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 66 ASN : amide:sc= 0.809 K(o=1.2,f=-2.6) USER MOD Set 1.2: A 78 LYS NZ :NH3+ -151:sc= 0.377 (180deg=0) USER MOD Set 2.1: A 53 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 107 HIS : no HD1:sc= -0.0711 X(o=-0.071,f=-0.17) USER MOD Set 3.1: A 51 THR OG1 : rot 180:sc= 0.67 USER MOD Set 3.2: A 109 SER OG : rot -76:sc= 0.76 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 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= 0.606 K(o=0.61,f=-5.1!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 178:sc= 0 (180deg=-0.00387) USER MOD Single : A 71 SER OG : rot 180:sc= 0 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=-0.055) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 MET CE :methyl 177:sc= -0.0505 (180deg=-0.0678) USER MOD Single : A 116 ASN : amide:sc= 0.705 K(o=0.71,f=0) USER MOD Single : A 118 SER OG : rot 170:sc= 0.789 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot -7:sc= 1.23 USER MOD Single : A 127 SER OG : rot 180:sc=-0.00991 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= 0.552 K(o=0.55,f=-5.1!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 150:sc= 0.167 USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 0.826 -6.072 9.142 1.00 0.00 N ATOM 49 CA THR A 36 -0.483 -5.814 8.532 1.00 0.00 C ATOM 50 C THR A 36 -0.404 -4.759 7.433 1.00 0.00 C ATOM 51 O THR A 36 0.489 -3.904 7.423 1.00 0.00 O ATOM 52 CB THR A 36 -1.523 -5.481 9.611 1.00 0.00 C ATOM 53 OG1 THR A 36 -2.807 -5.471 9.027 1.00 0.00 O ATOM 54 CG2 THR A 36 -1.282 -4.136 10.302 1.00 0.00 C ATOM 0 HA THR A 36 -0.815 -6.726 8.036 1.00 0.00 H new ATOM 0 HB THR A 36 -1.436 -6.251 10.378 1.00 0.00 H new ATOM 0 HG1 THR A 36 -3.476 -5.261 9.711 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.055 -3.968 11.052 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.305 -4.145 10.785 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.314 -3.336 9.562 1.00 0.00 H new ATOM 62 N PHE A 37 -1.356 -4.860 6.506 1.00 0.00 N ATOM 63 CA PHE A 37 -1.572 -3.989 5.354 1.00 0.00 C ATOM 64 C PHE A 37 -3.089 -3.860 5.134 1.00 0.00 C ATOM 65 O PHE A 37 -3.760 -4.852 4.841 1.00 0.00 O ATOM 66 CB PHE A 37 -0.851 -4.575 4.129 1.00 0.00 C ATOM 67 CG PHE A 37 -0.923 -3.728 2.873 1.00 0.00 C ATOM 68 CD1 PHE A 37 -0.321 -2.458 2.854 1.00 0.00 C ATOM 69 CD2 PHE A 37 -1.560 -4.210 1.711 1.00 0.00 C ATOM 70 CE1 PHE A 37 -0.331 -1.679 1.685 1.00 0.00 C ATOM 71 CE2 PHE A 37 -1.589 -3.422 0.545 1.00 0.00 C ATOM 72 CZ PHE A 37 -0.973 -2.159 0.530 1.00 0.00 C ATOM 0 H PHE A 37 -2.047 -5.609 6.545 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.161 -2.994 5.522 1.00 0.00 H new ATOM 0 HB2 PHE A 37 0.197 -4.730 4.384 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.275 -5.555 3.912 1.00 0.00 H new ATOM 0 HD1 PHE A 37 0.154 -2.078 3.746 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -2.026 -5.184 1.716 1.00 0.00 H new ATOM 0 HE1 PHE A 37 0.153 -0.714 1.674 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -2.086 -3.789 -0.341 1.00 0.00 H new ATOM 0 HZ PHE A 37 -0.993 -1.558 -0.367 1.00 0.00 H new ATOM 82 N SER A 38 -3.646 -2.663 5.324 1.00 0.00 N ATOM 83 CA SER A 38 -5.102 -2.435 5.388 1.00 0.00 C ATOM 84 C SER A 38 -5.570 -1.134 4.688 1.00 0.00 C ATOM 85 O SER A 38 -4.757 -0.222 4.494 1.00 0.00 O ATOM 86 CB SER A 38 -5.535 -2.448 6.867 1.00 0.00 C ATOM 87 OG SER A 38 -4.946 -1.387 7.610 1.00 0.00 O ATOM 0 H SER A 38 -3.098 -1.811 5.440 1.00 0.00 H new ATOM 0 HA SER A 38 -5.583 -3.241 4.834 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.621 -2.372 6.926 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.258 -3.401 7.316 1.00 0.00 H new ATOM 0 HG SER A 38 -5.249 -1.432 8.541 1.00 0.00 H new ATOM 93 N PRO A 39 -6.866 -1.010 4.311 1.00 0.00 N ATOM 94 CA PRO A 39 -7.916 -2.036 4.358 1.00 0.00 C ATOM 95 C PRO A 39 -7.666 -3.145 3.334 1.00 0.00 C ATOM 96 O PRO A 39 -6.927 -2.942 2.376 1.00 0.00 O ATOM 97 CB PRO A 39 -9.222 -1.306 4.029 1.00 0.00 C ATOM 98 CG PRO A 39 -8.763 -0.164 3.126 1.00 0.00 C ATOM 99 CD PRO A 39 -7.395 0.204 3.701 1.00 0.00 C ATOM 0 HA PRO A 39 -7.943 -2.517 5.336 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -9.932 -1.959 3.523 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.714 -0.936 4.928 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.691 -0.477 2.084 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.454 0.678 3.159 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.729 0.567 2.918 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.485 1.002 4.438 1.00 0.00 H new ATOM 107 N ALA A 40 -8.310 -4.304 3.515 1.00 0.00 N ATOM 108 CA ALA A 40 -8.252 -5.421 2.560 1.00 0.00 C ATOM 109 C ALA A 40 -8.881 -5.077 1.191 1.00 0.00 C ATOM 110 O ALA A 40 -8.467 -5.620 0.163 1.00 0.00 O ATOM 111 CB ALA A 40 -8.940 -6.632 3.205 1.00 0.00 C ATOM 0 H ALA A 40 -8.890 -4.496 4.332 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.207 -5.646 2.346 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -8.911 -7.476 2.516 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.421 -6.897 4.126 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.977 -6.384 3.431 1.00 0.00 H new ATOM 117 N LEU A 41 -9.850 -4.155 1.176 1.00 0.00 N ATOM 118 CA LEU A 41 -10.489 -3.591 -0.004 1.00 0.00 C ATOM 119 C LEU A 41 -10.534 -2.063 0.143 1.00 0.00 C ATOM 120 O LEU A 41 -11.213 -1.546 1.034 1.00 0.00 O ATOM 121 CB LEU A 41 -11.906 -4.195 -0.117 1.00 0.00 C ATOM 122 CG LEU A 41 -12.379 -4.358 -1.566 1.00 0.00 C ATOM 123 CD1 LEU A 41 -13.785 -4.972 -1.582 1.00 0.00 C ATOM 124 CD2 LEU A 41 -12.369 -3.059 -2.385 1.00 0.00 C ATOM 0 H LEU A 41 -10.226 -3.764 2.040 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.935 -3.827 -0.913 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.920 -5.168 0.374 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.609 -3.558 0.419 1.00 0.00 H new ATOM 0 HG LEU A 41 -11.658 -5.019 -2.047 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -14.120 -5.087 -2.613 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -13.761 -5.948 -1.097 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.474 -4.318 -1.048 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -12.718 -3.264 -3.397 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.027 -2.328 -1.916 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -11.355 -2.661 -2.424 1.00 0.00 H new ATOM 136 N LEU A 42 -9.830 -1.340 -0.728 1.00 0.00 N ATOM 137 CA LEU A 42 -9.901 0.118 -0.825 1.00 0.00 C ATOM 138 C LEU A 42 -10.664 0.513 -2.094 1.00 0.00 C ATOM 139 O LEU A 42 -10.233 0.178 -3.195 1.00 0.00 O ATOM 140 CB LEU A 42 -8.472 0.685 -0.817 1.00 0.00 C ATOM 141 CG LEU A 42 -8.397 2.221 -0.907 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.155 2.932 0.226 1.00 0.00 C ATOM 143 CD2 LEU A 42 -6.927 2.639 -0.850 1.00 0.00 C ATOM 0 H LEU A 42 -9.184 -1.758 -1.397 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.441 0.534 0.026 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -7.971 0.362 0.095 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -7.919 0.257 -1.653 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.869 2.515 -1.844 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.063 4.011 0.104 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.208 2.652 0.191 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.733 2.638 1.187 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.855 3.725 -0.913 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.488 2.300 0.088 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.389 2.191 -1.685 1.00 0.00 H new ATOM 155 N VAL A 43 -11.762 1.256 -1.945 1.00 0.00 N ATOM 156 CA VAL A 43 -12.519 1.846 -3.063 1.00 0.00 C ATOM 157 C VAL A 43 -12.250 3.349 -3.096 1.00 0.00 C ATOM 158 O VAL A 43 -12.460 4.037 -2.097 1.00 0.00 O ATOM 159 CB VAL A 43 -14.044 1.584 -2.987 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.741 2.039 -4.282 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.362 0.097 -2.760 1.00 0.00 C ATOM 0 H VAL A 43 -12.161 1.471 -1.031 1.00 0.00 H new ATOM 0 HA VAL A 43 -12.176 1.363 -3.978 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.415 2.158 -2.138 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.811 1.846 -4.207 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.575 3.106 -4.429 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.332 1.488 -5.129 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.442 -0.041 -2.713 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.956 -0.492 -3.583 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.913 -0.232 -1.823 1.00 0.00 H new ATOM 171 N VAL A 44 -11.807 3.845 -4.249 1.00 0.00 N ATOM 172 CA VAL A 44 -11.695 5.287 -4.548 1.00 0.00 C ATOM 173 C VAL A 44 -12.362 5.635 -5.881 1.00 0.00 C ATOM 174 O VAL A 44 -12.644 4.749 -6.685 1.00 0.00 O ATOM 175 CB VAL A 44 -10.232 5.781 -4.570 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.567 5.611 -3.198 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.396 5.106 -5.668 1.00 0.00 C ATOM 0 H VAL A 44 -11.508 3.251 -5.023 1.00 0.00 H new ATOM 0 HA VAL A 44 -12.213 5.797 -3.736 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.269 6.844 -4.807 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.538 5.968 -3.246 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -10.117 6.187 -2.453 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.573 4.557 -2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.377 5.491 -5.637 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.382 4.028 -5.504 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.835 5.319 -6.643 1.00 0.00 H new ATOM 187 N THR A 45 -12.568 6.933 -6.128 1.00 0.00 N ATOM 188 CA THR A 45 -13.005 7.469 -7.424 1.00 0.00 C ATOM 189 C THR A 45 -11.794 7.775 -8.309 1.00 0.00 C ATOM 190 O THR A 45 -10.720 8.116 -7.819 1.00 0.00 O ATOM 191 CB THR A 45 -13.883 8.706 -7.205 1.00 0.00 C ATOM 192 OG1 THR A 45 -15.039 8.297 -6.502 1.00 0.00 O ATOM 193 CG2 THR A 45 -14.359 9.337 -8.511 1.00 0.00 C ATOM 0 H THR A 45 -12.433 7.655 -5.420 1.00 0.00 H new ATOM 0 HA THR A 45 -13.605 6.722 -7.944 1.00 0.00 H new ATOM 0 HB THR A 45 -13.284 9.440 -6.666 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.619 9.072 -6.347 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.976 10.208 -8.291 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.496 9.644 -9.103 1.00 0.00 H new ATOM 0 HG23 THR A 45 -14.945 8.610 -9.074 1.00 0.00 H new ATOM 201 N GLU A 46 -11.977 7.673 -9.622 1.00 0.00 N ATOM 202 CA GLU A 46 -11.005 8.050 -10.648 1.00 0.00 C ATOM 203 C GLU A 46 -10.526 9.502 -10.459 1.00 0.00 C ATOM 204 O GLU A 46 -11.320 10.446 -10.538 1.00 0.00 O ATOM 205 CB GLU A 46 -11.657 7.835 -12.025 1.00 0.00 C ATOM 206 CG GLU A 46 -10.636 7.713 -13.156 1.00 0.00 C ATOM 207 CD GLU A 46 -11.299 7.829 -14.541 1.00 0.00 C ATOM 208 OE1 GLU A 46 -12.411 7.288 -14.742 1.00 0.00 O ATOM 209 OE2 GLU A 46 -10.696 8.459 -15.442 1.00 0.00 O1- ATOM 0 H GLU A 46 -12.844 7.310 -10.019 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.115 7.426 -10.567 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -12.267 6.933 -11.995 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -12.328 8.667 -12.237 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.880 8.491 -13.049 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.121 6.755 -13.079 1.00 0.00 H new ATOM 216 N GLY A 47 -9.227 9.686 -10.193 1.00 0.00 N ATOM 217 CA GLY A 47 -8.614 10.987 -9.908 1.00 0.00 C ATOM 218 C GLY A 47 -8.607 11.379 -8.425 