USER MOD reduce.3.24.130724 H: found=0, std=0, add=488, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 489 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 276 HIS : no HD1:sc= -0.993 K(o=-1,f=-2.1!) USER MOD Set 1.2: A 279 GLN : amide:sc= -0.014 K(o=-1,f=-3) USER MOD Set 2.1: A 238 GLN : amide:sc=-0.00483 K(o=-0.0051,f=-1.7) USER MOD Set 2.2: A 240 GLN : amide:sc=-0.000265 X(o=-0.0051,f=-0.0051) USER MOD Single : A 230 ASN :FLIP amide:sc= 0.649 F(o=-1,f=0.65) USER MOD Single : A 242 GLN : amide:sc= -3.38! C(o=-3.4!,f=-7!) USER MOD Single : A 243 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 244 MET CE :methyl 152:sc= -6.7! (180deg=-10.4!) USER MOD Single : A 246 GLN : amide:sc= -0.0195 K(o=-0.019,f=-1.5!) USER MOD Single : A 249 GLN : amide:sc= -3.32! C(o=-3.3!,f=-4.8!) USER MOD Single : A 250 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 251 ASN : amide:sc= -0.206 X(o=-0.21,f=-0.007) USER MOD Single : A 260 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 261 GLN : amide:sc= -0.0965 X(o=-0.096,f=0) USER MOD Single : A 264 GLN : amide:sc= -0.327 K(o=-0.33,f=-3!) USER MOD Single : A 266 ASN : amide:sc= -0.345 K(o=-0.35,f=-2.2!) USER MOD Single : A 268 GLN : amide:sc= -0.05 X(o=-0.05,f=0) USER MOD Single : A 271 GLN :FLIP amide:sc= -0.0281 F(o=-0.65,f=-0.028) USER MOD Single : A 272 GLN : amide:sc= -4.93! C(o=-4.9!,f=-5.1!) USER MOD Single : A 274 SER OG : rot 180:sc= 0 USER MOD Single : A 277 GLN : amide:sc= -0.0991 X(o=-0.099,f=-0.017) USER MOD Single : A 282 GLN : amide:sc= -0.0416 K(o=-0.042,f=-1.3!) USER MOD Single : A 283 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 285 ASN : amide:sc= -0.141 X(o=-0.14,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 230 -0.734 -6.587 -18.053 1.00 0.00 N ATOM 2 CA ASN A 230 -1.452 -6.236 -16.800 1.00 0.00 C ATOM 3 C ASN A 230 -1.542 -4.724 -16.622 1.00 0.00 C ATOM 4 O ASN A 230 -0.737 -3.973 -17.172 1.00 0.00 O ATOM 5 CB ASN A 230 -0.709 -6.864 -15.619 1.00 0.00 C ATOM 6 CG ASN A 230 -0.430 -8.339 -15.830 1.00 0.00 C ATOM 7 OD1 ASN A 230 -0.778 -9.155 -14.842 1.00 0.00 O flip ATOM 8 ND2 ASN A 230 0.092 -8.742 -16.871 1.00 0.00 N flip ATOM 0 HA ASN A 230 -2.470 -6.622 -16.851 1.00 0.00 H new ATOM 0 HB2 ASN A 230 0.233 -6.337 -15.464 1.00 0.00 H new ATOM 0 HB3 ASN A 230 -1.299 -6.735 -14.712 1.00 0.00 H new ATOM 0 HD21 ASN A 230 0.344 -8.080 -17.605 1.00 0.00 H new ATOM 0 HD22 ASN A 230 0.272 -9.738 -16.999 1.00 0.00 H new ATOM 15 N PRO A 231 -2.532 -4.259 -15.845 1.00 0.00 N ATOM 16 CA PRO A 231 -2.739 -2.834 -15.589 1.00 0.00 C ATOM 17 C PRO A 231 -1.813 -2.297 -14.502 1.00 0.00 C ATOM 18 O PRO A 231 -2.015 -1.195 -13.991 1.00 0.00 O ATOM 19 CB PRO A 231 -4.193 -2.784 -15.125 1.00 0.00 C ATOM 20 CG PRO A 231 -4.412 -4.094 -14.447 1.00 0.00 C ATOM 21 CD PRO A 231 -3.535 -5.095 -15.157 1.00 0.00 C ATOM 0 HA PRO A 231 -2.527 -2.220 -16.465 1.00 0.00 H new ATOM 0 HB2 PRO A 231 -4.364 -1.951 -14.444 1.00 0.00 H new ATOM 0 HB3 PRO A 231 -4.874 -2.653 -15.966 1.00 0.00 H new ATOM 0 HG2 PRO A 231 -4.153 -4.032 -13.390 1.00 0.00 H new ATOM 0 HG3 PRO A 231 -5.460 -4.389 -14.502 1.00 0.00 H new ATOM 0 HD2 PRO A 231 -3.067 -5.785 -14.455 1.00 0.00 H new ATOM 0 HD3 PRO A 231 -4.106 -5.697 -15.863 1.00 0.00 H new ATOM 29 N LEU A 232 -0.798 -3.080 -14.152 1.00 0.00 N ATOM 30 CA LEU A 232 0.156 -2.680 -13.125 1.00 0.00 C ATOM 31 C LEU A 232 1.443 -2.155 -13.753 1.00 0.00 C ATOM 32 O LEU A 232 2.117 -1.297 -13.181 1.00 0.00 O ATOM 33 CB LEU A 232 0.468 -3.859 -12.201 1.00 0.00 C ATOM 34 CG LEU A 232 -0.090 -3.736 -10.782 1.00 0.00 C ATOM 35 CD1 LEU A 232 0.590 -4.729 -9.853 1.00 0.00 C ATOM 36 CD2 LEU A 232 0.081 -2.315 -10.263 1.00 0.00 C ATOM 0 H LEU A 232 -0.615 -3.995 -14.564 1.00 0.00 H new ATOM 0 HA LEU A 232 -0.294 -1.879 -12.539 1.00 0.00 H new ATOM 0 HB2 LEU A 232 0.073 -4.769 -12.653 1.00 0.00 H new ATOM 0 HB3 LEU A 232 1.550 -3.977 -12.140 1.00 0.00 H new ATOM 0 HG LEU A 232 -1.155 -3.966 -10.810 1.00 0.00 H new ATOM 0 HD11 LEU A 232 0.180 -4.627 -8.848 1.00 0.00 H new ATOM 0 HD12 LEU A 232 0.417 -5.743 -10.214 1.00 0.00 H new ATOM 0 HD13 LEU A 232 1.662 -4.530 -9.830 1.00 0.00 H new ATOM 0 HD21 LEU A 232 -0.321 -2.246 -9.252 1.00 0.00 H new ATOM 0 