 HA CYS A 123 4.246 -3.486 1.187 1.00 0.00 H new ATOM 0 HB2 CYS A 123 2.466 -2.774 2.762 1.00 0.00 H new ATOM 0 HB3 CYS A 123 2.572 -4.308 3.602 1.00 0.00 H new ATOM 1399 N GLY A 124 6.034 -4.961 2.251 1.00 0.00 N ATOM 1400 CA GLY A 124 7.077 -5.861 2.764 1.00 0.00 C ATOM 1401 C GLY A 124 8.321 -5.123 3.254 1.00 0.00 C ATOM 1402 O GLY A 124 8.737 -4.151 2.631 1.00 0.00 O ATOM 0 H GLY A 124 6.383 -4.038 1.992 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.667 -6.452 3.583 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.363 -6.560 1.978 1.00 0.00 H new ATOM 1406 N ALA A 125 8.936 -5.578 4.349 1.00 0.00 N ATOM 1407 CA ALA A 125 10.108 -4.923 4.950 1.00 0.00 C ATOM 1408 C ALA A 125 11.188 -5.918 5.409 1.00 0.00 C ATOM 1409 O ALA A 125 10.908 -7.089 5.645 1.00 0.00 O ATOM 1410 CB ALA A 125 9.623 -4.041 6.111 1.00 0.00 C ATOM 0 H ALA A 125 8.636 -6.415 4.848 1.00 0.00 H new ATOM 0 HA ALA A 125 10.592 -4.312 4.188 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.477 -3.545 6.572 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.928 -3.291 5.733 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.119 -4.661 6.853 1.00 0.00 H new ATOM 1416 N ILE A 126 12.429 -5.449 5.551 1.00 0.00 N ATOM 1417 CA ILE A 126 13.600 -6.245 5.958 1.00 0.00 C ATOM 1418 C ILE A 126 14.570 -5.378 6.771 1.00 0.00 C ATOM 1419 O ILE A 126 14.851 -4.238 6.400 1.00 0.00 O ATOM 1420 CB ILE A 126 14.266 -6.878 4.709 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.315 -7.935 5.105 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.900 -5.827 3.781 1.00 0.00 C ATOM 1423 CD1 ILE A 126 15.914 -8.691 3.913 1.00 0.00 C ATOM 0 H ILE A 126 12.660 -4.470 5.381 1.00 0.00 H new ATOM 0 HA ILE A 126 13.287 -7.064 6.606 1.00 0.00 H new ATOM 0 HB ILE A 126 13.465 -7.367 4.154 1.00 0.00 H new ATOM 0 HG12 ILE A 126 16.120 -7.446 5.655 1.00 0.00 H new ATOM 0 HG13 ILE A 126 14.855 -8.653 5.784 1.00 0.00 H new ATOM 0 HG21 ILE A 126 15.352 -6.325 2.923 1.00 0.00 H new ATOM 0 HG22 ILE A 126 14.131 -5.135 3.436 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.666 -5.276 4.326 1.00 0.00 H new ATOM 0 HD11 ILE A 126 16.643 -9.417 4.272 1.00 0.00 H new ATOM 0 HD12 ILE A 126 15.120 -9.210 3.375 1.00 0.00 H new ATOM 0 HD13 ILE A 126 16.405 -7.985 3.243 1.00 0.00 H new ATOM 1435 N SER A 127 15.077 -5.893 7.889 1.00 0.00 N ATOM 1436 CA SER A 127 16.067 -5.188 8.723 1.00 0.00 C ATOM 1437 C SER A 127 17.477 -5.228 8.096 1.00 0.00 C ATOM 1438 O SER A 127 17.773 -6.101 7.277 1.00 0.00 O ATOM 1439 CB SER A 127 16.060 -5.757 10.147 1.00 0.00 C ATOM 1440 OG SER A 127 14.782 -5.571 10.752 1.00 0.00 O ATOM 0 H SER A 127 14.817 -6.811 8.249 1.00 0.00 H new ATOM 0 HA SER A 127 15.782 -4.137 8.775 1.00 0.00 H new ATOM 0 HB2 SER A 127 16.306 -6.819 10.122 1.00 0.00 H new ATOM 0 HB3 SER A 127 16.827 -5.266 10.745 1.00 0.00 H new ATOM 0 HG SER A 127 14.793 -5.941 11.660 1.00 0.00 H new ATOM 1446 N LEU A 128 18.374 -4.301 8.469 1.00 0.00 N ATOM 1447 CA LEU A 128 19.725 -4.230 7.876 1.00 0.00 C ATOM 1448 C LEU A 128 20.687 -5.340 8.352 1.00 0.00 C ATOM 1449 O LEU A 128 21.765 -5.503 7.774 1.00 0.00 O ATOM 1450 CB LEU A 128 20.341 -2.830 8.087 1.00 0.00 C ATOM 1451 CG LEU A 128 19.567 -1.636 7.483 1.00 0.00 C ATOM 1452 CD1 LEU A 128 20.449 -0.380 7.539 1.00 0.00 C ATOM 1453 CD2 LEU A 128 19.109 -1.859 6.034 1.00 0.00 C ATOM 0 H LEU A 128 18.191 -3.590 9.177 1.00 0.00 H new ATOM 0 HA LEU A 128 19.590 -4.406 6.809 1.00 0.00 H new ATOM 0 HB2 LEU A 128 20.445 -2.662 9.159 1.00 0.00 H new ATOM 0 HB3 LEU A 128 21.346 -2.833 7.666 1.00 0.00 H new ATOM 0 HG LEU A 128 18.664 -1.520 8.083 1.00 0.00 H new ATOM 0 HD11 LEU A 128 19.907 0.465 7.114 1.00 0.00 H new ATOM 0 HD12 LEU A 128 20.706 -0.162 8.576 1.00 0.00 H new ATOM 0 HD13 LEU A 128 21.361 -0.550 6.967 1.00 0.00 H new ATOM 0 HD21 LEU A 128 18.574 -0.977 5.682 1.00 0.00 H new ATOM 0 HD22 LEU A 128 19.979 -2.033 5.400 1.00 0.00 H new ATOM 0 HD23 LEU A 128 18.449 -2.726 5.990 1.00 0.00 H new ATOM 1465 N ALA A 129 20.317 -6.122 9.375 1.00 0.00 N ATOM 1466 CA ALA A 129 21.076 -7.288 9.834 1.00 0.00 C ATOM 1467 C ALA A 129 21.189 -8.373 8.731 1.00 0.00 C ATOM 1468 O ALA A 129 20.210 -8.604 8.011 1.00 0.00 O ATOM 1469 CB ALA A 129 20.405 -7.841 11.102 1.00 0.00 C ATOM 0 H ALA A 129 19.467 -5.957 9.914 1.00 0.00 H new ATOM 0 HA ALA A 129 22.097 -6.983 10.065 1.00 0.00 H new ATOM 0 HB1 ALA A 129 20.958 -8.710 11.457 1.00 0.00 H new ATOM 0 HB2 ALA A 129 20.400 -7.073 11.876 1.00 0.00 H new ATOM 0 HB3 ALA A 129 19.380 -8.132 10.874 1.00 0.00 H new ATOM 1475 N PRO A 130 22.330 -9.083 8.610 1.00 0.00 N ATOM 1476 CA PRO A 130 22.550 -10.081 7.558 1.00 0.00 C ATOM 1477 C PRO A 130 21.658 -11.325 7.702 1.00 0.00 C ATOM 1478 O PRO A 130 21.445 -12.038 6.724 1.00 0.00 O ATOM 1479 CB PRO A 130 24.038 -10.440 7.650 1.00 0.00 C ATOM 1480 CG PRO A 130 24.377 -10.187 9.118 1.00 0.00 C ATOM 1481 CD PRO A 130 23.514 -8.973 9.455 1.00 0.00 C ATOM 0 HA PRO A 130 22.281 -9.675 6.583 1.00 0.00 H new ATOM 0 HB2 PRO A 130 24.218 -11.478 7.370 1.00 0.00 H new ATOM 0 HB3 PRO A 130 24.642 -9.821 6.986 1.00 0.00 H new ATOM 0 HG2 PRO A 130 24.132 -11.045 9.744 1.00 0.00 H new ATOM 0 HG3 PRO A 130 25.438 -9.982 9.259 1.00 0.00 H new ATOM 0 HD2 PRO A 130 23.242 -8.967 10.511 1.00 0.00 H new ATOM 0 HD3 PRO A 130 24.050 -8.045 9.258 1.00 0.00 H new ATOM 1489 N LYS A 131 21.111 -11.579 8.899 1.00 0.00 N ATOM 1490 CA LYS A 131 20.195 -12.694 9.187 1.00 0.00 C ATOM 1491 C LYS A 131 18.716 -12.390 8.830 1.00 0.00 C ATOM 1492 O LYS A 131 17.845 -13.238 9.041 1.00 0.00 O ATOM 1493 CB LYS A 131 20.405 -13.072 10.671 1.00 0.00 C ATOM 1494 CG LYS A 131 19.919 -14.491 11.026 1.00 0.00 C ATOM 1495 CD LYS A 131 20.373 -14.939 12.426 1.00 0.00 C ATOM 1496 CE LYS A 131 19.861 -14.058 13.578 1.00 0.00 C ATOM 1497 NZ LYS A 131 18.385 -14.139 13.749 1.00 0.00 N1+ ATOM 0 H LYS A 131 21.298 -10.999 9.717 1.00 0.00 H new ATOM 0 HA LYS A 131 20.429 -13.544 8.546 1.00 0.00 H new ATOM 0 HB2 LYS A 131 21.465 -12.991 10.911 1.00 0.00 H new ATOM 0 HB3 LYS A 131 19.880 -12.351 11.298 1.00 0.00 H new ATOM 0 HG2 LYS A 131 18.831 -14.522 10.974 1.00 0.00 H new ATOM 0 HG3 LYS A 131 20.294 -15.196 10.284 1.00 0.00 H new ATOM 0 HD2 LYS A 131 20.037 -15.963 12.592 1.00 0.00 H new ATOM 0 HD3 LYS A 131 21.463 -14.953 12.453 1.00 0.00 H new ATOM 0 HE2 LYS A 131 20.347 -14.360 14.505 1.00 0.00 H new ATOM 0 HE3 LYS A 131 20.145 -13.022 13.