1.00 0.00 C ATOM 219 O GLY A 47 -8.234 12.509 -8.118 1.00 0.00 O ATOM 0 H GLY A 47 -8.558 8.916 -10.170 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.587 10.977 -10.272 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.145 11.755 -10.471 1.00 0.00 H new ATOM 223 N ASP A 48 -8.982 10.482 -7.507 1.00 0.00 N ATOM 224 CA ASP A 48 -8.853 10.665 -6.053 1.00 0.00 C ATOM 225 C ASP A 48 -7.610 9.943 -5.488 1.00 0.00 C ATOM 226 O ASP A 48 -7.112 8.972 -6.062 1.00 0.00 O ATOM 227 CB ASP A 48 -10.144 10.192 -5.361 1.00 0.00 C ATOM 228 CG ASP A 48 -10.214 10.537 -3.863 1.00 0.00 C ATOM 229 OD1 ASP A 48 -9.715 11.615 -3.460 1.00 0.00 O ATOM 230 OD2 ASP A 48 -10.794 9.731 -3.098 1.00 0.00 O1- ATOM 0 H ASP A 48 -9.395 9.584 -7.759 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.709 11.726 -5.849 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -11.000 10.639 -5.867 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -10.233 9.112 -5.479 1.00 0.00 H new ATOM 235 N ASN A 49 -7.101 10.418 -4.350 1.00 0.00 N ATOM 236 CA ASN A 49 -5.929 9.852 -3.678 1.00 0.00 C ATOM 237 C ASN A 49 -6.303 8.579 -2.897 1.00 0.00 C ATOM 238 O ASN A 49 -7.114 8.621 -1.967 1.00 0.00 O ATOM 239 CB ASN A 49 -5.302 10.907 -2.749 1.00 0.00 C ATOM 240 CG ASN A 49 -4.789 12.145 -3.482 1.00 0.00 C ATOM 241 OD1 ASN A 49 -4.469 12.119 -4.664 1.00 0.00 O ATOM 242 ND2 ASN A 49 -4.691 13.271 -2.801 1.00 0.00 N ATOM 0 H ASN A 49 -7.498 11.220 -3.861 1.00 0.00 H new ATOM 0 HA ASN A 49 -5.194 9.569 -4.432 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -6.043 11.214 -2.011 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -4.476 10.452 -2.202 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -4.350 14.116 -3.259 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -4.957 13.296 -1.817 1.00 0.00 H new ATOM 249 N ALA A 50 -5.688 7.450 -3.255 1.00 0.00 N ATOM 250 CA ALA A 50 -5.849 6.161 -2.576 1.00 0.00 C ATOM 251 C ALA A 50 -4.686 5.907 -1.610 1.00 0.00 C ATOM 252 O ALA A 50 -3.536 5.950 -2.049 1.00 0.00 O ATOM 253 CB ALA A 50 -5.912 5.066 -3.647 1.00 0.00 C ATOM 0 H ALA A 50 -5.047 7.405 -4.047 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.766 6.162 -1.987 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.032 4.095 -3.167 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.759 5.252 -4.308 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.990 5.072 -4.228 1.00 0.00 H new ATOM 259 N THR A 51 -4.971 5.608 -0.336 1.00 0.00 N ATOM 260 CA THR A 51 -3.950 5.337 0.689 1.00 0.00 C ATOM 261 C THR A 51 -4.278 4.083 1.490 1.00 0.00 C ATOM 262 O THR A 51 -5.351 3.980 2.084 1.00 0.00 O ATOM 263 CB THR A 51 -3.780 6.546 1.617 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.362 7.645 0.835 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.709 6.317 2.686 1.00 0.00 C ATOM 0 H THR A 51 -5.926 5.546 0.017 1.00 0.00 H new ATOM 0 HA THR A 51 -3.005 5.160 0.175 1.00 0.00 H new ATOM 0 HB THR A 51 -4.735 6.718 2.114 1.00 0.00 H new ATOM 0 HG1 THR A 51 -3.248 8.431 1.409 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.629 7.203 3.316 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.985 5.459 3.299 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.750 6.126 2.205 1.00 0.00 H new ATOM 273 N PHE A 52 -3.318 3.159 1.528 1.00 0.00 N ATOM 274 CA PHE A 52 -3.285 1.993 2.413 1.00 0.00 C ATOM 275 C PHE A 52 -2.355 2.280 3.603 1.00 0.00 C ATOM 276 O PHE A 52 -1.405 3.057 3.478 1.00 0.00 O ATOM 277 CB PHE A 52 -2.758 0.769 1.650 1.00 0.00 C ATOM 278 CG PHE A 52 -3.629 0.275 0.512 1.00 0.00 C ATOM 279 CD1 PHE A 52 -4.671 -0.638 0.769 1.00 0.00 C ATOM 280 CD2 PHE A 52 -3.368 0.684 -0.810 1.00 0.00 C ATOM 281 CE1 PHE A 52 -5.445 -1.141 -0.289 1.00 0.00 C ATOM 282 CE2 PHE A 52 -4.141 0.178 -1.869 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.177 -0.736 -1.607 1.00 0.00 C ATOM 0 H PHE A 52 -2.504 3.204 0.915 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.295 1.790 2.770 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.773 1.010 1.250 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.623 -0.047 2.360 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -4.875 -0.952 1.782 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.573 1.387 -1.010 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -6.245 -1.838 -0.090 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.940 0.491 -2.883 1.00 0.00 H new ATOM 0 HZ PHE A 52 -5.768 -1.128 -2.421 1.00 0.00 H new ATOM 293 N THR A 53 -2.585 1.615 4.736 1.00 0.00 N ATOM 294 CA THR A 53 -1.717 1.661 5.927 1.00 0.00 C ATOM 295 C THR A 53 -0.952 0.348 6.046 1.00 0.00 C ATOM 296 O THR A 53 -1.550 -0.718 5.913 1.00 0.00 O ATOM 297 CB THR A 53 -2.554 1.918 7.184 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.326 3.086 6.995 1.00 0.00 O ATOM 299 CG2 THR A 53 -1.688 2.132 8.427 1.00 0.00 C ATOM 0 H THR A 53 -3.399 1.013 4.860 1.00 0.00 H new ATOM 0 HA THR A 53 -1.003 2.478 5.825 1.00 0.00 H new ATOM 0 HB THR A 53 -3.178 1.038 7.340 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.865 3.255 7.796 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.329 2.310 9.291 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.079 1.245 8.604 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.038 2.993 8.274 1.00 0.00 H new ATOM 307 N CYS A 54 0.354 0.418 6.309 1.00 0.00 N ATOM 308 CA CYS A 54 1.244 -0.729 6.539 1.00 0.00 C ATOM 309 C CYS A 54 2.015 -0.602 7.863 1.00 0.00 C ATOM 310 O CYS A 54 2.543 0.469 8.177 1.00 0.00 O ATOM 311 CB CYS A 54 2.254 -0.846 5.387 1.00 0.00 C ATOM 312 SG CYS A 54 3.329 -2.299 5.551 1.00 0.00 S ATOM 0 H CYS A 54 0.844 1.311 6.371 1.00 0.00 H new ATOM 0 HA CYS A 54 0.618 -1.620 6.590 1.00 0.00 H new ATOM 0 HB2 CYS A 54 1.716 -0.901 4.441 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.868 0.054 5.353 1.00 0.00 H new ATOM 317 N SER A 55 2.171 -1.700 8.607 1.00 0.00 N ATOM 318 CA SER A 55 3.056 -1.739 9.781 1.00 0.00 C ATOM 319 C SER A 55 3.620 -3.145 10.034 1.00 0.00 C ATOM 320 O SER A 55 3.024 -4.150 9.636 1.00 0.00 O ATOM 321 CB SER A 55 2.358 -1.174 11.030 1.00 0.00 C ATOM 322 OG SER A 55 1.240 -1.951 11.440 1.00 0.00 O ATOM 0 H SER A 55 1.693 -2.581 8.418 1.00 0.00 H new ATOM 0 HA SER A 55 3.907 -1.094 9.560 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.076 -1.121 11.848 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.030 -0.155 10.827 1.00 0.00 H new ATOM 0 HG SER A 55 0.836 -1.548 12.237 1.00 0.00 H new ATOM 328 N PHE A 56 4.797 -3.201 10.671 1.00 0.00 N ATOM 329 CA PHE A 56 5.576 -4.414 10.925 1.00 0.00 C ATOM 330 C PHE A 56 6.030 -4.550 12.383 1.00 0.00 C ATOM 331 O PHE A 56 6.220 -3.566 13.098 1.00 0.00 O ATOM 332 CB PHE A 56 6.812 -4.418 10.009 1.00 0.00 C ATOM 333 CG PHE A 56 6.568 -5.128 8.702 1.00 0.00 C ATOM 334 CD1 PHE A 56 5.823 -4.503 7.690 1.00 0.00 C ATOM 335 CD2 PHE A 56 7.049 -6.436 8.513 1.00 0.00 C ATOM 336 CE1 PHE A 56 5.565 -5.180 6.489 1.00 0.00 C ATOM 337 CE2 PHE A 56 6.784 -7.115 7.313 1.00 0.00 C ATOM 338 CZ PHE A 56 6.044 -6.485 6.300 1.00 0.00 C ATOM 0 H PHE A 56 5.250 -2.364 11.038 1.00 0.00 H new ATOM 0 HA PHE A 56 4.924 -5.262 10.716 1.00 0.00 H new ATOM 0 HB2 PHE A 56 7.113 -3.390 9.808 1.00 0.00 H new ATOM 0 HB3 PHE A 56 7.642 -4.897 10.528 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.448 -3.501 7.836 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.622 -6.918 9.291 1.00 0.00 H new ATOM 0 HE1 PHE A 56 4.997 -4.696 5.709 1.00 0.00 H new ATOM 0 HE2 PHE A 56 7.149 -8.121 7.169 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.843 -7.005 5.375 1.00 0.00 H new ATOM 424 N PHE A 63 14.440 -0.902 9.964 1.00 0.00 N ATOM 425 CA PHE A 63 14.246 -1.704 8.758 1.00 0.00 C ATOM 426 C PHE A 63 13.873 -0.811 7.563 1.00 0.00 C ATOM 427 O PHE A 63 13.422 0.323 7.741 1.00 0.00 O ATOM 428 CB PHE A 63 13.185 -2.793 9.035 1.00 0.00 C ATOM 429 CG PHE A 63 11.856 -2.325 9.602 1.00 0.00 C ATOM 430 CD1 PHE A 63 10.833 -1.875 8.743 1.00 0.00 C ATOM 431 CD2 PHE A 63 11.617 -2.403 10.988 1.00 0.00 C ATOM 432 CE1 PHE A 63 9.580 -1.511 9.268 1.00 0.00 C ATOM 433 CE2 PHE A 63 10.357 -2.055 11.509 1.00 0.00 C ATOM 434 CZ PHE A 63 9.339 -1.606 10.650 1.00 0.00 C ATOM 0 HA PHE A 63 15.179 -2.202 8.492 1.00 0.00 H new ATOM 0 HB2 PHE A 63 12.989 -3.322 8.102 1.00 0.00 H new ATOM 0 HB3 PHE A 63 13.614 -3.517 9.728 1.00 0.00 H new ATOM 0 HD1 PHE A 63 11.012 -1.810 7.680 1.00 0.00 H new ATOM 0 HD2 PHE A 63 12.403 -2.731 11.652 1.00 0.00 H new ATOM 0 HE1 PHE A 63 8.801 -1.158 8.608 1.00 0.00 H new ATOM 0 HE2 PHE A 63 10.172 -2.133 12.570 1.00 0.00 H new ATOM 0 HZ PHE A 63 8.374 -1.335 11.051 1.00 0.00 H new ATOM 444 N VAL A 64 14.018 -1.341 6.347 1.00 0.00 N ATOM 445 CA VAL A 64 13.516 -0.713 5.114 1.00 0.00 C ATOM 446 C VAL A 64 12.159 -1.335 4.813 1.00 0.00 C ATOM 447 O VAL A 64 12.052 -2.556 4.696 1.00 0.00 O ATOM 448 CB VAL A 64 14.468 -0.903 3.908 1.00 0.00 C ATOM 449 CG1 VAL A 64 13.849 -0.355 2.609 1.00 0.00 C ATOM 450 CG2 VAL A 64 15.811 -0.201 4.166 1.00 0.00 C ATOM 0 H VAL A 64 14.492 -2.229 6.184 1.00 0.00 H new ATOM 0 HA VAL A 64 13.443 0.363 5.270 1.00 0.00 H new ATOM 0 HB VAL A 64 14.632 -1.974 3.790 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.544 -0.505 1.783 1.00 0.00 H new ATOM 0 HG12 VAL A 64 12.918 -0.881 2.399 1.00 0.00 H new ATOM 0 HG13 VAL A 64 13.646 0.710 2.724 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.468 -0.345 3.308 1.00 0.00 H new ATOM 0 HG22 VAL A 64 15.641 0.865 4.318 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.278 -0.624 5.055 1.00 0.00 H new ATOM 460 N LEU A 65 11.131 -0.493 4.707 1.00 0.00 N ATOM 461 CA LEU A 65 9.776 -0.903 4.352 1.00 0.00 C ATOM 462 C LEU A 65 9.519 -0.615 2.870 1.00 0.00 C ATOM 463 O LEU A 65 9.880 0.446 2.371 1.00 0.00 O ATOM 464 CB LEU A 65 8.786 -0.173 5.274 1.00 0.00 C ATOM 465 CG LEU A 65 7.358 -0.748 5.222 1.00 0.00 C ATOM 466 CD1 LEU A 65 7.307 -2.196 5.722 1.00 0.00 C ATOM 467 CD2 LEU A 65 6.443 0.112 6.096 1.00 0.00 C ATOM 0 H LEU A 65 11.220 0.510 4.869 1.00 0.00 H new ATOM 0 HA LEU A 65 9.644 -1.976 4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.152 -0.224 6.299 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.755 0.881 4.998 1.00 0.00 H new ATOM 0 HG LEU A 65 7.028 -0.738 4.183 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.282 -2.563 5.669 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.949 -2.819 5.099 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.654 -2.237 6.755 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.429 -0.288 6.065 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.806 0.101 7.124 1.00 0.00 H new ATOM 0 HD23 LEU A 65 6.441 1.136 5.723 1.00 0.00 H new ATOM 479 N ASN A 66 8.903 -1.566 2.171 1.00 0.00 N ATOM 480 CA ASN A 66 8.749 -1.592 0.715 1.00 0.00 C ATOM 481 C ASN A 66 7.289 -1.871 0.320 1.00 0.00 C ATOM 482 O ASN A 66 6.543 -2.512 1.066 1.00 0.00 O ATOM 483 CB ASN A 66 9.644 -2.693 0.116 1.00 0.00 C ATOM 484 CG ASN A 66 11.094 -2.663 0.592 1.00 0.00 C ATOM 485 OD1 ASN A 66 11.958 -2.041 -0.013 1.00 0.00 O ATOM 486 ND2 ASN A 66 11.400 -3.350 1.677 1.00 0.00 N ATOM 0 H ASN A 66 8.478 -2.376 2.622 1.00 0.00 H new ATOM 0 HA ASN A 66 9.041 -0.616 0.328 1.00 0.00 H new ATOM 0 HB2 ASN A 66 9.215 -3.665 0.361 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.630 -2.603 -0.970 1.00 0.00 H new ATOM 0 HD21 ASN A 66 12.362 -3.365 2.017 1.00 0.00 H new ATOM 0 HD22 ASN A 66 10.675 -3.866 2.176 1.00 0.00 H new ATOM 493 N TRP A 67 6.895 -1.425 -0.874 1.00 0.00 N ATOM 494 CA TRP A 67 5.535 -1.544 -1.402 1.00 0.00 C ATOM 495 C