HD22 LEU A 232 1.140 -2.057 -10.250 1.00 0.00 H new ATOM 0 HD23 LEU A 232 -0.453 -1.623 -10.914 1.00 0.00 H new ATOM 48 N GLU A 233 1.778 -2.673 -14.930 1.00 0.00 N ATOM 49 CA GLU A 233 2.985 -2.251 -15.631 1.00 0.00 C ATOM 50 C GLU A 233 3.225 -0.757 -15.438 1.00 0.00 C ATOM 51 O GLU A 233 4.265 -0.347 -14.921 1.00 0.00 O ATOM 52 CB GLU A 233 2.874 -2.574 -17.122 1.00 0.00 C ATOM 53 CG GLU A 233 2.572 -4.036 -17.406 1.00 0.00 C ATOM 54 CD GLU A 233 3.815 -4.832 -17.753 1.00 0.00 C ATOM 55 OE1 GLU A 233 4.733 -4.898 -16.908 1.00 0.00 O ATOM 56 OE2 GLU A 233 3.872 -5.389 -18.870 1.00 0.00 O ATOM 0 H GLU A 233 1.232 -3.384 -15.417 1.00 0.00 H new ATOM 0 HA GLU A 233 3.831 -2.796 -15.213 1.00 0.00 H new ATOM 0 HB2 GLU A 233 2.090 -1.957 -17.562 1.00 0.00 H new ATOM 0 HB3 GLU A 233 3.807 -2.302 -17.615 1.00 0.00 H new ATOM 0 HG2 GLU A 233 2.093 -4.480 -16.534 1.00 0.00 H new ATOM 0 HG3 GLU A 233 1.861 -4.103 -18.229 1.00 0.00 H new ATOM 63 N PHE A 234 2.254 0.050 -15.852 1.00 0.00 N ATOM 64 CA PHE A 234 2.359 1.497 -15.719 1.00 0.00 C ATOM 65 C PHE A 234 2.362 1.903 -14.247 1.00 0.00 C ATOM 66 O PHE A 234 3.136 2.764 -13.830 1.00 0.00 O ATOM 67 CB PHE A 234 1.208 2.184 -16.462 1.00 0.00 C ATOM 68 CG PHE A 234 0.002 2.439 -15.606 1.00 0.00 C ATOM 69 CD1 PHE A 234 -0.947 1.449 -15.412 1.00 0.00 C ATOM 70 CD2 PHE A 234 -0.177 3.666 -14.992 1.00 0.00 C ATOM 71 CE1 PHE A 234 -2.054 1.679 -14.620 1.00 0.00 C ATOM 72 CE2 PHE A 234 -1.283 3.903 -14.199 1.00 0.00 C ATOM 73 CZ PHE A 234 -2.221 2.908 -14.014 1.00 0.00 C ATOM 0 H PHE A 234 1.387 -0.273 -16.282 1.00 0.00 H new ATOM 0 HA PHE A 234 3.301 1.817 -16.164 1.00 0.00 H new ATOM 0 HB2 PHE A 234 1.563 3.132 -16.865 1.00 0.00 H new ATOM 0 HB3 PHE A 234 0.916 1.566 -17.311 1.00 0.00 H new ATOM 0 HD1 PHE A 234 -0.820 0.487 -15.885 1.00 0.00 H new ATOM 0 HD2 PHE A 234 0.556 4.447 -15.134 1.00 0.00 H new ATOM 0 HE1 PHE A 234 -2.787 0.900 -14.475 1.00 0.00 H new ATOM 0 HE2 PHE A 234 -1.413 4.865 -13.725 1.00 0.00 H new ATOM 0 HZ PHE A 234 -3.087 3.091 -13.395 1.00 0.00 H new ATOM 83 N LEU A 235 1.493 1.269 -13.466 1.00 0.00 N ATOM 84 CA LEU A 235 1.395 1.556 -12.039 1.00 0.00 C ATOM 85 C LEU A 235 2.727 1.288 -11.345 1.00 0.00 C ATOM 86 O LEU A 235 3.162 2.062 -10.493 1.00 0.00 O ATOM 87 CB LEU A 235 0.294 0.705 -11.403 1.00 0.00 C ATOM 88 CG LEU A 235 -0.508 1.397 -10.301 1.00 0.00 C ATOM 89 CD1 LEU A 235 0.390 1.742 -9.123 1.00 0.00 C ATOM 90 CD2 LEU A 235 -1.189 2.646 -10.840 1.00 0.00 C ATOM 0 H LEU A 235 0.846 0.553 -13.797 1.00 0.00 H new ATOM 0 HA LEU A 235 1.145 2.610 -11.917 1.00 0.00 H new ATOM 0 HB2 LEU A 235 -0.394 0.386 -12.186 1.00 0.00 H new ATOM 0 HB3 LEU A 235 0.747 -0.196 -10.990 1.00 0.00 H new ATOM 0 HG LEU A 235 -1.279 0.709 -9.954 1.00 0.00 H new ATOM 0 HD11 LEU A 235 -0.199 2.234 -8.349 1.00 0.00 H new ATOM 0 HD12 LEU A 235 0.829 0.829 -8.720 1.00 0.00 H new ATOM 0 HD13 LEU A 235 1.184 2.411 -9.455 1.00 0.00 H new ATOM 0 HD21 LEU A 235 -1.755 3.125 -10.041 1.00 0.00 H new ATOM 0 HD22 LEU A 235 -0.435 3.338 -11.216 1.00 0.00 H new ATOM 0 HD23 LEU A 235 -1.865 2.371 -11.650 1.00 0.00 H new ATOM 102 N ARG A 236 3.370 0.185 -11.718 1.00 0.00 N ATOM 103 CA ARG A 236 4.653 -0.186 -11.136 1.00 0.00 C ATOM 104 C ARG A 236 5.742 0.787 -11.572 1.00 0.00 C ATOM 105 O ARG A 236 6.693 1.044 -10.835 1.00 0.00 O ATOM 106 CB ARG A 236 5.032 -1.610 -11.544 1.00 0.00 C ATOM 107 CG ARG A 236 4.061 -2.665 -11.040 1.00 0.00 C ATOM 108 CD ARG A 236 3.878 -3.783 -12.054 1.00 0.00 C ATOM 109 NE ARG A 236 5.147 -4.198 -12.645 1.00 0.00 N ATOM 110 CZ ARG A 236 5.242 -4.863 -13.791 1.00 0.00 C ATOM 111 NH1 ARG A 236 4.146 -5.189 -14.464 1.00 0.00 N ATOM 112 NH2 ARG A 236 6.433 -5.202 -14.266 1.00 0.00 N ATOM 0 H ARG A 236 3.022 -0.467 -12.421 1.00 0.00 H new ATOM 0 HA ARG A 236 4.560 -0.142 -10.051 1.00 0.00 H new ATOM 0 HB2 ARG A 236 5.084 -1.666 -12.631 1.00 0.00 H new ATOM 0 HB3 ARG A 236 6.029 -1.835 -11.165 1.00 0.00 H new ATOM 0 HG2 ARG A 236 4.428 -3.080 -10.101 1.00 0.00 H new ATOM 0 HG3 ARG A 236 3.097 -2.202 -10.829 1.00 0.00 H new ATOM 0 HD2 ARG A 236 3.407 -4.638 -11.570 1.00 0.00 H new ATOM 0 HD3 ARG A 236 3.202 -3.451 -12.842 1.00 0.00 H new ATOM 0 HE ARG A 236 6.008 -3.964 -12.151 1.00 