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 18.093 -13.527 14.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 17.917 -13.825 12.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 18.113 -15.122 13.954 1.00 0.00 H new ATOM 1511 N ALA A 132 18.404 -11.191 8.320 1.00 0.00 N ATOM 1512 CA ALA A 132 17.041 -10.766 7.975 1.00 0.00 C ATOM 1513 C ALA A 132 16.507 -11.412 6.676 1.00 0.00 C ATOM 1514 O ALA A 132 17.258 -11.682 5.736 1.00 0.00 O ATOM 1515 CB ALA A 132 17.006 -9.232 7.889 1.00 0.00 C ATOM 0 H ALA A 132 19.106 -10.475 8.132 1.00 0.00 H new ATOM 0 HA ALA A 132 16.373 -11.113 8.764 1.00 0.00 H new ATOM 0 HB1 ALA A 132 15.998 -8.905 7.633 1.00 0.00 H new ATOM 0 HB2 ALA A 132 17.292 -8.807 8.851 1.00 0.00 H new ATOM 0 HB3 ALA A 132 17.703 -8.895 7.122 1.00 0.00 H new ATOM 1521 N GLN A 133 15.187 -11.602 6.618 1.00 0.00 N ATOM 1522 CA GLN A 133 14.405 -11.999 5.443 1.00 0.00 C ATOM 1523 C GLN A 133 13.238 -11.004 5.297 1.00 0.00 C ATOM 1524 O GLN A 133 12.851 -10.353 6.270 1.00 0.00 O ATOM 1525 CB GLN A 133 13.848 -13.430 5.615 1.00 0.00 C ATOM 1526 CG GLN A 133 14.857 -14.576 5.393 1.00 0.00 C ATOM 1527 CD GLN A 133 15.975 -14.681 6.436 1.00 0.00 C ATOM 1528 OE1 GLN A 133 17.150 -14.818 6.113 1.00 0.00 O ATOM 1529 NE2 GLN A 133 15.676 -14.630 7.719 1.00 0.00 N ATOM 0 H GLN A 133 14.598 -11.475 7.441 1.00 0.00 H new ATOM 0 HA GLN A 133 15.039 -11.989 4.556 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.439 -13.522 6.621 1.00 0.00 H new ATOM 0 HB3 GLN A 133 13.018 -13.562 4.920 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.311 -15.519 5.375 1.00 0.00 H new ATOM 0 HG3 GLN A 133 15.311 -14.452 4.410 1.00 0.00 H new ATOM 0 HE21 GLN A 133 14.706 -14.516 8.012 1.00 0.00 H new ATOM 0 HE22 GLN A 133 16.415 -14.704 8.418 1.00 0.00 H new ATOM 1538 N ILE A 134 12.659 -10.878 4.096 1.00 0.00 N ATOM 1539 CA ILE A 134 11.549 -9.939 3.849 1.00 0.00 C ATOM 1540 C ILE A 134 10.267 -10.431 4.538 1.00 0.00 C ATOM 1541 O ILE A 134 9.682 -11.449 4.162 1.00 0.00 O ATOM 1542 CB ILE A 134 11.313 -9.657 2.341 1.00 0.00 C ATOM 1543 CG1 ILE A 134 12.622 -9.278 1.605 1.00 0.00 C ATOM 1544 CG2 ILE A 134 10.270 -8.525 2.196 1.00 0.00 C ATOM 1545 CD1 ILE A 134 12.464 -9.032 0.099 1.00 0.00 C ATOM 0 H ILE A 134 12.940 -11.415 3.276 1.00 0.00 H new ATOM 0 HA ILE A 134 11.837 -8.983 4.287 1.00 0.00 H new ATOM 0 HB ILE A 134 10.942 -10.571 1.878 1.00 0.00 H new ATOM 0 HG12 ILE A 134 13.034 -8.380 2.065 1.00 0.00 H new ATOM 0 HG13 ILE A 134 13.350 -10.075 1.754 1.00 0.00 H new ATOM 0 HG21 ILE A 134 10.099 -8.321 1.139 1.00 0.00 H new ATOM 0 HG22 ILE A 134 9.334 -8.831 2.663 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.641 -7.624 2.684 1.00 0.00 H new ATOM 0 HD11 ILE A 134 13.432 -8.773 -0.331 1.00 0.00 H new ATOM 0 HD12 ILE A 134 12.085 -9.935 -0.379 1.00 0.00 H new ATOM 0 HD13 ILE A 134 11.763 -8.213 -0.064 1.00 0.00 H new ATOM 1557 N LYS A 135 9.795 -9.666 5.522 1.00 0.00 N ATOM 1558 CA LYS A 135 8.491 -9.823 6.163 1.00 0.00 C ATOM 1559 C LYS A 135 7.409 -9.236 5.237 1.00 0.00 C ATOM 1560 O LYS A 135 7.090 -8.048 5.318 1.00 0.00 O ATOM 1561 CB LYS A 135 8.529 -9.117 7.539 1.00 0.00 C ATOM 1562 CG LYS A 135 9.583 -9.642 8.530 1.00 0.00 C ATOM 1563 CD LYS A 135 9.374 -11.112 8.919 1.00 0.00 C ATOM 1564 CE LYS A 135 10.392 -11.511 9.995 1.00 0.00 C ATOM 1565 NZ LYS A 135 10.211 -12.920 10.434 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.332 -8.890 5.909 1.00 0.00 H new ATOM 0 HA LYS A 135 8.253 -10.873 6.330 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.708 -8.054 7.376 1.00 0.00 H new ATOM 0 HB3 LYS A 135 7.546 -9.208 8.001 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.574 -9.527 8.090 1.00 0.00 H new ATOM 0 HG3 LYS A 135 9.561 -9.029 9.431 1.00 0.00 H new ATOM 0 HD2 LYS A 135 8.360 -11.259 9.291 1.00 0.00 H new ATOM 0 HD3 LYS A 135 9.488 -11.750 8.043 1.00 0.00 H new ATOM 0 HE2 LYS A 135 11.402 -11.379 9.606 1.00 0.00 H new ATOM 0 HE3 LYS A 135 10.291 -10.847 10.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 10.918 -13.151 11.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 9.256 -13.041 10.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 10.332 -13.556 9.620 1.00 0.00 H new ATOM 1579 N GLU A 136 6.873 -10.055 4.328 1.00 0.00 N ATOM 1580 CA GLU A 136 5.788 -9.675 3.415 1.00 0.00 C ATOM 1581 C GLU A 136 4.438 -9.709 4.145 1.00 0.00 C ATOM 1582 O GLU A 136 4.121 -10.665 4.855 1.00 0.00 O ATOM 1583 CB GLU A 136 5.743 -10.604 2.192 1.00 0.00 C ATOM 1584 CG GLU A 136 6.902 -10.351 1.222 1.00 0.00 C ATOM 1585 CD GLU A 136 6.884 -11.357 0.061 1.00 0.00 C ATOM 1586 OE1 GLU A 136 7.309 -12.520 0.258 1.00 0.00 O1- ATOM 1587 OE2 GLU A 136 6.456 -10.991 -1.058 1.00 0.00 O ATOM 0 H GLU A 136 7.185 -11.018 4.203 1.00 0.00 H new ATOM 0 HA GLU A 136 5.982 -8.660 3.069 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.772 -11.641 2.526 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.797 -10.465 1.668 1.00 0.00 H new ATOM 0 HG2 GLU A 136 6.836 -9.337 0.829 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.849 -10.425 1.756 1.00 0.00 H new ATOM 1594 N SER A 137 3.636 -8.666 3.962 1.00 0.00 N ATOM 1595 CA SER A 137 2.310 -8.525 4.569 1.00 0.00 C ATOM 1596 C SER A 137 1.200 -9.244 3.778 1.00 0.00 C ATOM 1597 O SER A 137 1.417 -9.772 2.680 1.00 0.00 O ATOM 1598 CB SER A 137 1.966 -7.035 4.722 1.00 0.00 C ATOM 1599 OG SER A 137 2.934 -6.346 5.500 1.00 0.00 O ATOM 0 H SER A 137 3.893 -7.873 3.373 1.00 0.00 H new ATOM 0 HA SER A 137 2.356 -9.005 5.546 1.00 0.00 H new ATOM 0 HB2 SER