TRP A 67 5.528 -2.109 -2.830 1.00 0.00 C ATOM 496 O TRP A 67 6.351 -1.717 -3.663 1.00 0.00 O ATOM 497 CB TRP A 67 4.910 -0.146 -1.358 1.00 0.00 C ATOM 498 CG TRP A 67 3.468 -0.035 -1.742 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.502 -0.962 -1.551 1.00 0.00 C ATOM 500 CD2 TRP A 67 2.800 1.112 -2.344 1.00 0.00 C ATOM 501 NE1 TRP A 67 1.299 -0.488 -2.032 1.00 0.00 N ATOM 502 CE2 TRP A 67 1.421 0.791 -2.525 1.00 0.00 C ATOM 503 CE3 TRP A 67 3.222 2.404 -2.721 1.00 0.00 C ATOM 504 CZ2 TRP A 67 0.503 1.707 -3.056 1.00 0.00 C ATOM 505 CZ3 TRP A 67 2.307 3.333 -3.242 1.00 0.00 C ATOM 506 CH2 TRP A 67 0.957 2.988 -3.406 1.00 0.00 C ATOM 0 H TRP A 67 7.532 -0.957 -1.519 1.00 0.00 H new ATOM 0 HA TRP A 67 4.957 -2.244 -0.798 1.00 0.00 H new ATOM 0 HB2 TRP A 67 5.022 0.244 -0.346 1.00 0.00 H new ATOM 0 HB3 TRP A 67 5.487 0.504 -2.016 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.650 -1.928 -1.091 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.428 -1.019 -2.023 1.00 0.00 H new ATOM 0 HE3 TRP A 67 4.260 2.682 -2.608 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -0.533 1.433 -3.193 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 2.645 4.321 -3.519 1.00 0.00 H new ATOM 0 HH2 TRP A 67 0.263 3.713 -3.804 1.00 0.00 H new ATOM 517 N TYR A 68 4.598 -3.025 -3.119 1.00 0.00 N ATOM 518 CA TYR A 68 4.533 -3.773 -4.374 1.00 0.00 C ATOM 519 C TYR A 68 3.107 -3.871 -4.942 1.00 0.00 C ATOM 520 O TYR A 68 2.137 -3.994 -4.188 1.00 0.00 O ATOM 521 CB TYR A 68 5.074 -5.197 -4.144 1.00 0.00 C ATOM 522 CG TYR A 68 6.447 -5.281 -3.502 1.00 0.00 C ATOM 523 CD1 TYR A 68 6.563 -5.314 -2.097 1.00 0.00 C ATOM 524 CD2 TYR A 68 7.603 -5.343 -4.303 1.00 0.00 C ATOM 525 CE1 TYR A 68 7.831 -5.384 -1.492 1.00 0.00 C ATOM 526 CE2 TYR A 68 8.875 -5.415 -3.704 1.00 0.00 C ATOM 527 CZ TYR A 68 8.992 -5.425 -2.294 1.00 0.00 C ATOM 528 OH TYR A 68 10.221 -5.478 -1.708 1.00 0.00 O ATOM 0 H TYR A 68 3.852 -3.271 -2.469 1.00 0.00 H new ATOM 0 HA TYR A 68 5.138 -3.230 -5.100 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.366 -5.739 -3.517 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.109 -5.712 -5.104 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.675 -5.285 -1.483 1.00 0.00 H new ATOM 0 HD2 TYR A 68 7.514 -5.335 -5.379 1.00 0.00 H new ATOM 0 HE1 TYR A 68 7.916 -5.406 -0.416 1.00 0.00 H new ATOM 0 HE2 TYR A 68 9.761 -5.463 -4.320 1.00 0.00 H new ATOM 0 HH TYR A 68 10.913 -5.502 -2.401 1.00 0.00 H new ATOM 538 N ARG A 69 2.993 -3.876 -6.276 1.00 0.00 N ATOM 539 CA ARG A 69 1.766 -4.215 -7.017 1.00 0.00 C ATOM 540 C ARG A 69 1.918 -5.628 -7.587 1.00 0.00 C ATOM 541 O ARG A 69 3.003 -5.975 -8.053 1.00 0.00 O ATOM 542 CB ARG A 69 1.522 -3.205 -8.151 1.00 0.00 C ATOM 543 CG ARG A 69 0.184 -3.459 -8.861 1.00 0.00 C ATOM 544 CD ARG A 69 -0.117 -2.383 -9.908 1.00 0.00 C ATOM 545 NE ARG A 69 -1.462 -2.574 -10.479 1.00 0.00 N ATOM 546 CZ ARG A 69 -1.964 -1.946 -11.536 1.00 0.00 C ATOM 547 NH1 ARG A 69 -1.277 -1.059 -12.226 1.00 0.00 N1+ ATOM 548 NH2 ARG A 69 -3.191 -2.192 -11.930 1.00 0.00 N ATOM 0 H ARG A 69 3.772 -3.638 -6.889 1.00 0.00 H new ATOM 0 HA ARG A 69 0.909 -4.175 -6.345 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.532 -2.193 -7.745 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.335 -3.267 -8.874 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.207 -4.437 -9.341 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.619 -3.485 -8.125 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.047 -1.395 -9.452 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.629 -2.422 -10.702 1.00 0.00 H new ATOM 0 HE ARG A 69 -2.066 -3.254 -10.018 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -0.321 -0.831 -11.954 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -1.701 -0.600 -13.032 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -3.763 -2.868 -11.424 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -3.573 -1.707 -12.742 1.00 0.00 H new ATOM 562 N MET A 70 0.860 -6.437 -7.577 1.00 0.00 N ATOM 563 CA MET A 70 0.868 -7.787 -8.159 1.00 0.00 C ATOM 564 C MET A 70 0.519 -7.769 -9.654 1.00 0.00 C ATOM 565 O MET A 70 -0.372 -7.041 -10.092 1.00 0.00 O ATOM 566 CB MET A 70 -0.084 -8.720 -7.403 1.00 0.00 C ATOM 567 CG MET A 70 0.200 -8.729 -5.895 1.00 0.00 C ATOM 568 SD MET A 70 -0.330 -10.229 -5.032 1.00 0.00 S ATOM 569 CE MET A 70 1.051 -11.303 -5.509 1.00 0.00 C ATOM 0 H MET A 70 -0.035 -6.177 -7.163 1.00 0.00 H new ATOM 0 HA MET A 70 1.884 -8.169 -8.058 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.113 -8.406 -7.577 1.00 0.00 H new ATOM 0 HB3 MET A 70 0.011 -9.732 -7.796 1.00 0.00 H new ATOM 0 HG2 MET A 70 1.271 -8.597 -5.740 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.296 -7.871 -5.441 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.930 -12.280 -5.042 1.00 0.00 H new ATOM 0 HE2 MET A 70 1.065 -11.418 -6.593 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.989 -10.857 -5.179 1.00 0.00 H new ATOM 579 N SER A 71 1.201 -8.599 -10.434 1.00 0.00 N ATOM 580 CA SER A 71 0.963 -8.781 -11.875 1.00 0.00 C ATOM 581 C SER A 71 -0.037 -9.930 -12.155 1.00 0.00 C ATOM 582 O SER A 71 -0.156 -10.837 -11.320 1.00 0.00 O ATOM 583 CB SER A 71 2.294 -9.070 -12.589 1.00 0.00 C ATOM 584 OG SER A 71 3.232 -8.021 -12.383 1.00 0.00 O ATOM 0 H SER A 71 1.958 -9.184 -10.079 1.00 0.00 H new ATOM 0 HA SER A 71 0.526 -7.858 -12.257 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.709 -10.009 -12.222 1.00 0.00 H new ATOM 0 HB3 SER A 71 2.116 -9.196 -13.657 1.00 0.00 H new ATOM 0 HG SER A 71 4.068 -8.234 -12.847 1.00 0.00 H new ATOM 590 N PRO A 72 -0.715 -9.954 -13.326 1.00 0.00 N ATOM 591 CA PRO A 72 -1.628 -11.033 -13.723 1.00 0.00 C ATOM 592 C PRO A 72 -0.990 -12.432 -13.709 1.00 0.00 C ATOM 593 O PRO A 72 -1.652 -13.408 -13.366 1.00 0.00 O ATOM 594 CB PRO A 72 -2.108 -10.675 -15.134 1.00 0.00 C ATOM 595 CG PRO A 72 -1.973 -9.157 -15.184 1.00 0.00 C ATOM 596 CD PRO A 72 -0.726 -8.904 -14.339 1.00 0.00 C ATOM 0 HA PRO A 72 -2.442 -11.099 -13.002 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -1.499 -11.157 -15.899 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.138 -10.992 -15.300 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.851 -8.795 -16.205 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.850 -8.658 -14.771 1.00 0.00 H new ATOM 0 HD2 PRO A 72 0.175 -8.941 -14.951 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -0.759 -7.916 -13.879 1.00 0.00 H new ATOM 604 N SER A 73 0.302 -12.532 -14.040 1.00 0.00 N ATOM 605 CA SER A 73 1.089 -13.781 -14.018 1.00 0.00 C ATOM 606 C SER A 73 1.519 -14.225 -12.599 1.00 0.00 C ATOM 607 O SER A 73 2.368 -15.106 -12.454 1.00 0.00 O ATOM 608 CB SER A 73 2.332 -13.612 -14.914 1.00 0.00 C ATOM 609 OG SER A 73 1.988 -13.143 -16.215 1.00 0.00 O ATOM 0 H SER A 73 0.850 -11.726 -14.340 1.00 0.00 H new ATOM 0 HA SER A 73 0.439 -14.570 -14.396 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.024 -12.912 -14.447 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.852 -14.566 -14.998 1.00 0.00 H new ATOM 0 HG SER A 73 2.801 -13.046 -16.754 1.00 0.00 H new ATOM 615 N ASN A 74 0.991 -13.580 -11.547 1.00 0.00 N ATOM 616 CA ASN A 74 1.271 -13.819 -10.119 1.00 0.00 C ATOM 617 C ASN A 74 2.684 -13.373 -9.689 1.00 0.00 C ATOM 618 O ASN A 74 3.207 -13.818 -8.664 1.00 0.00 O ATOM 619 CB ASN A 74 0.929 -15.266 -9.701 1.00 0.00 C ATOM 620 CG ASN A 74 -0.488 -15.677 -10.089 1.00 0.00 C ATOM 621 OD1 ASN A 74 -0.703 -16.497 -10.976 1.00 0.00 O ATOM 622 ND2 ASN A 74 -1.501 -15.125 -9.439 1.00 0.00 N ATOM 0 H ASN A 74 0.313 -12.829 -11.678 1.00 0.00 H new ATOM 0 HA ASN A 74 0.597 -13.170 -9.559 1.00 0.00 H new ATOM 0 HB2 ASN A 74 1.640 -15.950 -10.164 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.048 -15.365 -8.622 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.459 -15.382 -9.676 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -1.323 -14.443 -8.701 1.00 0.00 H new ATOM 629 N GLN A 75 3.297 -12.475 -10.469 1.00 0.00 N ATOM 630 CA GLN A 75 4.543 -11.787 -10.123 1.00 0.00 C ATOM 631 C GLN A 75 4.246 -10.471 -9.373 1.00 0.00 C ATOM 632 O GLN A 75 3.092 -10.194 -9.032 1.00 0.00 O ATOM 633 CB GLN A 75 5.385 -11.576 -11.402 1.00 0.00 C ATOM 634 CG GLN A 75 5.757 -12.899 -12.099 1.00 0.00 C ATOM 635 CD GLN A 75 6.598 -12.664 -13.355 1.00 0.00 C ATOM 636 OE1 GLN A 75 6.104 -12.655 -14.476 1.00 0.00 O ATOM 637 NE2 GLN A 75 7.894 -12.449 -13.228 1.00 0.00 N ATOM 0 H GLN A 75 2.930 -12.201 -11.380 1.00 0.00 H new ATOM 0 HA GLN A 75 5.132 -12.400 -9.441 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.829 -10.948 -12.098 1.00 0.00 H new ATOM 0 HB3 GLN A 75 6.297 -11.037 -11.146 1.00 0.00 H new ATOM 0 HG2 GLN A 75 6.310 -13.532 -11.405 1.00 0.00 H new ATOM 0 HG3 GLN A 75 4.847 -13.437 -12.366 1.00 0.00 H new ATOM 0 HE21 GLN A 75 8.323 -12.453 -12.303 1.00 0.00 H new ATOM 0 HE22 GLN A 75 8.466 -12.279 -14.055 1.00 0.00 H new ATOM 646 N THR A 76 5.274 -9.649 -9.118 1.00 0.00 N ATOM 647 CA THR A 76 5.206 -8.404 -8.339 1.00 0.00 C ATOM 648 C THR A 76 6.160 -7.367 -8.909 1.00 0.00 C ATOM 649 O THR A 76 7.242 -7.709 -9.388 1.00 0.00 O ATOM 650 CB THR A 76 5.549 -8.610 -6.852 1.00 0.00 C ATOM 651 OG1 THR A 76 6.600 -9.543 -6.692 1.00 0.00 O ATOM 652 CG2 THR A 76 4.345 -9.086 -6.046 1.00 0.00 C ATOM 0 H THR A 76 6.214 -9.841 -9.463 1.00 0.00 H new ATOM 0 HA THR A 76 4.174 -8.061 -8.409 1.00 0.00 H new ATOM 0 HB THR A 76 5.862 -7.636 -6.475 1.00 0.00 H new ATOM 0 HG1 THR A 76 6.798 -9.653 -5.738 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.634 -9.218 -5.003 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.548 -8.345 -6.111 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.991 -10.036 -6.447 1.00 0.00 H new ATOM 660 N ASP A 77 5.778 -6.096 -8.808 1.00 0.00 N ATOM 661 CA ASP A 77 6.603 -4.944 -9.182 1.00 0.00 C ATOM 662 C ASP A 77 6.764 -3.972 -8.008 1.00 0.00 C ATOM 663 O ASP A 77 5.787 -3.620 -7.345 1.00 0.00 O ATOM 664 CB ASP A 77 5.952 -4.234 -10.368 1.00 0.00 C ATOM 665 CG ASP A 77 6.879 -3.181 -10.995 1.00 0.00 C ATOM 666 OD1 ASP A 77 7.985 -3.551 -11.458 1.00 0.00 O ATOM 667 OD2 ASP A 77 6.495 -1.988 -11.032 1.00 0.00 O1- ATOM 0 H ASP A 77 4.860 -5.829 -8.454 1.00 0.00 H new ATOM 0 HA ASP A 77 7.597 -5.296 -9.458 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.678 -4.970 -11.124 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.030 -3.754 -10.040 1.00 0.00 H new ATOM 672 N LYS A 78 8.000 -3.531 -7.762 1.00 0.00 N ATOM 673 CA LYS A 78 8.343 -2.631 -6.655 1.00 0.00 C ATOM 674 C LYS A 78 8.001 -1.172 -6.998 1.00 0.00 C ATOM 675 O LYS A 78 8.547 -0.588 -7.940 1.00 0.00 O ATOM 676 CB LYS A 78 9.825 -2.820 -6.274 1.00 0.00 C ATOM 677 CG LYS A 78 10.164 -2.141 -4.935 1.00 0.00 C ATOM 678 CD LYS A 78 11.611 -2.443 -4.515 1.00 0.00 C ATOM 679 CE LYS A 78 11.897 -1.869 -3.118 1.00 0.00 C ATOM 680 NZ LYS A 78 13.256 -2.227 -2.636 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.803 -3.792 -8.334 1.00 0.00 H new ATOM 0 HA LYS A 78 7.740 -2.885 -5.783 1.00 0.00 H new ATOM 0 HB2 LYS A 78 10.050 -3.884 -6.209 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.457 -2.408 -7.060 1.00 0.00 H new ATOM 0 HG2 LYS A 78 10.025 -1.064 -5.024 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.477 -2.488 -4.163 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.778 -3.520 -4.513 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.303 -2.014 -5.240 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.796 -0.784 -3.144 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.153 -2.241 -2.