0.00 H new ATOM 0 HH11 ARG A 236 3.229 -4.929 -14.102 1.00 0.00 H new ATOM 0 HH12 ARG A 236 4.221 -5.700 -15.344 1.00 0.00 H new ATOM 0 HH21 ARG A 236 7.277 -4.952 -13.751 1.00 0.00 H new ATOM 0 HH22 ARG A 236 6.505 -5.713 -15.146 1.00 0.00 H new ATOM 126 N ASP A 237 5.593 1.325 -12.778 1.00 0.00 N ATOM 127 CA ASP A 237 6.562 2.272 -13.316 1.00 0.00 C ATOM 128 C ASP A 237 6.447 3.622 -12.615 1.00 0.00 C ATOM 129 O ASP A 237 7.449 4.291 -12.365 1.00 0.00 O ATOM 130 CB ASP A 237 6.353 2.447 -14.821 1.00 0.00 C ATOM 131 CG ASP A 237 7.625 2.857 -15.537 1.00 0.00 C ATOM 132 OD1 ASP A 237 8.021 4.035 -15.418 1.00 0.00 O ATOM 133 OD2 ASP A 237 8.225 2.000 -16.218 1.00 0.00 O ATOM 0 H ASP A 237 4.811 1.121 -13.401 1.00 0.00 H new ATOM 0 HA ASP A 237 7.561 1.873 -13.139 1.00 0.00 H new ATOM 0 HB2 ASP A 237 5.986 1.513 -15.245 1.00 0.00 H new ATOM 0 HB3 ASP A 237 5.584 3.200 -14.993 1.00 0.00 H new ATOM 138 N GLN A 238 5.217 4.014 -12.301 1.00 0.00 N ATOM 139 CA GLN A 238 4.966 5.283 -11.627 1.00 0.00 C ATOM 140 C GLN A 238 5.269 5.177 -10.136 1.00 0.00 C ATOM 141 O GLN A 238 5.399 4.080 -9.596 1.00 0.00 O ATOM 142 CB GLN A 238 3.514 5.715 -11.834 1.00 0.00 C ATOM 143 CG GLN A 238 3.289 6.501 -13.115 1.00 0.00 C ATOM 144 CD GLN A 238 1.889 7.076 -13.208 1.00 0.00 C ATOM 145 OE1 GLN A 238 1.161 7.133 -12.217 1.00 0.00 O ATOM 146 NE2 GLN A 238 1.503 7.505 -14.404 1.00 0.00 N ATOM 0 H GLN A 238 4.378 3.471 -12.503 1.00 0.00 H new ATOM 0 HA GLN A 238 5.627 6.033 -12.061 1.00 0.00 H new ATOM 0 HB2 GLN A 238 2.878 4.830 -11.845 1.00 0.00 H new ATOM 0 HB3 GLN A 238 3.200 6.322 -10.985 1.00 0.00 H new ATOM 0 HG2 GLN A 238 4.015 7.312 -13.172 1.00 0.00 H new ATOM 0 HG3 GLN A 238 3.469 5.852 -13.972 1.00 0.00 H new ATOM 0 HE21 GLN A 238 2.139 7.439 -15.199 1.00 0.00 H new ATOM 0 HE22 GLN A 238 0.571 7.901 -14.528 1.00 0.00 H new ATOM 155 N PRO A 239 5.382 6.325 -9.453 1.00 0.00 N ATOM 156 CA PRO A 239 5.669 6.369 -8.017 1.00 0.00 C ATOM 157 C PRO A 239 4.447 6.037 -7.168 1.00 0.00 C ATOM 158 O PRO A 239 4.481 6.147 -5.943 1.00 0.00 O ATOM 159 CB PRO A 239 6.094 7.819 -7.795 1.00 0.00 C ATOM 160 CG PRO A 239 5.350 8.586 -8.834 1.00 0.00 C ATOM 161 CD PRO A 239 5.239 7.675 -10.029 1.00 0.00 C ATOM 0 HA PRO A 239 6.421 5.635 -7.726 1.00 0.00 H new ATOM 0 HB2 PRO A 239 5.839 8.159 -6.791 1.00 0.00 H new ATOM 0 HB3 PRO A 239 7.171 7.939 -7.908 1.00 0.00 H new ATOM 0 HG2 PRO A 239 4.363 8.876 -8.472 1.00 0.00 H new ATOM 0 HG3 PRO A 239 5.877 9.504 -9.092 1.00 0.00 H new ATOM 0 HD2 PRO A 239 4.282 7.795 -10.536 1.00 0.00 H new ATOM 0 HD3 PRO A 239 6.017 7.881 -10.764 1.00 0.00 H new ATOM 169 N GLN A 240 3.366 5.630 -7.826 1.00 0.00 N ATOM 170 CA GLN A 240 2.133 5.284 -7.129 1.00 0.00 C ATOM 171 C GLN A 240 2.428 4.472 -5.873 1.00 0.00 C ATOM 172 O GLN A 240 1.764 4.632 -4.849 1.00 0.00 O ATOM 173 CB GLN A 240 1.205 4.495 -8.057 1.00 0.00 C ATOM 174 CG GLN A 240 0.900 5.210 -9.363 1.00 0.00 C ATOM 175 CD GLN A 240 0.069 6.463 -9.162 1.00 0.00 C ATOM 176 OE1 GLN A 240 -1.137 6.390 -8.928 1.00 0.00 O ATOM 177 NE2 GLN A 240 0.713 7.621 -9.255 1.00 0.00 N ATOM 0 H GLN A 240 3.319 5.532 -8.840 1.00 0.00 H new ATOM 0 HA GLN A 240 1.639 6.209 -6.832 1.00 0.00 H new ATOM 0 HB2 GLN A 240 1.661 3.530 -8.279 1.00 0.00 H new ATOM 0 HB3 GLN A 240 0.269 4.293 -7.536 1.00 0.00 H new ATOM 0 HG2 GLN A 240 1.836 5.474 -9.855 1.00 0.00 H new ATOM 0 HG3 GLN A 240 0.370 4.530 -10.030 1.00 0.00 H new ATOM 0 HE21 GLN A 240 1.714 7.634 -9.451 1.00 0.00 H new ATOM 0 HE22 GLN A 240 0.207 8.498 -9.131 1.00 0.00 H new ATOM 186 N PHE A 241 3.431 3.602 -5.956 1.00 0.00 N ATOM 187 CA PHE A 241 3.812 2.770 -4.821 1.00 0.00 C ATOM 188 C PHE A 241 4.514 3.600 -3.751 1.00 0.00 C ATOM 189 O PHE A 241 4.235 3.461 -2.560 1.00 0.00 O ATOM 190 CB PHE A 241 4.721 1.631 -5.276 1.00 0.00 C ATOM 191 CG PHE A 241 5.884 2.099 -6.092 1.00 0.00 C ATOM 192 CD1 PHE A 241 7.028 2.579 -5.476 1.00 0.00 C ATOM 193 CD2 PHE A 241 5.832 2.068 -7.474 1.00 0.00 C ATOM 194 CE1 PHE A 241 8.099 3.019 -6.224 1.00 0.00 C ATOM 195 CE2 PHE A 241 6.900 2.508 -8.228 1.00 0.00 C ATOM 196 CZ PHE A 241 8.034 2.984 -7.601 1.00 0.00 C ATOM 0 H PHE A 241 3.992 3.456 -6.795 1.00 0.00 H new ATOM 0 HA PHE A 241 2.903 2.348 -4.392 