A 137 1.898 -6.575 3.736 1.00 0.00 H new ATOM 0 HB3 SER A 137 0.986 -6.935 5.189 1.00 0.00 H new ATOM 0 HG SER A 137 2.652 -6.335 6.438 1.00 0.00 H new ATOM 1605 N LEU A 138 -0.022 -9.233 4.328 1.00 0.00 N ATOM 1606 CA LEU A 138 -1.234 -9.706 3.652 1.00 0.00 C ATOM 1607 C LEU A 138 -1.488 -8.937 2.341 1.00 0.00 C ATOM 1608 O LEU A 138 -1.199 -7.741 2.243 1.00 0.00 O ATOM 1609 CB LEU A 138 -2.443 -9.562 4.602 1.00 0.00 C ATOM 1610 CG LEU A 138 -2.328 -10.298 5.956 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -3.581 -10.013 6.796 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -2.156 -11.814 5.782 1.00 0.00 C ATOM 0 H LEU A 138 -0.197 -8.889 5.272 1.00 0.00 H new ATOM 0 HA LEU A 138 -1.095 -10.756 3.393 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -2.602 -8.502 4.799 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -3.331 -9.927 4.086 1.00 0.00 H new ATOM 0 HG LEU A 138 -1.437 -9.926 6.462 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.504 -10.531 7.752 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.666 -8.940 6.970 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.464 -10.365 6.263 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -2.080 -12.286 6.761 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -3.017 -12.219 5.250 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -1.249 -12.014 5.211 1.00 0.00 H new ATOM 1624 N ARG A 139 -2.068 -9.610 1.342 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.491 -8.983 0.086 1.00 0.00 C ATOM 1626 C ARG A 139 -3.778 -8.175 0.294 1.00 0.00 C ATOM 1627 O ARG A 139 -4.754 -8.670 0.864 1.00 0.00 O ATOM 1628 CB ARG A 139 -2.674 -10.049 -1.004 1.00 0.00 C ATOM 1629 CG ARG A 139 -1.326 -10.645 -1.435 1.00 0.00 C ATOM 1630 CD ARG A 139 -1.523 -11.849 -2.362 1.00 0.00 C ATOM 1631 NE ARG A 139 -0.239 -12.509 -2.651 1.00 0.00 N ATOM 1632 CZ ARG A 139 -0.071 -13.651 -3.310 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -1.083 -14.312 -3.831 1.00 0.00 N ATOM 1634 NH2 ARG A 139 1.139 -14.149 -3.454 1.00 0.00 N1+ ATOM 0 H ARG A 139 -2.258 -10.611 1.383 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.714 -8.293 -0.242 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -3.323 -10.843 -0.634 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -3.171 -9.607 -1.868 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -0.735 -9.884 -1.944 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -0.762 -10.950 -0.554 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -2.206 -12.561 -1.899 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -1.986 -11.523 -3.293 1.00 0.00 H new ATOM 0 HE ARG A 139 0.604 -12.045 -2.313 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -2.032 -13.950 -3.735 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -0.918 -15.186 -4.331 1.00 0.00 H new ATOM 0 HH21 ARG A 139 1.942 -13.659 -3.061 1.00 0.00 H new ATOM 0 HH22 ARG A 139 1.273 -15.025 -3.959 1.00 0.00 H new ATOM 1648 N ALA A 140 -3.778 -6.945 -0.209 