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.254 -2.277 -1.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.531 -3.151 -3.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.936 -1.504 -2.946 1.00 0.00 H new ATOM 694 N LEU A 79 7.105 -0.580 -6.208 1.00 0.00 N ATOM 695 CA LEU A 79 6.540 0.752 -6.430 1.00 0.00 C ATOM 696 C LEU A 79 7.393 1.832 -5.763 1.00 0.00 C ATOM 697 O LEU A 79 7.828 2.766 -6.432 1.00 0.00 O ATOM 698 CB LEU A 79 5.108 0.768 -5.869 1.00 0.00 C ATOM 699 CG LEU A 79 4.159 -0.258 -6.518 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.891 -0.303 -5.667 1.00 0.00 C ATOM 701 CD2 LEU A 79 3.834 0.099 -7.976 1.00 0.00 C ATOM 0 H LEU A 79 6.740 -1.029 -5.368 1.00 0.00 H new ATOM 0 HA LEU A 79 6.526 0.969 -7.498 1.00 0.00 H new ATOM 0 HB2 LEU A 79 5.149 0.579 -4.796 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.690 1.766 -6.001 1.00 0.00 H new ATOM 0 HG LEU A 79 4.638 -1.236 -6.551 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.191 -1.021 -6.095 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.145 -0.605 -4.651 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.431 0.685 -5.647 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.162 -0.651 -8.393 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.354 1.077 -8.013 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.755 0.125 -8.558 1.00 0.00 H new ATOM 713 N ALA A 80 7.654 1.677 -4.463 1.00 0.00 N ATOM 714 CA ALA A 80 8.354 2.637 -3.609 1.00 0.00 C ATOM 715 C ALA A 80 8.784 1.972 -2.287 1.00 0.00 C ATOM 716 O ALA A 80 8.409 0.831 -2.002 1.00 0.00 O ATOM 717 CB ALA A 80 7.441 3.857 -3.391 1.00 0.00 C ATOM 0 H ALA A 80 7.370 0.840 -3.954 1.00 0.00 H new ATOM 0 HA ALA A 80 9.271 2.978 -4.090 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.949 4.583 -2.756 1.00 0.00 H new ATOM 0 HB2 ALA A 80 7.210 4.315 -4.353 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.516 3.538 -2.910 1.00 0.00 H new ATOM 723 N ALA A 81 9.573 2.688 -1.483 1.00 0.00 N ATOM 724 CA ALA A 81 10.122 2.226 -0.207 1.00 0.00 C ATOM 725 C ALA A 81 10.548 3.404 0.687 1.00 0.00 C ATOM 726 O ALA A 81 10.662 4.535 0.206 1.00 0.00 O ATOM 727 CB ALA A 81 11.306 1.285 -0.497 1.00 0.00 C ATOM 0 H ALA A 81 9.857 3.641 -1.711 1.00 0.00 H new ATOM 0 HA ALA A 81 9.352 1.686 0.343 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.728 0.931 0.443 1.00 0.00 H new ATOM 0 HB2 ALA A 81 10.959 0.434 -1.083 1.00 0.00 H new ATOM 0 HB3 ALA A 81 12.070 1.824 -1.057 1.00 0.00 H new ATOM 733 N PHE A 82 10.830 3.135 1.967 1.00 0.00 N ATOM 734 CA PHE A 82 11.442 4.094 2.890 1.00 0.00 C ATOM 735 C PHE A 82 12.182 3.411 4.070 1.00 0.00 C ATOM 736 O PHE A 82 11.605 2.516 4.699 1.00 0.00 O ATOM 737 CB PHE A 82 10.395 5.089 3.414 1.00 0.00 C ATOM 738 CG PHE A 82 11.039 6.287 4.086 1.00 0.00 C ATOM 739 CD1 PHE A 82 11.436 7.394 3.312 1.00 0.00 C ATOM 740 CD2 PHE A 82 11.323 6.262 5.466 1.00 0.00 C ATOM 741 CE1 PHE A 82 12.094 8.477 3.919 1.00 0.00 C ATOM 742 CE2 PHE A 82 11.990 7.342 6.069 1.00 0.00 C ATOM 743 CZ PHE A 82 12.371 8.453 5.297 1.00 0.00 C ATOM 0 H PHE A 82 10.636 2.230 2.396 1.00 0.00 H new ATOM 0 HA PHE A 82 12.196 4.636 2.319 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.771 5.429 2.587 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.738 4.585 4.123 1.00 0.00 H new ATOM 0 HD1 PHE A 82 11.235 7.411 2.251 1.00 0.00 H new ATOM 0 HD2 PHE A 82 11.027 5.411 6.062 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.388 9.330 3.325 1.00 0.00 H new ATOM 0 HE2 PHE A 82 12.210 7.318 7.126 1.00 0.00 H new ATOM 0 HZ PHE A 82 12.876 9.287 5.762 1.00 0.00 H new ATOM 753 N PRO A 83 13.410 3.856 4.425 1.00 0.00 N ATOM 754 CA PRO A 83 14.264 4.738 3.630 1.00 0.00 C ATOM 755 C PRO A 83 14.660 4.017 2.340 1.00 0.00 C ATOM 756 O PRO A 83 14.912 2.813 2.343 1.00 0.00 O ATOM 757 CB PRO A 83 15.469 5.081 4.499 1.00 0.00 C ATOM 758 CG PRO A 83 15.563 3.898 5.464 1.00 0.00 C ATOM 759 CD PRO A 83 14.111 3.450 5.636 1.00 0.00 C ATOM 0 HA PRO A 83 13.760 5.659 3.337 1.00 0.00 H new ATOM 0 HB2 PRO A 83 16.376 5.186 3.904 1.00 0.00 H new ATOM 0 HB3 PRO A 83 15.326 6.022 5.030 1.00 0.00 H new ATOM 0 HG2 PRO A 83 16.183 3.099 5.058 1.00 0.00 H new ATOM 0 HG3 PRO A 83 16.006 4.192 6.415 1.00 0.00 H new ATOM 0 HD2 PRO A 83 14.051 2.371 5.776 1.00 0.00 H new ATOM 0 HD3 PRO A 83 13.664 3.911 6.517 1.00 0.00 H new ATOM 907 N ARG A 94 3.382 9.200 -8.976 1.00 0.00 N ATOM 908 CA ARG A 94 2.146 9.112 -8.184 1.00 0.00 C ATOM 909 C ARG A 94 2.184 8.079 -7.048 1.00 0.00 C ATOM 910 O ARG A 94 1.337 8.160 -6.159 1.00 0.00 O ATOM 911 CB ARG A 94 0.928 8.900 -9.100 1.00 0.00 C ATOM 912 CG ARG A 94 0.795 7.515 -9.756 1.00 0.00 C ATOM 913 CD ARG A 94 -0.468 7.476 -10.642 1.00 0.00 C ATOM 914 NE ARG A 94 -0.618 6.201 -11.369 1.00 0.00 N ATOM 915 CZ ARG A 94 0.163 5.751 -12.345 1.00 0.00 C ATOM 916 NH1 ARG A 94 1.132 6.471 -12.864 1.00 0.00 N1+ ATOM 917 NH2 ARG A 94 -0.017 4.550 -12.837 1.00 0.00 N ATOM 0 HA ARG A 94 2.052 10.073 -7.679 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.026 9.090 -8.518 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.961 9.650 -9.890 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.679 7.301 -10.357 1.00 0.00 H new ATOM 0 HG3 ARG A 94 0.736 6.743 -8.989 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -1.348 7.640 -10.020 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.428 8.296 -11.360 1.00 0.00 H new ATOM 0 HE ARG A 94 -1.399 5.605 -11.095 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.308 7.414 -12.518 1.00 0.00 H new ATOM 0 HH12 ARG A 94 1.708 6.086 -13.613 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -0.760 3.955 -12.471 1.00 0.00 H new ATOM 0 HH22 ARG A 94 0.586 4.210 -13.586 1.00 0.00 H new ATOM 931 N PHE A 95 3.128 7.131 -7.059 1.00 0.00 N ATOM 932 CA PHE A 95 3.300 6.115 -6.009 1.00 0.00 C ATOM 933 C PHE A 95 4.277 6.619 -4.933 1.00 0.00 C ATOM 934 O PHE A 95 5.440 6.893 -5.235 1.00 0.00 O ATOM 935 CB PHE A 95 3.789 4.800 -6.637 1.00 0.00 C ATOM 936 CG PHE A 95 2.828 4.195 -7.644 1.00 0.00 C ATOM 937 CD1 PHE A 95 1.748 3.405 -7.206 1.00 0.00 C ATOM 938 CD2 PHE A 95 3.006 4.425 -9.022 1.00 0.00 C ATOM 939 CE1 PHE A 95 0.847 2.858 -8.137 1.00 0.00 C ATOM 940 CE2 PHE A 95 2.107 3.874 -9.953 1.00 0.00 C ATOM 941 CZ PHE A 95 1.023 3.095 -9.511 1.00 0.00 C ATOM 0 H PHE A 95 3.809 7.045 -7.813 1.00 0.00 H new ATOM 0 HA PHE A 95 2.342 5.928 -5.524 1.00 0.00 H new ATOM 0 HB2 PHE A 95 4.746 4.979 -7.127 1.00 0.00 H new ATOM 0 HB3 PHE A 95 3.968 4.076 -5.842 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.611 3.218 -6.151 1.00 0.00 H new ATOM 0 HD2 PHE A 95 3.835 5.026 -9.365 1.00 0.00 H new ATOM 0 HE1 PHE A 95 0.019 2.255 -7.796 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.250 4.050 -11.009 1.00 0.00 H new ATOM 0 HZ PHE A 95 0.328 2.680 -10.225 1.00 0.00 H new ATOM 951 N ARG A 96 3.805 6.764 -3.688 1.00 0.00 N ATOM 952 CA ARG A 96 4.530 7.438 -2.595 1.00 0.00 C ATOM 953 C ARG A 96 4.385 6.698 -1.253 1.00 0.00 C ATOM 954 O ARG A 96 3.379 6.030 -1.014 1.00 0.00 O ATOM 955 CB ARG A 96 4.031 8.895 -2.470 1.00 0.00 C ATOM 956 CG ARG A 96 4.198 9.679 -3.784 1.00 0.00 C ATOM 957 CD ARG A 96 3.796 11.151 -3.674 1.00 0.00 C ATOM 958 NE ARG A 96 3.841 11.768 -5.009 1.00 0.00 N ATOM 959 CZ ARG A 96 3.501 13.004 -5.343 1.00 0.00 C ATOM 960 NH1 ARG A 96 3.095 13.891 -4.460 1.00 0.00 N ATOM 961 NH2 ARG A 96 3.572 13.345 -6.610 1.00 0.00 N1+ ATOM 0 H ARG A 96 2.891 6.411 -3.404 1.00 0.00 H new ATOM 0 HA ARG A 96 5.592 7.432 -2.842 1.00 0.00 H new ATOM 0 HB2 ARG A 96 2.980 8.894 -2.180 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.581 9.399 -1.675 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.238 9.618 -4.104 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.597 9.204 -4.560 1.00 0.00 H new ATOM 0 HD2 ARG A 96 2.793 11.236 -3.255 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.470 11.674 -2.996 1.00 0.00 H new ATOM 0 HE ARG A 96 4.174 11.173 -5.768 1.00 0.00 H new ATOM 0 HH11 ARG A 96 3.032 13.637 -3.474 1.00 0.00 H new ATOM 0 HH12 ARG A 96 2.843 14.832 -4.761 1.00 0.00 H new ATOM 0 HH21 ARG A 96 3.882 12.665 -7.304 1.00 0.00 H new ATOM 0 HH22 ARG A 96 3.317 14.289 -6.899 1.00 0.00 H new ATOM 975 N VAL A 97 5.381 6.838 -0.373 1.00 0.00 N ATOM 976 CA VAL A 97 5.423 6.258 0.987 1.00 0.00 C ATOM 977 C VAL A 97 5.702 7.371 2.007 1.00 0.00 C ATOM 978 O VAL A 97 6.653 8.135 1.830 1.00 0.00 O ATOM 979 CB VAL A 97 6.489 5.136 1.094 1.00 0.00 C ATOM 980 CG1 VAL A 97 6.649 4.601 2.527 1.00 0.00 C ATOM 981 CG2 VAL A 97 6.127 3.955 0.177 1.00 0.00 C ATOM 0 H VAL A 97 6.218 7.379 -0.591 1.00 0.00 H new ATOM 0 HA VAL A 97 4.455 5.805 1.201 1.00 0.00 H new ATOM 0 HB VAL A 97 7.432 5.588 0.787 1.00 0.00 H new ATOM 0 HG11 VAL A 97 7.408 3.819 2.541 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.954 5.413 3.187 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.699 4.191 2.871 1.00 0.00 H new ATOM 0 HG21 VAL A 97 6.887 3.179 0.266 1.00 0.00 H new ATOM 0 HG22 VAL A 97 5.158 3.550 0.470 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.079 4.298 -0.856 1.00 0.00 H new ATOM 991 N THR A 98 4.876 7.458 3.060 1.00 0.00 N ATOM 992 CA THR A 98 4.934 8.501 4.105 1.00 0.00 C ATOM 993 C THR A 98 4.968 7.861 5.493 1.00 0.00 C ATOM 994 O THR A 98 4.173 6.970 5.776 1.00 0.00 O ATOM 995 CB THR A 98 3.720 9.434 3.979 1.00 0.00 C ATOM 996 OG1 THR A 98 3.746 10.049 2.709 1.00 0.00 O ATOM 997 CG2 THR A 98 3.716 10.558 5.017 1.00 0.00 C ATOM 0 H THR A 98 4.125 6.786 3.216 1.00 0.00 H new ATOM 0 HA THR A 98 5.845 9.085 3.971 1.00 0.00 H new ATOM 0 HB THR A 98 2.835 8.816 4.132 1.00 0.00 H new ATOM 0 HG1 THR A 98 2.974 10.645 2.618 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.833 11.182 4.875 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.699 10.128 6.019 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.613 11.166 4.898 1.00 0.00 H new ATOM 1005 N GLN A 99 5.868 8.324 6.365 1.00 0.00 N ATOM 1006 CA GLN A 99 5.977 7.863 7.757 1.00 0.00 C ATOM 1007 C GLN A 99 4.940 8.535 8.673 1.00 0.00 C ATOM 1008 O GLN A 99 4.662 9.731 8.542 1.00 0.00 O ATOM 1009 CB GLN A 99 7.414 8.058 8.286 1.00 0.00 C ATOM 1010 CG GLN A 99 7.864 9.524 8.434 1.00 0.00 C ATOM 1011 CD GLN A 99 9.294 9.635 8.969 1.00 0.00 C ATOM 1012 OE1 GLN A 99 9.533 9.902 10.140 1.00 0.00 O ATOM 1013 NE2 GLN A 99 10.304 9.431 8.144 1.00 0.00 N ATOM 0 H GLN A 99 6.553 9.040 6.123 1.00 0.00 H new ATOM 0 HA GLN A 99 5.755 6.796 7.767 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.496 7.569 9.257 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.104 7.549 7.613 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.799 10.022 7.467 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.184 10.046 9.107 1.00 0.00 H new ATOM 0 HE21 GLN A 99 10.126 9.207 7.165 1.00 0.00 H new ATOM 0 HE22 GLN A 99 11.263 9.497 8.486 1.00 0.00 H new ATOM 1022 N LEU A 100 4.382 7.777 9.624 1.00 0.00 N ATOM 1023 CA LEU A 100 3.504 8.297 10.681 1.00 0.00 C ATOM 1024 C LEU A 100 4.308 8.694 11.939 1.00 0.00 C ATOM 1025 O LEU A 100 5.391 8.137 12.165 1.00 0.00 O ATOM 1026 CB LEU A 100 2.437 7.238 11.034 1.00 0.00 C ATOM 1027 CG LEU A 100 1.580 6.733 9.855 1.00 0.00 C ATOM 1028 CD1 LEU A 100 0.409 5.901 10.395 1.00 0.00 C ATOM 1029 CD2 LEU A 100 1.023 7.864 8.981 1.00 0.00 C ATOM 0 H LEU A 100 4.529 6.769 9.683 1.00 0.00 H new ATOM 0 HA LEU A 100 3.013 9.196 10.309 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.937 6.383 11.488 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.772 7.657 11.789 