1.00 0.00 H new ATOM 0 HB2 PHE A 241 5.090 1.097 -4.400 1.00 0.00 H new ATOM 0 HB3 PHE A 241 4.137 0.920 -5.860 1.00 0.00 H new ATOM 0 HD1 PHE A 241 7.081 2.609 -4.398 1.00 0.00 H new ATOM 0 HD2 PHE A 241 4.946 1.696 -7.968 1.00 0.00 H new ATOM 0 HE1 PHE A 241 8.986 3.390 -5.733 1.00 0.00 H new ATOM 0 HE2 PHE A 241 6.849 2.480 -9.306 1.00 0.00 H new ATOM 0 HZ PHE A 241 8.871 3.329 -8.190 1.00 0.00 H new ATOM 206 N GLN A 242 5.426 4.464 -4.184 1.00 0.00 N ATOM 207 CA GLN A 242 6.166 5.318 -3.263 1.00 0.00 C ATOM 208 C GLN A 242 5.279 6.443 -2.741 1.00 0.00 C ATOM 209 O GLN A 242 5.352 6.808 -1.568 1.00 0.00 O ATOM 210 CB GLN A 242 7.404 5.900 -3.953 1.00 0.00 C ATOM 211 CG GLN A 242 7.135 7.190 -4.710 1.00 0.00 C ATOM 212 CD GLN A 242 7.306 8.423 -3.843 1.00 0.00 C ATOM 213 OE1 GLN A 242 6.896 8.442 -2.683 1.00 0.00 O ATOM 214 NE2 GLN A 242 7.915 9.460 -4.404 1.00 0.00 N ATOM 0 H GLN A 242 5.670 4.591 -5.166 1.00 0.00 H new ATOM 0 HA GLN A 242 6.488 4.710 -2.417 1.00 0.00 H new ATOM 0 HB2 GLN A 242 8.174 6.083 -3.203 1.00 0.00 H new ATOM 0 HB3 GLN A 242 7.804 5.160 -4.646 1.00 0.00 H new ATOM 0 HG2 GLN A 242 7.811 7.254 -5.563 1.00 0.00 H new ATOM 0 HG3 GLN A 242 6.120 7.168 -5.108 1.00 0.00 H new ATOM 0 HE21 GLN A 242 8.239 9.400 -5.369 1.00 0.00 H new ATOM 0 HE22 GLN A 242 8.059 10.317 -3.870 1.00 0.00 H new ATOM 223 N ASN A 243 4.437 6.985 -3.615 1.00 0.00 N ATOM 224 CA ASN A 243 3.533 8.064 -3.237 1.00 0.00 C ATOM 225 C ASN A 243 2.578 7.602 -2.143 1.00 0.00 C ATOM 226 O ASN A 243 2.335 8.319 -1.172 1.00 0.00 O ATOM 227 CB ASN A 243 2.741 8.547 -4.454 1.00 0.00 C ATOM 228 CG ASN A 243 2.291 9.987 -4.317 1.00 0.00 C ATOM 229 OD1 ASN A 243 3.111 10.905 -4.282 1.00 0.00 O ATOM 230 ND2 ASN A 243 0.981 10.194 -4.239 1.00 0.00 N ATOM 0 H ASN A 243 4.362 6.694 -4.590 1.00 0.00 H new ATOM 0 HA ASN A 243 4.129 8.892 -2.854 1.00 0.00 H new ATOM 0 HB2 ASN A 243 3.356 8.445 -5.348 1.00 0.00 H new ATOM 0 HB3 ASN A 243 1.869 7.908 -4.593 1.00 0.00 H new ATOM 0 HD21 ASN A 243 0.619 11.143 -4.146 1.00 0.00 H new ATOM 0 HD22 ASN A 243 0.337 9.404 -4.272 1.00 0.00 H new ATOM 237 N MET A 244 2.045 6.398 -2.302 1.00 0.00 N ATOM 238 CA MET A 244 1.124 5.838 -1.321 1.00 0.00 C ATOM 239 C MET A 244 1.857 5.526 -0.024 1.00 0.00 C ATOM 240 O MET A 244 1.601 6.139 1.012 1.00 0.00 O ATOM 241 CB MET A 244 0.471 4.566 -1.867 1.00 0.00 C ATOM 242 CG MET A 244 -0.372 4.804 -3.108 1.00 0.00 C ATOM 243 SD MET A 244 -0.560 3.320 -4.115 1.00 0.00 S ATOM 244 CE MET A 244 -1.362 2.220 -2.951 1.00 0.00 C ATOM 0 H MET A 244 2.234 5.791 -3.100 1.00 0.00 H new ATOM 0 HA MET A 244 0.347 6.575 -1.120 1.00 0.00 H new ATOM 0 HB2 MET A 244 1.249 3.839 -2.099 1.00 0.00 H new ATOM 0 HB3 MET A 244 -0.155 4.126 -1.091 1.00 0.00 H new ATOM 0 HG2 MET A 244 -1.357 5.163 -2.810 1.00 0.00 H new ATOM 0 HG3 MET A 244 0.086 5.590 -3.708 1.00 0.00 H new ATOM 0 HE1 MET A 244 -1.974 1.500 -3.494 1.00 0.00 H new ATOM 0 HE2 MET A 244 -0.606 1.690 -2.371 1.00 0.00 H new ATOM 0 HE3 MET A 244 -1.994 2.800 -2.279 1.00 0.00 H new ATOM 254 N ARG A 245 2.770 4.564 -0.093 1.00 0.00 N ATOM 255 CA ARG A 245 3.550 4.150 1.068 1.00 0.00 C ATOM 256 C ARG A 245 4.010 5.348 1.891 1.00 0.00 C ATOM 257 O ARG A 245 4.136 5.251 3.108 1.00 0.00 O ATOM 258 CB ARG A 245 4.763 3.331 0.625 1.00 0.00 C ATOM 259 CG ARG A 245 5.897 4.178 0.070 1.00 0.00 C ATOM 260 CD ARG A 245 6.993 3.316 -0.534 1.00 0.00 C ATOM 261 NE ARG A 245 8.255 4.041 -0.651 1.00 0.00 N ATOM 262 CZ ARG A 245 9.449 3.455 -0.624 1.00 0.00 C ATOM 263 NH1 ARG A 245 9.543 2.140 -0.488 1.00 0.00 N ATOM 264 NH2 ARG A 245 10.550 4.186 -0.736 1.00 0.00 N ATOM 0 H ARG A 245 2.990 4.052 -0.948 1.00 0.00 H new ATOM 0 HA ARG A 245 2.905 3.535 1.696 1.00 0.00 H new ATOM 0 HB2 ARG A 245 5.132 2.755 1.474 1.00 0.00 H new ATOM 0 HB3 ARG A 245 4.450 2.615 -0.134 1.00 0.00 H new ATOM 0 HG2 ARG A 245 5.508 4.857 -0.688 1.00 0.00 H new ATOM 0 HG3 ARG A 245 6.315 4.795 0.866 1.00 0.00 H new ATOM 0 HD2 ARG A 245 7.140 2.430 0.084 1.00 0.00 H new ATOM 0 HD3 ARG A 245 6.681 2.970 -1.519 1.00 0.00 H new ATOM 0 HE ARG A 245 8.219 5.055 -0.760 1.00 0.00 H new ATOM 0 HH11 ARG A 245 8.698 1.574 -0.404 1.00 0.00 H new ATOM 0 HH12 ARG A 245 10.460 1.694 -0.468 1.00 0.00 H