1.00 0.00 N ATOM 1649 CA ALA A 140 -4.935 -6.057 -0.324 1.00 0.00 C ATOM 1650 C ALA A 140 -5.235 -5.779 -1.805 1.00 0.00 C ATOM 1651 O ALA A 140 -4.422 -6.106 -2.669 1.00 0.00 O ATOM 1652 CB ALA A 140 -4.616 -4.759 0.427 1.00 0.00 C ATOM 0 H ALA A 140 -2.925 -6.515 -0.568 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.820 -6.520 0.112 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.465 -4.079 0.356 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.418 -4.984 1.475 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -3.737 -4.289 -0.015 1.00 0.00 H new ATOM 1658 N GLU A 141 -6.374 -5.163 -2.118 1.00 0.00 N ATOM 1659 CA GLU A 141 -6.694 -4.722 -3.478 1.00 0.00 C ATOM 1660 C GLU A 141 -7.251 -3.294 -3.530 1.00 0.00 C ATOM 1661 O GLU A 141 -7.965 -2.838 -2.635 1.00 0.00 O ATOM 1662 CB GLU A 141 -7.600 -5.735 -4.205 1.00 0.00 C ATOM 1663 CG GLU A 141 -8.880 -6.117 -3.454 1.00 0.00 C ATOM 1664 CD GLU A 141 -9.753 -7.056 -4.301 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -10.442 -6.578 -5.234 1.00 0.00 O ATOM 1666 OE2 GLU A 141 -9.758 -8.283 -4.042 1.00 0.00 O1- ATOM 0 H GLU A 141 -7.103 -4.955 -1.436 1.00 0.00 H new ATOM 0 HA GLU A 141 -5.750 -4.687 -4.022 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -7.876 -5.322 -5.175 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -7.025 -6.641 -4.396 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -8.623 -6.603 -2.513 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -9.442 -5.217 -3.205 1.00 0.00 H new ATOM 1673 N LEU A 142 -6.895 -2.591 -4.606 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.331 -1.245 -4.961 1.00 0.00 C ATOM 1675 C LEU A 142 -8.376 -1.319 -6.077 1.00 0.00 C ATOM 1676 O LEU A 142 -8.165 -2.004 -7.083 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.095 -0.451 -5.434 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.374 0.998 -5.886 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -6.924 1.868 -4.749 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.076 1.609 -6.428 1.00 0.00 C ATOM 0 H LEU A 142 -6.251 -2.975 -5.297 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.783 -0.750 -4.102 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.367 -0.427 -4.623 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.633 -0.989 -6.261 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.137 0.967 -6.663 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.104 2.878 -5.118 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.859 1.443 -4.385 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.200 1.903 -3.935 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.263 2.633 -6.750 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.318 1.608 -5.644 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.723 1.021 -7.275 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.455 -0.549 -5.928 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.498 -0.339 -6.929 1.00 0.00 C ATOM 1694 C ARG A 143 -10.675 