1.00 0.00 H new ATOM 0 HG LEU A 100 2.237 6.132 9.226 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.198 5.543 9.563 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.795 5.049 10.955 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.204 6.519 11.052 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.430 7.439 8.171 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.395 8.516 9.587 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.848 8.441 8.563 1.00 0.00 H new ATOM 1041 N PRO A 101 3.765 9.573 12.812 1.00 0.00 N ATOM 1042 CA PRO A 101 4.386 9.933 14.091 1.00 0.00 C ATOM 1043 C PRO A 101 4.477 8.770 15.098 1.00 0.00 C ATOM 1044 O PRO A 101 5.119 8.928 16.136 1.00 0.00 O ATOM 1045 CB PRO A 101 3.559 11.104 14.636 1.00 0.00 C ATOM 1046 CG PRO A 101 2.184 10.894 14.006 1.00 0.00 C ATOM 1047 CD PRO A 101 2.536 10.339 12.629 1.00 0.00 C ATOM 0 HA PRO A 101 5.429 10.206 13.933 1.00 0.00 H new ATOM 0 HB2 PRO A 101 3.508 11.087 15.725 1.00 0.00 H new ATOM 0 HB3 PRO A 101 3.988 12.065 14.352 1.00 0.00 H new ATOM 0 HG2 PRO A 101 1.576 10.197 14.582 1.00 0.00 H new ATOM 0 HG3 PRO A 101 1.622 11.825 13.937 1.00 0.00 H new ATOM 0 HD2 PRO A 101 1.735 9.707 12.245 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.680 11.144 11.908 1.00 0.00 H new ATOM 1055 N ASN A 102 3.894 7.595 14.807 1.00 0.00 N ATOM 1056 CA ASN A 102 4.115 6.370 15.592 1.00 0.00 C ATOM 1057 C ASN A 102 5.590 5.895 15.555 1.00 0.00 C ATOM 1058 O ASN A 102 6.062 5.247 16.492 1.00 0.00 O ATOM 1059 CB ASN A 102 3.175 5.284 15.042 1.00 0.00 C ATOM 1060 CG ASN A 102 3.312 3.964 15.796 1.00 0.00 C ATOM 1061 OD1 ASN A 102 4.067 3.082 15.406 1.00 0.00 O ATOM 1062 ND2 ASN A 102 2.610 3.803 16.906 1.00 0.00 N ATOM 0 H ASN A 102 3.256 7.468 14.021 1.00 0.00 H new ATOM 0 HA ASN A 102 3.897 6.576 16.640 1.00 0.00 H new ATOM 0 HB2 ASN A 102 2.144 5.632 15.107 1.00 0.00 H new ATOM 0 HB3 ASN A 102 3.390 5.121 13.986 1.00 0.00 H new ATOM 0 HD21 ASN A 102 2.696 2.940 17.443 1.00 0.00 H new ATOM 0 HD22 ASN A 102 1.983 4.542 17.225 1.00 0.00 H new ATOM 1069 N GLY A 103 6.328 6.243 14.491 1.00 0.00 N ATOM 1070 CA GLY A 103 7.774 6.030 14.329 1.00 0.00 C ATOM 1071 C GLY A 103 8.142 4.799 13.497 1.00 0.00 C ATOM 1072 O GLY A 103 9.113 4.869 12.741 1.00 0.00 O ATOM 0 H GLY A 103 5.913 6.703 13.681 1.00 0.00 H new ATOM 0 HA2 GLY A 103 8.209 6.913 13.861 1.00 0.00 H new ATOM 0 HA3 GLY A 103 8.228 5.936 15.315 1.00 0.00 H new ATOM 1076 N ARG A 104 7.357 3.711 13.574 1.00 0.00 N ATOM 1077 CA ARG A 104 7.468 2.536 12.688 1.00 0.00 C ATOM 1078 C ARG A 104 6.066 2.086 12.239 1.00 0.00 C ATOM 1079 O ARG A 104 5.534 1.058 12.660 1.00 0.00 O ATOM 1080 CB ARG A 104 8.270 1.393 13.356 1.00 0.00 C ATOM 1081 CG ARG A 104 9.668 1.823 13.842 1.00 0.00 C ATOM 1082 CD ARG A 104 10.671 0.676 14.041 1.00 0.00 C ATOM 1083 NE ARG A 104 10.175 -0.409 14.911 1.00 0.00 N ATOM 1084 CZ ARG A 104 10.887 -1.472 15.278 1.00 0.00 C ATOM 1085 NH1 ARG A 104 12.179 -1.546 15.049 1.00 0.00 N ATOM 1086 NH2 ARG A 104 10.309 -2.491 15.875 1.00 0.00 N1+ ATOM 0 H ARG A 104 6.613 3.620 14.266 1.00 0.00 H new ATOM 0 HA ARG A 104 8.030 2.818 11.798 1.00 0.00 H new ATOM 0 HB2 ARG A 104 7.702 1.009 14.203 1.00 0.00 H new ATOM 0 HB3 ARG A 104 8.378 0.573 12.646 1.00 0.00 H new ATOM 0 HG2 ARG A 104 10.084 2.528 13.123 1.00 0.00 H new ATOM 0 HG3 ARG A 104 9.559 2.357 14.786 1.00 0.00 H new ATOM 0 HD2 ARG A 104 10.928 0.259 13.068 1.00 0.00 H new ATOM 0 HD3 ARG A 104 11.589 1.079 14.468 1.00 0.00 H new ATOM 0 HE ARG A 104 9.218 -0.339 15.256 1.00 0.00 H new ATOM 0 HH11 ARG A 104 12.659 -0.778 14.580 1.00 0.00 H new ATOM 0 HH12 ARG A 104 12.702 -2.372 15.340 1.00 0.00 H new ATOM 0 HH21 ARG A 104 9.306 -2.471 16.061 1.00 0.00 H new ATOM 0 HH22 ARG A 104 10.863 -3.301 16.152 1.00 0.00 H new ATOM 1100 N ASP A 105 5.489 2.877 11.336 1.00 0.00 N ATOM 1101 CA ASP A 105 4.142 2.765 10.755 1.00 0.00 C ATOM 1102 C ASP A 105 4.070 3.740 9.572 1.00 0.00 C ATOM 1103 O ASP A 105 4.629 4.842 9.644 1.00 0.00 O ATOM 1104 CB ASP A 105 3.066 3.081 11.809 1.00 0.00 C ATOM 1105 CG ASP A 105 1.683 2.471 11.522 1.00 0.00 C ATOM 1106 OD1 ASP A 105 1.208 2.540 10.368 1.00 0.00 O ATOM 1107 OD2 ASP A 105 1.065 1.940 12.475 1.00 0.00 O1- ATOM 0 H ASP A 105 5.989 3.681 10.957 1.00 0.00 H new ATOM 0 HA ASP A 105 3.954 1.748 10.412 1.00 0.00 H new ATOM 0 HB2 ASP A 105 3.411 2.723 12.779 1.00 0.00 H new ATOM 0 HB3 ASP A 105 2.961 4.163 11.888 1.00 0.00 H new ATOM 1112 N PHE A 106 3.434 3.324 8.478 1.00 0.00 N ATOM 1113 CA PHE A 106 3.505 4.031 7.196 1.00 0.00 C ATOM 1114 C PHE A 106 2.199 4.022 6.393 1.00 0.00 C ATOM 1115 O PHE A 106 1.428 3.064 6.415 1.00 0.00 O ATOM 1116 CB PHE A 106 4.624 3.405 6.344 1.00 0.00 C ATOM 1117 CG PHE A 106 6.040 3.692 6.814 1.00 0.00 C ATOM 1118 CD1 PHE A 106 6.631 2.931 7.843 1.00 0.00 C ATOM 1119 CD2 PHE A 106 6.783 4.715 6.199 1.00 0.00 C ATOM 1120 CE1 PHE A 106 7.947 3.197 8.258 1.00 0.00 C ATOM 1121 CE2 PHE A 106 8.101 4.978 6.609 1.00 0.00 C ATOM 1122 CZ PHE A 106 8.684 4.223 7.641 1.00 0.00 C ATOM 0 H PHE A 106 2.853 2.486 8.453 1.00 0.00 H new ATOM 0 HA PHE A 106 3.707 5.076 7.432 1.00 0.00 H new ATOM 0 HB2 PHE A 106 4.479 2.325 6.321 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.520 3.762 5.319 1.00 0.00 H new ATOM 0 HD1 PHE A 106 6.069 2.139 8.315 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.339 5.301 5.408 1.00 0.00 H new ATOM 0 HE1 PHE A 106 8.392 2.614 9.050 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.668 5.763 6.130 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.695 4.430 7.959 1.00 0.00 H new ATOM 1132 N HIS A 107 2.007 5.089 5.616 1.00 0.00 N ATOM 1133 CA HIS A 107 0.981 5.216 4.582 1.00 0.00 C ATOM 1134 C HIS A 107 1.597 5.008 3.183 1.00 0.00 C ATOM 1135 O HIS A 107 2.580 5.662 2.824 1.00 0.00 O ATOM 1136 CB HIS A 107 0.322 6.602 4.686 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.766 6.726 5.725 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.337 5.687 6.469 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -1.385 7.896 6.055 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.272 6.268 7.241 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -2.327 7.591 7.012 1.00 0.00 N ATOM 0 H HIS A 107 2.588 5.924 5.694 1.00 0.00 H new ATOM 0 HA HIS A 107 0.221 4.449 4.731 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.096 7.338 4.905 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -0.097 6.860 3.713 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -1.176 8.873 5.645 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -2.895 5.742 7.950 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -2.956 8.253 7.467 1.00 0.00 H new ATOM 1149 N MET A 108 0.993 4.121 2.391 1.00 0.00 N ATOM 1150 CA MET A 108 1.333 3.803 0.998 1.00 0.00 C ATOM 1151 C MET A 108 0.258 4.415 0.095 1.00 0.00 C ATOM 1152 O MET A 108 -0.896 3.991 0.140 1.00 0.00 O ATOM 1153 CB MET A 108 1.370 2.274 0.832 1.00 0.00 C ATOM 1154 CG MET A 108 2.725 1.652 1.186 1.00 0.00 C ATOM 1155 SD MET A 108 3.295 1.844 2.895 1.00 0.00 S ATOM 1156 CE MET A 108 4.926 1.081 2.712 1.00 0.00 C ATOM 0 H MET A 108 0.203 3.569 2.724 1.00 0.00 H new ATOM 0 HA MET A 108 2.308 4.208 0.729 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.600 1.830 1.462 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.122 2.023 -0.199 1.00 0.00 H new ATOM 0 HG2 MET A 108 2.678 0.586 0.962 1.00 0.00 H new ATOM 0 HG3 MET A 108 3.479 2.083 0.527 1.00 0.00 H new ATOM 0 HE1 MET A 108 5.467 1.148 3.656 1.00 0.00 H new ATOM 0 HE2 MET A 108 4.809 0.033 2.435 1.00 0.00 H new ATOM 0 HE3 MET A 108 5.486 1.601 1.935 1.00 0.00 H new ATOM 1166 N SER A 109 0.613 5.412 -0.713 1.00 0.00 N ATOM 1167 CA SER A 109 -0.356 6.254 -1.431 1.00 0.00 C ATOM 1168 C SER A 109 -0.201 6.255 -2.963 1.00 0.00 C ATOM 1169 O SER A 109 0.899 6.465 -3.476 1.00 0.00 O ATOM 1170 CB SER A 109 -0.235 7.708 -0.942 1.00 0.00 C ATOM 1171 OG SER A 109 -0.492 7.832 0.450 1.00 0.00 O ATOM 0 H SER A 109 1.585 5.664 -0.892 1.00 0.00 H new ATOM 0 HA SER A 109 -1.331 5.820 -1.211 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.766 8.080 -1.159 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.934 8.335 -1.496 1.00 0.00 H new ATOM 0 HG SER A 109 -1.457 7.774 0.611 1.00 0.00 H new ATOM 1177 N VAL A 110 -1.313 6.079 -3.691 1.00 0.00 N ATOM 1178 CA VAL A 110 -1.437 6.302 -5.143 1.00 0.00 C ATOM 1179 C VAL A 110 -2.143 7.651 -5.317 1.00 0.00 C ATOM 1180 O VAL A 110 -3.351 7.764 -5.098 1.00 0.00 O ATOM 1181 CB VAL A 110 -2.239 5.202 -5.892 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -2.146 5.425 -7.414 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -1.776 3.774 -5.577 1.00 0.00 C ATOM 0 H VAL A 110 -2.187 5.765 -3.270 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.438 6.278 -5.579 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.267 5.294 -5.541 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.711 4.649 -7.931 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.559 6.402 -7.664 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.102 5.381 -7.725 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.383 3.063 -6.137 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.730 3.660 -5.860 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.886 3.583 -4.509 1.00 0.00 H new ATOM 1193 N VAL A 111 -1.384 8.683 -5.685 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.906 10.042 -5.914 1.00 0.00 C ATOM 1195 C VAL A 111 -2.774 10.061 -7.182 1.00 0.00 C ATOM 1196 O VAL A 111 -2.328 9.625 -8.243 1.00 0.00 O ATOM 1197 CB VAL A 111 -0.759 11.079 -5.997 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -1.250 12.493 -6.353 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.003 11.149 -4.661 1.00 0.00 C ATOM 0 H VAL A 111 -0.378 8.604 -5.836 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.528 10.324 -5.065 1.00 0.00 H new ATOM 0 HB VAL A 111 -0.103 10.737 -6.798 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -0.400 13.173 -6.396 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.747 12.472 -7.323 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.952 12.837 -5.593 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.805 11.883 -4.738 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.683 11.443 -3.866 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.426 10.171 -4.432 1.00 0.00 H new ATOM 1209 N ARG A 112 -4.012 10.562 -7.067 1.00 0.00 N ATOM 1210 CA ARG A 112 -4.988 10.714 -8.162 1.00 0.00 C ATOM 1211 C ARG A 112 -5.104 9.445 -9.021 1.00 0.00 C ATOM 1212 O ARG A 112 -4.805 9.445 -10.218 1.00 0.00 O ATOM 1213 CB ARG A 112 -4.683 11.978 -8.985 1.00 0.00 C ATOM 1214 CG ARG A 112 -4.839 13.229 -8.113 1.00 0.00 C ATOM 1215 CD ARG A 112 -4.667 14.511 -8.932 1.00 0.00 C ATOM 1216 NE ARG A 112 -4.822 15.705 -8.084 1.00 0.00 N ATOM 1217 CZ ARG A 112 -4.703 16.970 -8.474 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -4.419 17.294 -9.719 1.00 0.00 N ATOM 1219 NH2 ARG A 112 -4.870 17.941 -7.602 1.00 0.00 N1+ ATOM 0 H ARG A 112 -4.379 10.887 -6.172 1.00 0.00 H new ATOM 0 HA ARG A 112 -5.975 10.849 -7.720 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -3.669 11.927 -9.381 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -5.357 12.035 -9.840 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -5.823 13.226 -7.643 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -4.102 13.208 -7.310 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -3.683 14.518 -9.400 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -5.402 14.534 -9.736 