new ATOM 0 HH21 ARG A 245 10.482 5.198 -0.843 1.00 0.00 H new ATOM 0 HH22 ARG A 245 11.465 3.736 -0.715 1.00 0.00 H new ATOM 278 N GLN A 246 4.270 6.473 1.229 1.00 0.00 N ATOM 279 CA GLN A 246 4.726 7.672 1.926 1.00 0.00 C ATOM 280 C GLN A 246 3.584 8.323 2.706 1.00 0.00 C ATOM 281 O GLN A 246 3.659 8.463 3.930 1.00 0.00 O ATOM 282 CB GLN A 246 5.357 8.666 0.935 1.00 0.00 C ATOM 283 CG GLN A 246 4.464 9.839 0.553 1.00 0.00 C ATOM 284 CD GLN A 246 5.227 10.947 -0.146 1.00 0.00 C ATOM 285 OE1 GLN A 246 6.456 10.924 -0.211 1.00 0.00 O ATOM 286 NE2 GLN A 246 4.499 11.924 -0.673 1.00 0.00 N ATOM 0 H GLN A 246 4.174 6.579 0.219 1.00 0.00 H new ATOM 0 HA GLN A 246 5.490 7.377 2.645 1.00 0.00 H new ATOM 0 HB2 GLN A 246 6.278 9.055 1.369 1.00 0.00 H new ATOM 0 HB3 GLN A 246 5.634 8.128 0.029 1.00 0.00 H new ATOM 0 HG2 GLN A 246 3.665 9.486 -0.099 1.00 0.00 H new ATOM 0 HG3 GLN A 246 3.991 10.238 1.450 1.00 0.00 H new ATOM 0 HE21 GLN A 246 3.482 11.901 -0.595 1.00 0.00 H new ATOM 0 HE22 GLN A 246 4.956 12.697 -1.156 1.00 0.00 H new ATOM 295 N VAL A 247 2.529 8.715 1.999 1.00 0.00 N ATOM 296 CA VAL A 247 1.381 9.344 2.639 1.00 0.00 C ATOM 297 C VAL A 247 0.886 8.497 3.806 1.00 0.00 C ATOM 298 O VAL A 247 0.630 9.007 4.896 1.00 0.00 O ATOM 299 CB VAL A 247 0.224 9.556 1.645 1.00 0.00 C ATOM 300 CG1 VAL A 247 0.514 10.737 0.731 1.00 0.00 C ATOM 301 CG2 VAL A 247 -0.023 8.292 0.834 1.00 0.00 C ATOM 0 H VAL A 247 2.446 8.609 0.988 1.00 0.00 H new ATOM 0 HA VAL A 247 1.711 10.317 3.004 1.00 0.00 H new ATOM 0 HB VAL A 247 -0.680 9.779 2.211 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -0.315 10.871 0.036 1.00 0.00 H new ATOM 0 HG12 VAL A 247 0.635 11.640 1.330 1.00 0.00 H new ATOM 0 HG13 VAL A 247 1.430 10.548 0.171 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -0.844 8.461 0.137 1.00 0.00 H new ATOM 0 HG22 VAL A 247 0.878 8.035 0.277 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -0.280 7.473 1.506 1.00 0.00 H new ATOM 311 N ILE A 248 0.763 7.197 3.564 1.00 0.00 N ATOM 312 CA ILE A 248 0.307 6.264 4.583 1.00 0.00 C ATOM 313 C ILE A 248 1.413 5.975 5.593 1.00 0.00 C ATOM 314 O ILE A 248 1.140 5.648 6.748 1.00 0.00 O ATOM 315 CB ILE A 248 -0.180 4.943 3.956 1.00 0.00 C ATOM 316 CG1 ILE A 248 0.895 4.363 3.020 1.00 0.00 C ATOM 317 CG2 ILE A 248 -1.497 5.174 3.221 1.00 0.00 C ATOM 318 CD1 ILE A 248 0.366 3.881 1.680 1.00 0.00 C ATOM 0 H ILE A 248 0.975 6.765 2.665 1.00 0.00 H new ATOM 0 HA ILE A 248 -0.530 6.734 5.099 1.00 0.00 H new ATOM 0 HB ILE A 248 -0.355 4.213 4.746 1.00 0.00 H new ATOM 0 HG12 ILE A 248 1.655 5.124 2.844 1.00 0.00 H new ATOM 0 HG13 ILE A 248 1.387 3.531 3.523 1.00 0.00 H new ATOM 0 HG21 ILE A 248 -1.837 4.237 2.780 1.00 0.00 H new ATOM 0 HG22 ILE A 248 -2.247 5.537 3.924 1.00 0.00 H new ATOM 0 HG23 ILE A 248 -1.349 5.913 2.434 1.00 0.00 H new ATOM 0 HD11 ILE A 248 1.190 3.488 1.084 1.00 0.00 H new ATOM 0 HD12 ILE A 248 -0.372 3.095 1.841 1.00 0.00 H new ATOM 0 HD13 ILE A 248 -0.100 4.713 1.152 1.00 0.00 H new ATOM 330 N GLN A 249 2.664 6.106 5.156 1.00 0.00 N ATOM 331 CA GLN A 249 3.804 5.868 6.033 1.00 0.00 C ATOM 332 C GLN A 249 3.711 6.749 7.267 1.00 0.00 C ATOM 333 O GLN A 249 3.506 6.262 8.380 1.00 0.00 O ATOM 334 CB GLN A 249 5.121 6.145 5.303 1.00 0.00 C ATOM 335 CG GLN A 249 5.891 4.886 4.935 1.00 0.00 C ATOM 336 CD GLN A 249 6.817 4.425 6.042 1.00 0.00 C ATOM 337 OE1 GLN A 249 7.964 4.863 6.131 1.00 0.00 O ATOM 338 NE2 GLN A 249 6.323 3.534 6.894 1.00 0.00 N ATOM 0 H GLN A 249 2.911 6.375 4.204 1.00 0.00 H new ATOM 0 HA GLN A 249 3.785 4.821 6.334 1.00 0.00 H new ATOM 0 HB2 GLN A 249 4.911 6.711 4.395 1.00 0.00 H new ATOM 0 HB3 GLN A 249 5.750 6.774 5.933 1.00 0.00 H new ATOM 0 HG2 GLN A 249 5.186 4.089 4.701 1.00 0.00 H new ATOM 0 HG3 GLN A 249 6.474 5.072 4.033 1.00 0.00 H new ATOM 0 HE21 GLN A 249 5.366 3.198 6.783 1.00 0.00 H new ATOM 0 HE22 GLN A 249 6.900 3.186 7.660 1.00 0.00 H new ATOM 347 N GLN A 250 3.843 8.053 7.060 1.00 0.00 N ATOM 348 CA GLN A 250 3.754 9.005 8.155 1.00 0.00 C ATOM 349 C GLN A 250 2.301 9.181 8.565 1.00 0.00 C ATOM 350 O GLN A 250 1.961 9.097 9.745 1.00 0.00 O ATOM 351 CB GLN A 250 4.355 10.351 7.743 1.00 0.00 C ATOM 352 CG GLN A 250 5.767 10.242 7.190 1.00 0.00 C ATOM 