1.162 -7.190 1.00 0.00 C ATOM 1695 O ARG A 143 -11.053 1.916 -6.290 1.00 0.00 O ATOM 1696 CB ARG A 143 -11.796 -0.988 -6.416 1.00 0.00 C ATOM 1697 CG ARG A 143 -12.974 -0.842 -7.391 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.216 -1.571 -6.860 1.00 0.00 C ATOM 1699 NE ARG A 143 -15.377 -1.386 -7.750 1.00 0.00 N ATOM 1700 CZ ARG A 143 -15.661 -2.074 -8.851 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -14.879 -3.034 -9.303 1.00 0.00 N ATOM 1702 NH2 ARG A 143 -16.757 -1.801 -9.524 1.00 0.00 N1+ ATOM 0 H ARG A 143 -9.632 -0.032 -5.067 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.224 -0.801 -7.878 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.616 -2.047 -6.230 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.066 -0.538 -5.461 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.202 0.214 -7.538 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -12.698 -1.247 -8.365 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -13.999 -2.635 -6.760 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.458 -1.200 -5.864 1.00 0.00 H new ATOM 0 HE ARG A 143 -16.034 -0.649 -7.492 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -14.022 -3.271 -8.804 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -15.131 -3.540 -10.152 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.384 -1.064 -9.200 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -16.980 -2.326 -10.370 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.426 1.592 -8.425 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.761 2.937 -8.911 1.00 0.00 C ATOM 1718 C VAL A 144 -12.079 2.861 -9.687 1.00 0.00 C ATOM 1719 O VAL A 144 -12.164 2.163 -10.697 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.641 3.543 -9.785 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -10.022 4.966 -10.218 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.311 3.593 -9.018 1.00 0.00 C ATOM 0 H VAL A 144 -9.978 1.009 -9.132 1.00 0.00 H new ATOM 0 HA VAL A 144 -10.868 3.600 -8.053 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.521 2.908 -10.663 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -9.226 5.384 -10.834 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.948 4.936 -10.793 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -10.163 5.589 -9.335 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.539 4.024 -9.656 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.429 4.207 -8.125 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -8.020 2.583 -8.728 1.00 0.00 H new ATOM 1732 N THR A 145 -13.101 3.580 -9.218 1.00 0.00 N ATOM 1733 CA THR A 145 -14.401 3.752 -9.887 1.00 0.00 C ATOM 1734 C THR A 145 -14.371 4.995 -10.776 1.00 0.00 C ATOM 1735 O THR A 145 -13.658 5.952 -10.475 1.00 0.00 O ATOM 1736 CB THR A 145 -15.541 3.818 -8.857 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.368 4.914 -7.988 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.613 2.546 -8.010 1.00 0.00 C ATOM 0 H THR A 145 -13.048 4.078 -8.330 1.00 0.00 H new ATOM 0 HA THR A 145 -14.590 2.887 -10.522 1.00 0.00 H new ATOM 0 HB THR A 145 -16.466 3.927 -9.423 1.00 0.00 H new ATOM 0 HG1 THR A 145 -16.104 4.939 -7.342 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.431 2.631 -7.294 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.786 1.687 -8.658 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.674 2.413 -7.473 1.00 0.00 H new ATOM 1746 N GLU A 146 -15.133 4.995 -11.868 1.00 0.00 N ATOM 1747 CA GLU A 146 -15.178 6.119 -12.815 1.00 0.00 C ATOM 1748 C GLU A 146 -15.721 7.403 -12.162 1.00 0.00 C ATOM 1749 O GLU A 146 -16.583 7.358 -11.279 1.00 0.00 O ATOM 1750 CB GLU A 146 -16.005 5.752 -14.057 1.00 0.00 C ATOM 1751 CG GLU A 146 -15.312 4.683 -14.910 1.00 0.00 C ATOM 1752 CD GLU A 146 -16.135 4.361 -16.167 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -17.015 3.470 -16.106 1.00 0.00 O1- ATOM 1754 OE2 GLU A 146 -15.905 4.994 -17.224 1.00 0.00 O ATOM 0 H GLU A 146 -15.740 4.217 -12.126 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.153 6.321 -13.125 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -16.985 5.390 -13.746 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -16.172 6.645 -14.659 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.320 5.031 -15.200 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.172 3.777 -14.321 1.00 0.00 H new ATOM 1761 N ARG A 147 -15.216 8.561 -12.609 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.556 9.871 -12.045 1.00 0.00 C ATOM 1763 C ARG A 147 -17.003 10.235 -12.403 1.00 0.00 C ATOM 1764 O ARG A 147 -17.369 10.289 -13.583 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.547 10.939 -12.502 1.00 0.00 C ATOM 1766 CG ARG A 147 -14.605 12.180 -11.597 1.00 0.00 C ATOM 1767 CD ARG A 147 -13.699 13.322 -12.078 1.00 0.00 C ATOM 1768 NE ARG A 147 -12.273 12.950 -12.104 1.00 0.00 N ATOM 1769 CZ ARG A 147 -11.265 13.744 -12.441 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -11.434 15.029 -12.684 1.00 0.00 N ATOM 1771 NH2 ARG A 147 -10.057 13.247 -12.543 1.00 0.00 N1+ ATOM 0 H ARG A 147 -14.552 8.613 -13.382 1.00 0.00 H new ATOM 0 HA ARG A 147 -15.490 9.826 -10.958 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.540 10.522 -12.488 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -14.759 11.226 -13.532 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -15.634 12.537 -11.547 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -14.316 11.897 -10.585 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -14.008 13.628 -13.078 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -13.833 14.185 -11.425 1.00 0.00 H new ATOM 0 HE ARG A 147 -12.040 11.993 -11.838 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -12.364 15.443 -12.615 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -10.635 15.609 -12.941 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -9.897 12.256 -12.364 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -9.277 13.851 -12.802 1.00 0.00 H new