1.00 0.00 H new ATOM 0 HE ARG A 112 -5.042 15.546 -7.101 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -4.283 16.563 -10.418 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -4.335 18.275 -9.984 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -5.090 17.722 -6.630 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -4.779 18.913 -7.898 1.00 0.00 H new ATOM 1233 N ALA A 113 -5.476 8.342 -8.374 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.452 6.994 -8.933 1.00 0.00 C ATOM 1235 C ALA A 113 -6.340 6.852 -10.181 1.00 0.00 C ATOM 1236 O ALA A 113 -7.460 7.365 -10.234 1.00 0.00 O ATOM 1237 CB ALA A 113 -5.861 6.025 -7.819 1.00 0.00 C ATOM 0 H ALA A 113 -5.814 8.365 -7.412 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.446 6.762 -9.282 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -5.854 5.005 -8.203 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.158 6.106 -6.990 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.863 6.274 -7.470 1.00 0.00 H new ATOM 1243 N ARG A 114 -5.813 6.148 -11.183 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.431 5.924 -12.498 1.00 0.00 C ATOM 1245 C ARG A 114 -7.078 4.537 -12.540 1.00 0.00 C ATOM 1246 O ARG A 114 -6.650 3.643 -11.812 1.00 0.00 O ATOM 1247 CB ARG A 114 -5.328 6.034 -13.567 1.00 0.00 C ATOM 1248 CG ARG A 114 -4.710 7.445 -13.642 1.00 0.00 C ATOM 1249 CD ARG A 114 -3.327 7.424 -14.302 1.00 0.00 C ATOM 1250 NE ARG A 114 -3.393 6.956 -15.701 1.00 0.00 N ATOM 1251 CZ ARG A 114 -2.710 5.960 -16.255 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -1.854 5.226 -15.576 1.00 0.00 N1+ ATOM 1253 NH2 ARG A 114 -2.888 5.680 -17.528 1.00 0.00 N ATOM 0 H ARG A 114 -4.902 5.696 -11.100 1.00 0.00 H new ATOM 0 HA ARG A 114 -7.207 6.666 -12.686 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -4.543 5.309 -13.349 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.743 5.772 -14.540 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -5.372 8.103 -14.205 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -4.628 7.860 -12.637 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -2.896 8.425 -14.274 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -2.662 6.774 -13.733 1.00 0.00 H new ATOM 0 HE ARG A 114 -4.038 7.455 -16.313 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -1.695 5.413 -14.586 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -1.350 4.470 -16.040 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -3.547 6.226 -18.083 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -2.367 4.917 -17.960 1.00 0.00 H new ATOM 1267 N ARG A 115 -8.042 4.290 -13.437 1.00 0.00 N ATOM 1268 CA ARG A 115 -8.648 2.944 -13.587 1.00 0.00 C ATOM 1269 C ARG A 115 -7.608 1.863 -13.943 1.00 0.00 C ATOM 1270 O ARG A 115 -7.725 0.720 -13.500 1.00 0.00 O ATOM 1271 CB ARG A 115 -9.817 2.964 -14.580 1.00 0.00 C ATOM 1272 CG ARG A 115 -10.887 3.987 -14.155 1.00 0.00 C ATOM 1273 CD ARG A 115 -12.306 3.534 -14.499 1.00 0.00 C ATOM 1274 NE ARG A 115 -12.740 2.451 -13.595 1.00 0.00 N ATOM 1275 CZ ARG A 115 -13.527 1.421 -13.876 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -14.061 1.240 -15.066 1.00 0.00 N ATOM 1277 NH2 ARG A 115 -13.785 0.545 -12.931 1.00 0.00 N1+ ATOM 0 H ARG A 115 -8.422 4.994 -14.070 1.00 0.00 H new ATOM 0 HA ARG A 115 -9.051 2.669 -12.612 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.448 3.211 -15.576 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -10.263 1.971 -14.642 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -10.815 4.157 -13.081 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -10.686 4.941 -14.643 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -12.992 4.378 -14.420 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -12.343 3.189 -15.532 1.00 0.00 H new ATOM 0 HE ARG A 115 -12.392 2.501 -12.637 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -13.875 1.907 -15.815 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -14.661 0.433 -15.238 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -13.382 0.664 -12.001 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -14.388 -0.254 -13.127 1.00 0.00 H new ATOM 1291 N ASN A 116 -6.535 2.267 -14.633 1.00 0.00 N ATOM 1292 CA ASN A 116 -5.313 1.491 -14.883 1.00 0.00 C ATOM 1293 C ASN A 116 -4.685 0.882 -13.609 1.00 0.00 C ATOM 1294 O ASN A 116 -4.042 -0.165 -13.683 1.00 0.00 O ATOM 1295 CB ASN A 116 -4.310 2.456 -15.546 1.00 0.00 C ATOM 1296 CG ASN A 116 -2.931 1.842 -15.785 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -2.670 1.245 -16.822 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -2.008 1.980 -14.846 1.00 0.00 N ATOM 0 H ASN A 116 -6.493 3.195 -15.055 1.00 0.00 H new ATOM 0 HA ASN A 116 -5.565 0.640 -15.515 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -4.718 2.792 -16.499 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.200 3.340 -14.917 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -1.076 1.589 -14.985 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -2.228 2.478 -13.983 1.00 0.00 H new ATOM 1305 N ASP A 117 -4.840 1.537 -12.453 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.136 1.217 -11.206 1.00 0.00 C ATOM 1307 C ASP A 117 -4.894 0.204 -10.326 1.00 0.00 C ATOM 1308 O ASP A 117 -4.331 -0.299 -9.359 1.00 0.00 O ATOM 1309 CB ASP A 117 -3.846 2.522 -10.435 1.00 0.00 C ATOM 1310 CG ASP A 117 -3.064 3.569 -11.247 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -2.336 3.197 -12.199 1.00 0.00 O ATOM 1312 OD2 ASP A 117 -3.162 4.777 -10.926 1.00 0.00 O1- ATOM 0 H ASP A 117 -5.477 2.327 -12.356 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.197 0.730 -11.470 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.791 2.959 -10.113 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.282 2.282 -9.534 1.00 0.00 H new ATOM 1317 N SER A 118 -6.144 -0.141 -10.653 1.00 0.00 N ATOM 1318 CA SER A 118 -6.912 -1.145 -9.896 1.00 0.00 C ATOM 1319 C SER A 118 -6.261 -2.542 -9.954 1.00 0.00 C ATOM 1320 O SER A 118 -5.781 -2.984 -11.005 1.00 0.00 O ATOM 1321 CB SER A 118 -8.369 -1.233 -10.378 1.00 0.00 C ATOM 1322 OG SER A 118 -9.052 0.011 -10.263 1.00 0.00 O ATOM 0 H SER A 118 -6.651 0.261 -11.441 1.00 0.00 H new ATOM 0 HA SER A 118 -6.907 -0.808 -8.860 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.386 -1.560 -11.418 1.00 0.00 H new ATOM 0 HB3 SER A 118 -8.896 -1.990 -9.797 1.00 0.00 H new ATOM 0 HG SER A 118 -9.915 -0.045 -10.725 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.248 -3.255 -8.824 1.00 0.00 N ATOM 1329 CA GLY A 119 -5.617 -4.577 -8.675 1.00 0.00 C ATOM 1330 C GLY A 119 -5.099 -4.835 -7.262 1.00 0.00 C ATOM 1331 O GLY A 119 -5.405 -4.069 -6.349 1.00 0.00 O ATOM 0 H GLY A 119 -6.686 -2.924 -7.964 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.339 -5.350 -8.938 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.790 -4.660 -9.380 1.00 0.00 H new ATOM 1335 N THR A 120 -4.334 -5.916 -7.072 1.00 0.00 N ATOM 1336 CA THR A 120 -3.800 -6.333 -5.760 1.00 0.00 C ATOM 1337 C THR A 120 -2.448 -5.687 -5.500 1.00 0.00 C ATOM 1338 O THR A 120 -1.603 -5.593 -6.388 1.00 0.00 O ATOM 1339 CB THR A 120 -3.671 -7.856 -5.632 1.00 0.00 C ATOM 1340 OG1 THR A 120 -4.822 -8.470 -6.175 1.00 0.00 O ATOM 1341 CG2 THR A 120 -3.543 -8.313 -4.173 1.00 0.00 C ATOM 0 H THR A 120 -4.062 -6.538 -7.833 1.00 0.00 H new ATOM 0 HA THR A 120 -4.520 -5.997 -5.014 1.00 0.00 H new ATOM 0 HB THR A 120 -2.767 -8.145 -6.168 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.742 -9.443 -6.096 1.00 0.00 H new ATOM 0 HG21 THR A 120 -3.455 -9.399 -4.138 1.00 0.00 H new ATOM 0 HG22 THR A 120 -2.656 -7.862 -3.727 1.00 0.00 H new ATOM 0 HG23 THR A 120 -4.427 -8.003 -3.616 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.239 -5.289 -4.253 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.016 -4.704 -3.712 1.00 0.00 C ATOM 1351 C TYR A 121 -0.628 -5.393 -2.390 1.00 0.00 C ATOM 1352 O TYR A 121 -1.475 -6.003 -1.730 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.242 -3.199 -3.466 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.429 -2.342 -4.709 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.629 -2.394 -5.445 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.408 -1.464 -5.116 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -2.786 -1.626 -6.614 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.578 -0.650 -6.252 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.763 -0.736 -7.012 1.00 0.00 C ATOM 1360 OH TYR A 121 -1.903 0.037 -8.122 1.00 0.00 O ATOM 0 H TYR A 121 -2.967 -5.371 -3.543 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.206 -4.846 -4.428 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.121 -3.082 -2.833 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.392 -2.811 -2.905 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.436 -3.029 -5.109 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.512 -1.414 -4.553 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -3.685 -1.717 -7.205 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.200 0.041 -6.542 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.717 -0.224 -8.602 1.00 0.00 H new ATOM 1370 N LEU A 122 0.635 -5.261 -1.971 1.00 0.00 N ATOM 1371 CA LEU A 122 1.149 -5.770 -0.692 1.00 0.00 C ATOM 1372 C LEU A 122 2.399 -5.017 -0.226 1.00 0.00 C ATOM 1373 O LEU A 122 3.081 -4.354 -1.007 1.00 0.00 O ATOM 1374 CB LEU A 122 1.366 -7.302 -0.717 1.00 0.00 C ATOM 1375 CG LEU A 122 2.567 -7.836 -1.527 1.00 0.00 C ATOM 1376 CD1 LEU A 122 2.823 -9.301 -1.143 1.00 0.00 C ATOM 1377 CD2 LEU A 122 2.323 -7.761 -3.041 1.00 0.00 C ATOM 0 H LEU A 122 1.347 -4.785 -2.525 1.00 0.00 H new ATOM 0 HA LEU A 122 0.375 -5.576 0.051 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.475 -7.644 0.312 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.461 -7.764 -1.112 1.00 0.00 H new ATOM 0 HG LEU A 122 3.428 -7.211 -1.291 1.00 0.00 H new ATOM 0 HD11 LEU A 122 3.670 -9.684 -1.712 1.00 0.00 H new ATOM 0 HD12 LEU A 122 3.043 -9.365 -0.077 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.937 -9.896 -1.367 1.00 0.00 H new ATOM 0 HD21 LEU A 122 3.194 -8.147 -3.570 1.00 0.00 H new ATOM 0 HD22 LEU A 122 1.448 -8.358 -3.299 1.00 0.00 H new ATOM 0 HD23 LEU A 122 2.153 -6.724 -3.331 1.00 0.00 H new ATOM 1389 N CYS A 123 2.698 -5.143 1.064 1.00 0.00 N ATOM 1390 CA CYS A 123 3.816 -4.488 1.751 1.00 0.00 C ATOM 1391 C CYS A 123 4.857 -5.523 2.230 1.00 0.00 C ATOM 1392 O CYS A 123 4.500 -6.671 2.508 1.00 0.00 O ATOM 1393 CB CYS A 123 3.198 -3.696 2.908 1.00 0.00 C ATOM 1394 SG CYS A 123 4.281 -2.535 3.767 1.00 0.00 S ATOM 0 H CYS A 123 2.146 -5.729 1.690 1.00 0.00 H new ATOM 0 HA CYS A 123 4.363 -3.820 1.086 1.00 0.00 H new ATOM 0 HB2 CYS A 123 2.343 -3.141 2.522 1.00 0.00 H new ATOM 0 HB3 CYS A 123 2.813 -4.407 3.639 1.00 0.00 H new ATOM 1399 N GLY A 124 6.137 -5.144 2.333 1.00 0.00 N ATOM 1400 CA GLY A 124 7.229 -6.033 2.767 1.00 0.00 C ATOM 1401 C GLY A 124 8.394 -5.297 3.428 1.00 0.00 C ATOM 1402 O GLY A 124 8.832 -4.268 2.919 1.00 0.00 O ATOM 0 H GLY A 124 6.451 -4.198 2.115 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.831 -6.768 3.467 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.602 -6.584 1.904 1.00 0.00 H new ATOM 1406 N ALA A 125 8.930 -5.821 4.532 1.00 0.00 N ATOM 1407 CA ALA A 125 10.041 -5.213 5.279 1.00 0.00 C ATOM 1408 C ALA A 125 11.339 -6.030 5.179 1.00 0.00 C ATOM 1409 O ALA A 125 11.303 -7.249 5.037 1.00 0.00 O ATOM 1410 CB ALA A 125 9.626 -5.061 6.748 1.00 0.00 C ATOM 0 H ALA A 125 8.601 -6.695 4.942 1.00 0.00 H new ATOM 0 HA ALA