353 CD GLN A 250 6.022 11.210 6.051 1.00 0.00 C ATOM 354 OE1 GLN A 250 6.121 10.811 4.891 1.00 0.00 O ATOM 355 NE2 GLN A 250 6.131 12.492 6.379 1.00 0.00 N ATOM 0 H GLN A 250 4.012 8.473 6.146 1.00 0.00 H new ATOM 0 HA GLN A 250 4.320 8.621 9.004 1.00 0.00 H new ATOM 0 HB2 GLN A 250 3.714 10.811 6.991 1.00 0.00 H new ATOM 0 HB3 GLN A 250 4.362 11.016 8.607 1.00 0.00 H new ATOM 0 HG2 GLN A 250 6.483 10.431 7.990 1.00 0.00 H new ATOM 0 HG3 GLN A 250 5.940 9.224 6.842 1.00 0.00 H new ATOM 0 HE21 GLN A 250 6.042 12.778 7.354 1.00 0.00 H new ATOM 0 HE22 GLN A 250 6.304 13.190 5.656 1.00 0.00 H new ATOM 364 N ASN A 251 1.446 9.416 7.574 1.00 0.00 N ATOM 365 CA ASN A 251 0.021 9.585 7.805 1.00 0.00 C ATOM 366 C ASN A 251 -0.745 8.299 7.494 1.00 0.00 C ATOM 367 O ASN A 251 -1.497 8.252 6.521 1.00 0.00 O ATOM 368 CB ASN A 251 -0.521 10.734 6.952 1.00 0.00 C ATOM 369 CG ASN A 251 -1.922 11.145 7.361 1.00 0.00 C ATOM 370 OD1 ASN A 251 -2.107 11.893 8.321 1.00 0.00 O ATOM 371 ND2 ASN A 251 -2.918 10.656 6.631 1.00 0.00 N ATOM 0 H ASN A 251 1.722 9.494 6.595 1.00 0.00 H new ATOM 0 HA ASN A 251 -0.122 9.822 8.859 1.00 0.00 H new ATOM 0 HB2 ASN A 251 0.146 11.592 7.037 1.00 0.00 H new ATOM 0 HB3 ASN A 251 -0.524 10.435 5.904 1.00 0.00 H new ATOM 0 HD21 ASN A 251 -3.883 10.897 6.858 1.00 0.00 H new ATOM 0 HD22 ASN A 251 -2.718 10.039 5.844 1.00 0.00 H new ATOM 378 N PRO A 252 -0.584 7.238 8.304 1.00 0.00 N ATOM 379 CA PRO A 252 -1.287 5.966 8.082 1.00 0.00 C ATOM 380 C PRO A 252 -2.758 6.031 8.488 1.00 0.00 C ATOM 381 O PRO A 252 -3.322 5.047 8.966 1.00 0.00 O ATOM 382 CB PRO A 252 -0.535 4.999 8.995 1.00 0.00 C ATOM 383 CG PRO A 252 -0.062 5.855 10.116 1.00 0.00 C ATOM 384 CD PRO A 252 0.287 7.180 9.494 1.00 0.00 C ATOM 0 HA PRO A 252 -1.295 5.681 7.030 1.00 0.00 H new ATOM 0 HB2 PRO A 252 -1.185 4.199 9.350 1.00 0.00 H new ATOM 0 HB3 PRO A 252 0.298 4.526 8.475 1.00 0.00 H new ATOM 0 HG2 PRO A 252 -0.836 5.970 10.875 1.00 0.00 H new ATOM 0 HG3 PRO A 252 0.804 5.413 10.608 1.00 0.00 H new ATOM 0 HD2 PRO A 252 0.092 8.008 10.176 1.00 0.00 H new ATOM 0 HD3 PRO A 252 1.342 7.232 9.223 1.00 0.00 H new ATOM 392 N ALA A 253 -3.375 7.194 8.301 1.00 0.00 N ATOM 393 CA ALA A 253 -4.775 7.383 8.654 1.00 0.00 C ATOM 394 C ALA A 253 -5.695 6.908 7.537 1.00 0.00 C ATOM 395 O ALA A 253 -6.684 6.218 7.785 1.00 0.00 O ATOM 396 CB ALA A 253 -5.060 8.842 8.980 1.00 0.00 C ATOM 0 H ALA A 253 -2.925 8.020 7.906 1.00 0.00 H new ATOM 0 HA ALA A 253 -4.973 6.781 9.541 1.00 0.00 H new ATOM 0 HB1 ALA A 253 -6.112 8.958 9.241 1.00 0.00 H new ATOM 0 HB2 ALA A 253 -4.441 9.154 9.821 1.00 0.00 H new ATOM 0 HB3 ALA A 253 -4.831 9.460 8.112 1.00 0.00 H new ATOM 402 N LEU A 254 -5.365 7.286 6.309 1.00 0.00 N ATOM 403 CA LEU A 254 -6.164 6.904 5.152 1.00 0.00 C ATOM 404 C LEU A 254 -5.721 5.554 4.604 1.00 0.00 C ATOM 405 O LEU A 254 -6.309 5.037 3.655 1.00 0.00 O ATOM 406 CB LEU A 254 -6.062 7.969 4.059 1.00 0.00 C ATOM 407 CG LEU A 254 -6.026 9.413 4.564 1.00 0.00 C ATOM 408 CD1 LEU A 254 -6.118 10.388 3.400 1.00 0.00 C ATOM 409 CD2 LEU A 254 -7.151 9.657 5.558 1.00 0.00 C ATOM 0 H LEU A 254 -4.549 7.857 6.088 1.00 0.00 H new ATOM 0 HA LEU A 254 -7.202 6.821 5.473 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -5.162 7.782 3.474 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -6.910 7.857 3.384 1.00 0.00 H new ATOM 0 HG LEU A 254 -5.076 9.577 5.073 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -6.091 11.410 3.778 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -5.277 10.229 2.725 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -7.052 10.225 2.862 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -7.111 10.689 5.907 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -8.110 9.475 5.074 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -7.039 8.982 6.407 1.00 0.00 H new ATOM 421 N LEU A 255 -4.673 4.994 5.198 1.00 0.00 N ATOM 422 CA LEU A 255 -4.147 3.713 4.755 1.00 0.00 C ATOM 423 C LEU A 255 -3.899 3.737 3.255 1.00 0.00 C ATOM 424 O LEU A 255 -4.283 4.682 2.565 1.00 0.00 O ATOM 425 CB LEU A 255 -5.111 2.577 5.112 1.00 0.00 C ATOM 426 CG LEU A 255 -6.133 2.218 4.030 1.00 0.00 C ATOM 427 CD1 LEU A 255 -5.826 0.855 3.431 1.00 0.00 C ATOM 428 CD2 LEU A 255 -7.537 2.239 4.608 1.00 0.00 C ATOM 0 H LEU A 255 -4.174 5.408 5.985 1.00 0.00 H new ATOM 0 HA LEU A 255 -3.202 3.536 5.268 1.00 0.00 H new ATOM 0 HB2 LEU A 255 -4.526 1.687 5.345 1.00 0.00 H new ATOM 0 HB3 LEU A 255 -5.649 2.852 6.019 1.00 0.00 H new ATOM 0 HG LEU A 255 -6.070 2.961 3.235 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -6.564 0.620 2.664 1.00 0.00 H new ATOM 0 HD12 LEU A 255 -4.832 0.869 2.985 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -5.862 0.097 4.214 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -8.255 1.982 3.829 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -7.607 1.515 5.419 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -7.758 3.235 4.991 1.00 0.00 H new ATOM 440 N PRO A 256 -3.245 2.698 2.732 1.00 0.00 N ATOM 441 CA PRO A 256 -2.933 2.591 1.311 1.00 0.00 C ATOM 442 C PRO A 256 -4.174 2.271 0.485 1.00 0.00 C ATOM 443 O PRO A 256 -4.190 1.314 -0.290 1.00 0.00 O ATOM 444 CB PRO A 256 -1.918 1.438 1.240 1.00 0.00 C ATOM 445 CG PRO A 256 -1.586 1.097 2.662 1.00 0.00 C ATOM 446 CD PRO A 256 -2.756 1.548 3.487 1.00 0.00 C ATOM 0 HA PRO A 256 -2.545 3.525 0.904 1.00 0.00 H new ATOM 0 HB2 PRO A 256 -2.339 0.578 0.720 1.00 0.00 H new ATOM 0 HB3 PRO A 256 -1.025 1.737 0.691 1.00 0.00 H new ATOM 0 HG2 PRO A 256 -1.419 0.026 2.776 1.00 0.00 H new ATOM 0 HG3 PRO A 256 -0.671 1.598 2.979 1.00 0.00 H new ATOM 0 HD2 PRO A 256 -3.513 0.770 3.578 1.00 0.00 H new ATOM 0 HD3 PRO A 256 -2.458 1.823 4.499 1.00 0.00 H new ATOM 454 N ALA A 257 -5.214 3.082 0.661 1.00 0.00 N ATOM 455 CA ALA A 257 -6.464 2.893 -0.060 1.00 0.00 C ATOM 456 C ALA A 257 -6.231 2.954 -1.561 1.00 0.00 C ATOM 457 O ALA A 257 -6.956 2.333 -2.338 1.00 0.00 O ATOM 458 CB ALA A 257 -7.495 3.933 0.356 1.00 0.00 C ATOM 0 H ALA A 257 -5.213 3.878 1.299 1.00 0.00 H new ATOM 0 HA ALA A 257 -6.851 1.906 0.193 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -8.420 3.770 -0.197 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -7.691 3.844 1.425 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -7.113 4.931 0.139 1.00 0.00 H new ATOM 464 N LEU A 258 -5.209 3.700 -1.965 1.00 0.00 N ATOM 465 CA LEU A 258 -4.881 3.830 -3.376 1.00 0.00 C ATOM 466 C LEU A 258 -4.958 2.468 -4.055 1.00 0.00 C ATOM 467 O LEU A 258 -5.506 2.333 -5.151 1.00 0.00 O ATOM 468 CB LEU A 258 -3.484 4.427 -3.547 1.00 0.00 C ATOM 469 CG LEU A 258 -3.427 5.954 -3.495 1.00 0.00 C ATOM 470 CD1 LEU A 258 -4.498 6.560 -4.389 1.00 0.00 C ATOM 471 CD2 LEU A 258 -3.585 6.445 -2.064 1.00 0.00 C ATOM 0 H LEU A 258 -4.597 4.221 -1.337 1.00 0.00 H new ATOM 0 HA LEU A 258 -5.602 4.501 -3.843 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -2.836 4.027 -2.768 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -3.077 4.095 -4.502 1.00 0.00 H new ATOM 0 HG LEU A 258 -2.452 6.274 -3.863 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -4.442 7.647 -4.339 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -4.340 6.236 -5.418 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -5.481 6.232 -4.052 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -3.542 7.534 -2.046 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -4.545 6.113 -1.669 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -2.781 6.040 -1.450 1.00 0.00 H new ATOM 483 N LEU A 259 -4.419 1.458 -3.382 1.00 0.00 N ATOM 484 CA LEU A 259 -4.435 0.098 -3.905 1.00 0.00 C ATOM 485 C LEU A 259 -5.861 -0.434 -3.932 1.00 0.00 C ATOM 486 O LEU A 259 -6.231 -1.215 -4.809 1.00 0.00 O ATOM 487 CB LEU A 259 -3.548 -0.811 -3.049 1.00 0.00 C ATOM 488 CG LEU A 259 -3.795 -2.310 -3.227 1.00 0.00 C ATOM 489 CD1 LEU A 259 -5.076 -2.727 -2.523 1.00 0.00 C ATOM 490 CD2 LEU A 259 -3.855 -2.669 -4.703 1.00 0.00 C ATOM 0 H LEU A 259 -3.966 1.556 -2.473 1.00 0.00 H new ATOM 0 HA LEU A 259 -4.043 0.109 -4.922 1.00 0.00 H new ATOM 0 HB2 LEU A 259 -2.505 -0.600 -3.283 1.00 0.00 H new ATOM 0 HB3 LEU A 259 -3.697 -0.556 -2.000 1.00 0.00 H new ATOM 0 HG LEU A 259 -2.964 -2.852 -2.776 1.00 0.00 H new ATOM 0 HD11 LEU A 259 -5.235 -3.796 -2.661 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -4.995 -2.506 -1.459 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -5.918 -2.178 -2.944 1.00 0.00 H new ATOM 0 