A 125 10.250 -4.239 4.836 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.443 -4.611 7.312 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.745 -4.423 6.813 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.395 -6.042 7.164 1.00 0.00 H new ATOM 1416 N ILE A 126 12.490 -5.372 5.328 1.00 0.00 N ATOM 1417 CA ILE A 126 13.811 -6.013 5.464 1.00 0.00 C ATOM 1418 C ILE A 126 14.670 -5.259 6.490 1.00 0.00 C ATOM 1419 O ILE A 126 14.731 -4.028 6.480 1.00 0.00 O ATOM 1420 CB ILE A 126 14.485 -6.170 4.078 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.752 -7.041 4.191 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.809 -4.823 3.413 1.00 0.00 C ATOM 1423 CD1 ILE A 126 16.339 -7.478 2.842 1.00 0.00 C ATOM 0 H ILE A 126 12.537 -4.354 5.359 1.00 0.00 H new ATOM 0 HA ILE A 126 13.690 -7.023 5.855 1.00 0.00 H new ATOM 0 HB ILE A 126 13.763 -6.669 3.431 1.00 0.00 H new ATOM 0 HG12 ILE A 126 16.512 -6.487 4.742 1.00 0.00 H new ATOM 0 HG13 ILE A 126 15.517 -7.930 4.777 1.00 0.00 H new ATOM 0 HG21 ILE A 126 15.279 -4.999 2.446 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.889 -4.256 3.271 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.489 -4.257 4.050 1.00 0.00 H new ATOM 0 HD11 ILE A 126 17.227 -8.086 3.012 1.00 0.00 H new ATOM 0 HD12 ILE A 126 15.599 -8.062 2.295 1.00 0.00 H new ATOM 0 HD13 ILE A 126 16.609 -6.597 2.260 1.00 0.00 H new ATOM 1435 N SER A 127 15.294 -5.994 7.409 1.00 0.00 N ATOM 1436 CA SER A 127 16.078 -5.449 8.532 1.00 0.00 C ATOM 1437 C SER A 127 17.346 -4.684 8.095 1.00 0.00 C ATOM 1438 O SER A 127 17.856 -4.851 6.984 1.00 0.00 O ATOM 1439 CB SER A 127 16.432 -6.593 9.497 1.00 0.00 C ATOM 1440 OG SER A 127 17.091 -6.123 10.662 1.00 0.00 O ATOM 0 H SER A 127 15.272 -7.014 7.399 1.00 0.00 H new ATOM 0 HA SER A 127 15.455 -4.708 9.033 1.00 0.00 H new ATOM 0 HB2 SER A 127 15.522 -7.120 9.783 1.00 0.00 H new ATOM 0 HB3 SER A 127 17.070 -7.314 8.986 1.00 0.00 H new ATOM 0 HG SER A 127 17.297 -6.880 11.249 1.00 0.00 H new ATOM 1446 N LEU A 128 17.883 -3.856 9.002 1.00 0.00 N ATOM 1447 CA LEU A 128 19.123 -3.086 8.825 1.00 0.00 C ATOM 1448 C LEU A 128 20.403 -3.937 8.674 1.00 0.00 C ATOM 1449 O LEU A 128 21.448 -3.404 8.291 1.00 0.00 O ATOM 1450 CB LEU A 128 19.219 -2.032 9.947 1.00 0.00 C ATOM 1451 CG LEU A 128 19.185 -2.520 11.415 1.00 0.00 C ATOM 1452 CD1 LEU A 128 20.436 -3.294 11.855 1.00 0.00 C ATOM 1453 CD2 LEU A 128 19.036 -1.283 12.307 1.00 0.00 C ATOM 0 H LEU A 128 17.450 -3.698 9.912 1.00 0.00 H new ATOM 0 HA LEU A 128 19.062 -2.583 7.860 1.00 0.00 H new ATOM 0 HB2 LEU A 128 20.145 -1.476 9.803 1.00 0.00 H new ATOM 0 HB3 LEU A 128 18.399 -1.327 9.812 1.00 0.00 H new ATOM 0 HG LEU A 128 18.352 -3.217 11.505 1.00 0.00 H new ATOM 0 HD11 LEU A 128 20.328 -3.598 12.896 1.00 0.00 H new ATOM 0 HD12 LEU A 128 20.556 -4.178 11.229 1.00 0.00 H new ATOM 0 HD13 LEU A 128 21.314 -2.656 11.753 1.00 0.00 H new ATOM 0 HD21 LEU A 128 19.008 -1.590 13.353 1.00 0.00 H new ATOM 0 HD22 LEU A 128 19.882 -0.615 12.147 1.00 0.00 H new ATOM 0 HD23 LEU A 128 18.111 -0.763 12.057 1.00 0.00 H new ATOM 1465 N ALA A 129 20.349 -5.242 8.965 1.00 0.00 N ATOM 1466 CA ALA A 129 21.494 -6.154 8.895 1.00 0.00 C ATOM 1467 C ALA A 129 21.814 -6.590 7.442 1.00 0.00 C ATOM 1468 O ALA A 129 20.879 -6.891 6.692 1.00 0.00 O ATOM 1469 CB ALA A 129 21.193 -7.367 9.787 1.00 0.00 C ATOM 0 H ALA A 129 19.489 -5.702 9.262 1.00 0.00 H new ATOM 0 HA ALA A 129 22.384 -5.636 9.251 1.00 0.00 H new ATOM 0 HB1 ALA A 129 22.032 -8.062 9.752 1.00 0.00 H new ATOM 0 HB2 ALA A 129 21.040 -7.035 10.814 1.00 0.00 H new ATOM 0 HB3 ALA A 129 20.293 -7.867 9.430 1.00 0.00 H new ATOM 1475 N PRO A 130 23.100 -6.713 7.043 1.00 0.00 N ATOM 1476 CA PRO A 130 23.493 -7.257 5.736 1.00 0.00 C ATOM 1477 C PRO A 130 22.959 -8.671 5.452 1.00 0.00 C ATOM 1478 O PRO A 130 22.729 -9.024 4.296 1.00 0.00 O ATOM 1479 CB PRO A 130 25.027 -7.258 5.736 1.00 0.00 C ATOM 1480 CG PRO A 130 25.389 -6.154 6.724 1.00 0.00 C ATOM 1481 CD PRO A 130 24.279 -6.259 7.768 1.00 0.00 C ATOM 0 HA PRO A 130 23.062 -6.641 4.947 1.00 0.00 H new ATOM 0 HB2 PRO A 130 25.427 -8.222 6.049 1.00 0.00 H new ATOM 0 HB3 PRO A 130 25.428 -7.054 4.743 1.00 0.00 H new ATOM 0 HG2 PRO A 130 26.374 -6.311 7.163 1.00 0.00 H new ATOM 0 HG3 PRO A 130 25.405 -5.174 6.248 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.548 -6.961 8.557 1.00 0.00 H new ATOM 0 HD3 PRO A 130 24.098 -5.296 8.246 1.00 0.00 H new ATOM 1489 N LYS A 131 22.744 -9.478 6.499 1.00 0.00 N ATOM 1490 CA LYS A 131 22.258 -10.866 6.417 1.00 0.00 C ATOM 1491 C LYS A 131 20.718 -10.984 6.265 1.00 0.00 C ATOM 1492 O LYS A 131 20.183 -12.093 6.184 1.00 0.00 O ATOM 1493 CB LYS A 131 22.808 -11.597 7.663 1.00 0.00 C ATOM 1494 CG LYS A 131 22.814 -13.131 7.544 1.00 0.00 C ATOM 1495 CD LYS A 131 23.521 -13.770 8.747 1.00 0.00 C ATOM 1496 CE LYS A 131 23.509 -15.298 8.613 1.00 0.00 C ATOM 1497 NZ LYS A 131 24.188 -15.958 9.759 1.00 0.00 N1+ ATOM 0 H LYS A 131 22.908 -9.175 7.459 1.00 0.00 H new ATOM 0 HA LYS A 131 22.624 -11.336 5.504 1.00 0.00 H new ATOM 0 HB2 LYS A 131 23.826 -11.255 7.851 1.00 0.00 H new ATOM 0 HB3 LYS A 131 22.211 -11.314 8.530 1.00 0.00 H new ATOM 0 HG2 LYS A 131 21.790 -13.499 7.481 1.00 0.00 H new ATOM 0 HG3 LYS A 131 23.316 -13.427 6.623 1.00 0.00 H new ATOM 0 HD2 LYS A 131 24.548 -13.410 8.809 1.00 0.00 H new ATOM 0 HD3 LYS A 131 23.024 -13.474 9.671 1.00 0.00 H new ATOM 0 HE2 LYS A 131 22.479 -15.649 8.549 1.00 0.00 H new ATOM 0 HE3 LYS A 131 24.002 -15.585 7.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 24.159 -16.990 9.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 25.178 -15.642 9.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 23.703 -15.704 10.643 1.00 0.00 H new ATOM 1511 N ALA A 132 19.988 -9.862 6.254 1.00 0.00 N ATOM 1512 CA ALA A 132 18.520 -9.817 6.234 1.00 0.00 C ATOM 1513 C ALA A 132 17.881 -10.393 4.949 1.00 0.00 C ATOM 1514 O ALA A 132 18.533 -10.552 3.913 1.00 0.00 O ATOM 1515 CB ALA A 132 18.083 -8.365 6.479 1.00 0.00 C ATOM 0 H ALA A 132 20.413 -8.935 6.259 1.00 0.00 H new ATOM 0 HA ALA A 132 18.156 -10.471 7.027 1.00 0.00 H new ATOM 0 HB1 ALA A 132 16.995 -8.306 6.469 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.455 -8.031 7.448 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.489 -7.726 5.695 1.00 0.00 H new ATOM 1521 N GLN A 133 16.575 -10.663 5.020 1.00 0.00 N ATOM 1522 CA GLN A 133 15.726 -11.143 3.928 1.00 0.00 C ATOM 1523 C GLN A 133 14.321 -10.527 4.083 1.00 0.00 C ATOM 1524 O GLN A 133 13.927 -10.137 5.185 1.00 0.00 O ATOM 1525 CB GLN A 133 15.712 -12.687 3.958 1.00 0.00 C ATOM 1526 CG GLN A 133 14.884 -13.369 2.854 1.00 0.00 C ATOM 1527 CD GLN A 133 15.309 -12.950 1.445 1.00 0.00 C ATOM 1528 OE1 GLN A 133 14.839 -11.955 0.905 1.00 0.00 O ATOM 1529 NE2 GLN A 133 16.228 -13.651 0.812 1.00 0.00 N ATOM 0 H GLN A 133 16.054 -10.546 5.889 1.00 0.00 H new ATOM 0 HA GLN A 133 16.109 -10.837 2.954 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.740 -13.043 3.888 1.00 0.00 H new ATOM 0 HB3 GLN A 133 15.329 -13.010 4.926 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.980 -14.450 2.950 1.00 0.00 H new ATOM 0 HG3 GLN A 133 13.830 -13.129 2.997 1.00 0.00 H new ATOM 0 HE21 GLN A 133 16.628 -14.481 1.250 1.00 0.00 H new ATOM 0 HE22 GLN A 133 16.540 -13.363 -0.116 1.00 0.00 H new ATOM 1538 N ILE A 134 13.570 -10.401 2.984 1.00 0.00 N ATOM 1539 CA ILE A 134 12.267 -9.715 2.961 1.00 0.00 C ATOM 1540 C ILE A 134 11.181 -10.553 3.658 1.00 0.00 C ATOM 1541 O ILE A 134 10.871 -11.673 3.243 1.00 0.00 O ATOM 1542 CB ILE A 134 11.849 -9.325 1.518 1.00 0.00 C ATOM 1543 CG1 ILE A 134 12.956 -8.511 0.802 1.00 0.00 C ATOM 1544 CG2 ILE A 134 10.530 -8.521 1.554 1.00 0.00 C ATOM 1545 CD1 ILE A 134 12.664 -8.200 -0.671 1.00 0.00 C ATOM 0 H ILE A 134 13.849 -10.774 2.076 1.00 0.00 H new ATOM 0 HA ILE A 134 12.377 -8.788 3.524 1.00 0.00 H new ATOM 0 HB ILE A 134 11.699 -10.243 0.951 1.00 0.00 H new ATOM 0 HG12 ILE A 134 13.102 -7.572 1.336 1.00 0.00 H new ATOM 0 HG13 ILE A 134 13.894 -9.063 0.865 1.00 0.00 H new ATOM 0 HG21 ILE A 134 10.241 -8.250 0.538 1.00 0.00 H new ATOM 0 HG22 ILE A 134 9.745 -9.129 2.004 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.672 -7.616 2.145 1.00 0.00 H new ATOM 0 HD11 ILE A 134 13.490 -7.628 -1.093 1.00 0.00 H new ATOM 0 HD12 ILE A 134 12.549 -9.132 -1.224 1.00 0.00 H new ATOM 0 HD13 ILE A 134 11.745 -7.618 -0.745 1.00 0.00 H new ATOM 1557 N LYS A 135 10.563 -9.977 4.690 1.00 0.00 N ATOM 1558 CA LYS A 135 9.359 -10.474 5.362 1.00 0.00 C ATOM 1559 C LYS A 135 8.118 -9.826 4.711 1.00 0.00 C ATOM 1560 O LYS A 135 8.026 -8.598 4.652 1.00 0.00 O ATOM 1561 CB LYS A 135 9.484 -10.132 6.861 1.00 0.00 C ATOM 1562 CG LYS A 135 8.355 -10.725 7.722 1.00 0.00 C ATOM 1563 CD LYS A 135 8.388 -10.209 9.171 1.00 0.00 C ATOM 1564 CE LYS A 135 9.619 -10.693 9.952 1.00 0.00 C ATOM 1565 NZ LYS A 135 9.680 -10.094 11.311 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.905 -9.108 5.101 1.00 0.00 H new ATOM 0 HA LYS A 135 9.250 -11.554 5.261 1.00 0.00 H new ATOM 0 HB2 LYS A 135 10.442 -10.498 7.230 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.489 -9.048 6.979 1.00 0.00 H new ATOM 0 HG2 LYS A 135 7.393 -10.479 7.274 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.437 -11.812 7.725 1.00 0.00 H new ATOM 0 HD2 LYS A 135 8.375 -9.119 9.163 1.00 0.00 H new ATOM 0 HD3 LYS A 135 7.485 -10.535 9.688 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.593 -11.780 10.034 1.00 0.00 H new ATOM 0 HE3 LYS A 135 10.524 -10.436 9.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 10.524 -10.444 11.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 9.730 -9.058 11.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 8.829 -10.360 11.846 1.00 0.00 H new ATOM 1579 N GLU A 136 7.173 -10.626 4.215 1.00 0.00 N ATOM 1580 CA GLU A 136 5.953 -10.139 3.551 1.00 0.00 C ATOM 1581 C GLU A 136 4.821 -9.866 4.556 1.00 0.00 C ATOM 1582 O GLU A 136 4.652 -10.586 5.542 1.00 0.00 O ATOM 1583 CB GLU A 136 5.479 -11.156 2.498 1.00 0.00 C ATOM 1584 CG GLU A 136 6.367 -11.157 1.247 1.00 0.00 C ATOM 1585 CD GLU A 136 6.059 -12.370 0.356 1.00 0.00 C ATOM 1586 OE1 GLU A 136 6.655 -13.452 0.577 1.00 0.00 O1- ATOM 1587 OE2 GLU A 136 5.226 -12.254 -0.573 1.00 0.00 O ATOM 0 H GLU A 136 7.230 -11.643 4.261 1.00 0.00 H new ATOM 0 HA GLU A 136 6.202 -9.196 3.064 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.473 -12.154 2.937 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.452 -10.927 2.212 1.00 0.00 H new ATOM 0 HG2 GLU A 136 6.209 -10.237 0.683 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.416 -11.174 1.541 1.00 0.00 H new ATOM 1594 N SER A 137 4.017 -8.840 4.280 1.00 0.00 N ATOM 1595 CA SER A 137 2.765 -8.536 4.985 1.00 0.00 C ATOM 1596 C SER A 137 1.541 -9.176 4.293 1.00 0.00 C ATOM 1597 O SER A 137 1.663 -10.048 3.423 1.00 0.00 O ATOM 1598 CB SER A 137 2.612 -7.009 5.082 1.00 0.00 C ATOM 1599 OG SER A 137 1.695 -6.652 6.102 1.00 0.00 O ATOM 0 H SER A 137 4.223 -8.174 3.536 1.00 0.00 H new ATOM 0 HA SER A 137 2.810 -8.966 5.986 1.00 0.00 H new ATOM 0 HB2 SER A 137 3.582 -6.555 5.286 1.00 0.00 H new ATOM 0 HB3 SER A 137 2.269 -6.613 4.126 1.00 0.00 H new ATOM 0 HG SER A 137 1.945 -5.781 6.476 1.00 0.00 H new ATOM 1605 N LEU A 138 0.342 -8.723 4.668 1.00 0.00 N ATOM 1606 CA LEU A 138 -0.920 -9.036 3.999 1.00 0.00 C ATOM 1607 C LEU A 138 -0.984 -8.392 2.599 1.00 0.00 C ATOM 1608 O LEU A 138 -0.299 -7.402 2.325 1.00 0.00 O ATOM 1609 CB LEU A 138 -2.084 -8.551 4.887 1.00 0.00 C ATOM 1610 CG LEU A 138 -2.139 -9.149 6.310 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -3.317 -8.526 7.069 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -2.282 -10.678 6.298 1.00 0.00 C ATOM 0 H LEU A 138 0.221 -8.108 5.473 1.00 0.00 H new ATOM 0 HA LEU A 138 -0.996 -10.114 3.856 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -2.024 -7.466 4.971 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -3.022 -8.780 4.381 1.00 0.00 H new ATOM 0 HG LEU A 138 -1.196 -8.918 6.806 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.363 -8.943 8.075 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.181 -7.446 7.130 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.246 -8.745 6.543 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -2.316 -11.048 7.323 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -3.202 -10.953 5.782 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -1.430 -11.119 5.781 1.00 0.00 H new ATOM 1624 N ARG A 139 -1.849 -8.935 1.732 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.211 -8.351 0.432 1.00 0.00 C ATOM 1626 C ARG A 139 -3.642 -7.795 0.452 1.00 0.00 C ATOM 1627 O ARG A 139 -4.519 -8.361 1.112 1.00 0.00 O ATOM 1628 CB ARG A 139 -1.974 -9.358 -0.716 1.00 0.00 C ATOM 1629 CG ARG A 139 -3.108 -10.352 -1.027 1.00 0.00 C ATOM 1630 CD ARG A 139 -3.441 -11.325 0.114 1.00 0.00 C ATOM 1631 NE ARG A 139 -4.631 -12.134 -0.205 1.00 0.00 N ATOM 1632 CZ ARG A 139 -5.901 -11.798 0.005 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -6.254 -10.640 0.528 1.00 0.00 N1+ ATOM 1634 NH2 ARG A 139 -6.854 -12.645 -0.319 1.00 0.00 N ATOM 0 H ARG A 139 -2.329 -9.815 1.919 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.553 -7.503 0.241 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -1.763 -8.792 -1.623 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -1.077 -9.932 -0.482 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -4.007 -9.789 -1.280 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -2.834 -10.929 -1.910 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -2.590 -11.981 0.296 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -3.614 -10.766 1.033 1.00 0.00 H new ATOM 0 HE ARG A 139 -4.464 -13.046 -0.631 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -5.540 -9.960 0.789 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -7.241 -10.425 0.671 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -6.616 -13.549 -0.727 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -7.831 -12.398 -0.162 1.00 0.00 H new ATOM 1648 N ALA A 140 -3.891 -6.726 -0.298 1.00 0.00 N ATOM 1649 CA ALA A 140 -5.173 -6.021 -0.379 1.00 0.00 C ATOM 1650 C ALA A 140 -5.435 -5.500 -1.798 1.00 0.00 C ATOM 1651 O ALA A 140 -4.483 -5.277 -2.544 1.00 0.00 O ATOM 1652 CB ALA A 140 -5.133 -4.852 0.608 1.00 0.00 C ATOM 0 H ALA A 140 -3.176 -6.307 -0.893 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.981 -6.709 -0.130 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -6.077 -4.309 0.568 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.976 -5.233 1.617 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -4.317 -4.180 0.343 1.00 0.00 H new ATOM 1658 N GLU A 141 -6.699 -5.286 -2.176 1.00 0.00 N ATOM 1659 CA GLU A 141 -7.048 -4.760 -3.502 1.00 0.00 C ATOM 1660 C GLU A 141 -7.427 -3.272 -3.488 1.00 0.00 C ATOM 1661 O GLU A 141 -8.116 -2.783 -2.588 1.00 0.00 O ATOM 1662 CB GLU A 141 -8.117 -5.618 -4.202 1.00 0.00 C ATOM 1663 CG GLU A 141 -9.500 -5.591 -3.544 1.00 0.00 C ATOM 1664 CD GLU A 141 -10.532 -6.338 -4.399 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -10.644 -7.581 -4.278 1.00 0.00 O1- ATOM 1666 OE2 GLU A 141 -11.253 -5.680 -5.186 1.00 0.00 O ATOM 0 H GLU A 141 -7.504 -5.470 -1.578 1.00 0.00 H new ATOM 0 HA GLU A 141 -6.136 -4.829 -4.095 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -8.215 -5.280 -5.233 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -7.768 -6.650 -4.237 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -9.445 -6.046 -2.555 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -9.819 -4.558 -3.403 1.00 0.00 H new ATOM 1673 N LEU A 142 -6.987 -2.569 -4.534 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.375 -1.211 -4.901 1.00 0.00 C ATOM 1675 C LEU A 142 -8.424 -1.285 -6.014 1.00 0.00 C ATOM 1676 O LEU A 142 -8.216 -1.967 -7.022 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.123 -0.456 -5.389 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.381 0.969 -5.923 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -7.028 1.880 -4.872 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.052 1.577 -6.382 1.00 0.00 C ATOM 0 H LEU A 142 -6.308 -2.960 -5.186 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.799 -0.683 -4.047 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.411 -0.395 -4.566 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.649 -1.042 -6.177 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.079 0.892 -6.756 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.188 2.870 -5.298 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.985 1.458 -4.564 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.371 1.960 -4.006 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.224 2.584 -6.761 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.361 1.619 -5.540 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.623 0.960 -7.172 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.514 -0.539 -5.846 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.639 -0.453 -6.773 1.00 0.00 C ATOM 1694 C ARG A 143 -10.916 1.021 -7.105 1.00 0.00 C ATOM 1695 O ARG A 143 -11.350 1.789 -6.243 1.00 0.00 O ATOM 1696 CB ARG A 143 -11.833 -1.163 -6.107 1.00 0.00 C ATOM 1697 CG ARG A 143 -12.988 -1.426 -7.083 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.140 -2.209 -6.439 1.00 0.00 C ATOM 1699 NE ARG A 143 -13.741 -3.578 -6.056 1.00 0.00 N ATOM 1700 CZ ARG A 143 -14.549 -4.576 -5.722 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -15.859 -4.446 -5.693 1.00 0.00 N1+ ATOM 1702 NH2 ARG A 143 -14.025 -5.737 -5.405 1.00 0.00 N ATOM 0 H ARG A 143 -9.642 0.049 -5.022 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.432 -0.944 -7.724 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.497 -2.110 -5.685 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.195 -0.555 -5.278 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.365 -0.475 -7.458 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -12.613 -1.981 -7.943 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.491 -1.675 -5.556 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.977 -2.258 -7.135 1.00 0.00 H new ATOM 0 HE ARG A 143 -12.741 -3.777 -6.047 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.288 -3.552 -5.933 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -16.444 -5.239 -5.431 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -13.013 -5.860 -5.418 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -14.630 -6.516 -5.146 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.643 1.427 -8.343 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.894 2.786 -8.849 1.00 0.00 C ATOM 1718 C VAL A 144 -12.175 2.772 -9.691 1.00 0.00 C ATOM 1719 O VAL A 144 -12.233 2.101 -10.725 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.698 3.329 -9.663 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -9.953 4.783 -10.083 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.382 3.266 -8.870 1.00 0.00 C ATOM 0 H VAL A 144 -10.231 0.810 -9.043 1.00 0.00 H new ATOM 0 HA VAL A 144 -11.020 3.459 -8.001 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.601 2.694 -10.543 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -9.102 5.151 -10.655 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.852 4.832 -10.698 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -10.087 5.400 -9.195 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.569 3.658 -9.482 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.475 3.864 -7.963 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -8.168 2.231 -8.602 1.00 0.00 H new ATOM 1732 N THR A 145 -13.200 3.504 -9.246 1.00 0.00 N ATOM 1733 CA THR A 145 -14.522 3.606 -9.885 1.00 0.00 C ATOM 1734 C THR A 145 -14.612 4.870 -10.738 1.00 0.00 C ATOM 1735 O THR A 145 -13.990 5.881 -10.416 1.00 0.00 O ATOM 1736 CB THR A 145 -15.635 3.569 -8.825 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.472 4.630 -7.911 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.622 2.251 -8.044 1.00 0.00 C ATOM 0 H THR A 145 -13.132 4.065 -8.397 1.00 0.00 H new ATOM 0 HA THR A 145 -14.657 2.749 -10.545 1.00 0.00 H new ATOM 0 HB THR A 145 -16.585 3.663 -9.350 1.00 0.00 H new ATOM 0 HG1 THR A 145 -16.187 4.598 -7.241 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.422 2.259 -7.303 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.773 1.419 -8.732 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.662 2.136 -7.540 1.00 0.00 H new ATOM 1746 N GLU A 146 -15.370 4.825 -11.835 1.00 0.00 N ATOM 1747 CA GLU A 146 -15.507 5.955 -12.769 1.00 0.00 C ATOM 1748 C GLU A 146 -16.072 7.203 -12.074 1.00 0.00 C ATOM 1749 O GLU A 146 -16.999 7.114 -11.262 1.00 0.00 O ATOM 1750 CB GLU A 146 -16.431 5.588 -13.943 1.00 0.00 C ATOM 1751 CG GLU A 146 -15.778 4.613 -14.924 1.00 0.00 C ATOM 1752 CD GLU A 146 -16.753 4.223 -16.044 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -16.795 4.918 -17.088 1.00 0.00 O1- ATOM 1754 OE2 GLU A 146 -17.481 3.214 -15.894 1.00 0.00 O ATOM 0 H GLU A 146 -15.910 4.003 -12.106 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.506 6.176 -13.139 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -17.348 5.146 -13.554 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -16.715 6.496 -14.474 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.886 5.068 -15.355 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.454 3.719 -14.392 1.00 0.00 H new ATOM 1761 N ARG A 147 -15.531 8.377 -12.422 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.924 9.661 -11.836 1.00 0.00 C ATOM 1763 C ARG A 147 -17.259 10.128 -12.425 1.00 0.00 C ATOM 1764 O ARG A 147 -17.334 10.550 -13.584 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.795 10.691 -12.018 1.00 0.00 C ATOM 1766 CG ARG A 147 -15.092 12.010 -11.288 1.00 0.00 C ATOM 1767 CD ARG A 147 -13.904 12.973 -11.387 1.00 0.00 C ATOM 1768 NE ARG A 147 -14.175 14.237 -10.677 1.00 0.00 N ATOM 1769 CZ ARG A 147 -14.829 15.295 -11.146 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -15.339 15.327 -12.361 1.00 0.00 N ATOM 1771 NH2 ARG A 147 -14.983 16.356 -10.382 1.00 0.00 N1+ ATOM 0 H ARG A 147 -14.799 8.461 -13.127 1.00 0.00 H new ATOM 0 HA ARG A 147 -16.079 9.545 -10.763 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.860 10.273 -11.644 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -14.654 10.889 -13.080 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -15.979 12.476 -11.718 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -15.314 11.808 -10.240 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -13.016 12.501 -10.967 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -13.689 13.182 -12.435 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.822 14.307 -9.722 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -15.238 14.521 -12.978 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -15.834 16.158 -12.684 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -14.601 16.363 -9.436 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -15.484 17.171 -10.736 1.00 0.00 H new