HD21 LEU A 259 -4.031 -3.739 -4.810 1.00 0.00 H new ATOM 0 HD22 LEU A 259 -4.666 -2.118 -5.179 1.00 0.00 H new ATOM 0 HD23 LEU A 259 -2.910 -2.407 -5.180 1.00 0.00 H new ATOM 502 N GLN A 260 -6.663 0.007 -2.967 1.00 0.00 N ATOM 503 CA GLN A 260 -8.055 -0.409 -2.877 1.00 0.00 C ATOM 504 C GLN A 260 -8.843 0.112 -4.073 1.00 0.00 C ATOM 505 O GLN A 260 -9.676 -0.595 -4.638 1.00 0.00 O ATOM 506 CB GLN A 260 -8.680 0.099 -1.576 1.00 0.00 C ATOM 507 CG GLN A 260 -9.203 -1.010 -0.678 1.00 0.00 C ATOM 508 CD GLN A 260 -10.330 -0.547 0.224 1.00 0.00 C ATOM 509 OE1 GLN A 260 -11.412 -1.136 0.238 1.00 0.00 O ATOM 510 NE2 GLN A 260 -10.083 0.514 0.984 1.00 0.00 N ATOM 0 H GLN A 260 -6.370 0.654 -2.235 1.00 0.00 H new ATOM 0 HA GLN A 260 -8.090 -1.498 -2.881 1.00 0.00 H new ATOM 0 HB2 GLN A 260 -7.937 0.679 -1.028 1.00 0.00 H new ATOM 0 HB3 GLN A 260 -9.499 0.777 -1.817 1.00 0.00 H new ATOM 0 HG2 GLN A 260 -9.553 -1.837 -1.295 1.00 0.00 H new ATOM 0 HG3 GLN A 260 -8.386 -1.392 -0.066 1.00 0.00 H new ATOM 0 HE21 GLN A 260 -9.172 0.971 0.941 1.00 0.00 H new ATOM 0 HE22 GLN A 260 -10.804 0.871 1.611 1.00 0.00 H new ATOM 519 N GLN A 261 -8.564 1.355 -4.457 1.00 0.00 N ATOM 520 CA GLN A 261 -9.237 1.971 -5.592 1.00 0.00 C ATOM 521 C GLN A 261 -8.805 1.301 -6.890 1.00 0.00 C ATOM 522 O GLN A 261 -9.582 1.196 -7.837 1.00 0.00 O ATOM 523 CB GLN A 261 -8.929 3.469 -5.648 1.00 0.00 C ATOM 524 CG GLN A 261 -10.073 4.305 -6.195 1.00 0.00 C ATOM 525 CD GLN A 261 -10.739 5.152 -5.127 1.00 0.00 C ATOM 526 OE1 GLN A 261 -11.935 5.019 -4.869 1.00 0.00 O ATOM 527 NE2 GLN A 261 -9.964 6.030 -4.500 1.00 0.00 N ATOM 0 H GLN A 261 -7.877 1.953 -3.998 1.00 0.00 H new ATOM 0 HA GLN A 261 -10.312 1.839 -5.468 1.00 0.00 H new ATOM 0 HB2 GLN A 261 -8.682 3.818 -4.646 1.00 0.00 H new ATOM 0 HB3 GLN A 261 -8.046 3.627 -6.267 1.00 0.00 H new ATOM 0 HG2 GLN A 261 -9.698 4.954 -6.987 1.00 0.00 H new ATOM 0 HG3 GLN A 261 -10.815 3.647 -6.647 1.00 0.00 H new ATOM 0 HE21 GLN A 261 -8.977 6.106 -4.746 1.00 0.00 H new ATOM 0 HE22 GLN A 261 -10.356 6.628 -3.772 1.00 0.00 H new ATOM 536 N LEU A 262 -7.558 0.842 -6.920 1.00 0.00 N ATOM 537 CA LEU A 262 -7.022 0.171 -8.098 1.00 0.00 C ATOM 538 C LEU A 262 -7.657 -1.205 -8.268 1.00 0.00 C ATOM 539 O LEU A 262 -8.144 -1.548 -9.345 1.00 0.00 O ATOM 540 CB LEU A 262 -5.501 0.036 -7.988 1.00 0.00 C ATOM 541 CG LEU A 262 -4.709 1.267 -8.427 1.00 0.00 C ATOM 542 CD1 LEU A 262 -3.507 1.481 -7.519 1.00 0.00 C ATOM 543 CD2 LEU A 262 -4.266 1.127 -9.876 1.00 0.00 C ATOM 0 H LEU A 262 -6.901 0.922 -6.144 1.00 0.00 H new ATOM 0 HA LEU A 262 -7.261 0.775 -8.973 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -5.246 -0.191 -6.953 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -5.183 -0.816 -8.589 1.00 0.00 H new ATOM 0 HG LEU A 262 -5.358 2.139 -8.348 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -2.955 2.362 -7.847 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -3.847 1.627 -6.494 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -2.856 0.608 -7.565 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -3.703 2.013 -10.172 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -3.635 0.245 -9.980 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -5.142 1.023 -10.516 1.00 0.00 H new ATOM 555 N GLY A 263 -7.653 -1.990 -7.195 1.00 0.00 N ATOM 556 CA GLY A 263 -8.234 -3.319 -7.244 1.00 0.00 C ATOM 557 C GLY A 263 -9.749 -3.284 -7.282 1.00 0.00 C ATOM 558 O GLY A 263 -10.386 -4.200 -7.802 1.00 0.00 O ATOM 0 H GLY A 263 -7.257 -1.729 -6.292 1.00 0.00 H new ATOM 0 HA2 GLY A 263 -7.863 -3.843 -8.125 1.00 0.00 H new ATOM 0 HA3 GLY A 263 -7.908 -3.888 -6.373 1.00 0.00 H new ATOM 562 N GLN A 264 -10.326 -2.222 -6.730 1.00 0.00 N ATOM 563 CA GLN A 264 -11.775 -2.063 -6.705 1.00 0.00 C ATOM 564 C GLN A 264 -12.271 -1.490 -8.025 1.00 0.00 C ATOM 565 O GLN A 264 -13.204 -2.014 -8.634 1.00 0.00 O ATOM 566 CB GLN A 264 -12.192 -1.151 -5.550 1.00 0.00 C ATOM 567 CG GLN A 264 -13.631 -0.670 -5.644 1.00 0.00 C ATOM 568 CD GLN A 264 -14.354 -0.734 -4.313 1.00 0.00 C ATOM 569 OE1 GLN A 264 -13.830 -1.264 -3.333 1.00 0.00 O ATOM 570 NE2 GLN A 264 -15.566 -0.193 -4.272 1.00 0.00 N ATOM 0 H GLN A 264 -9.811 -1.457 -6.293 1.00 0.00 H new ATOM 0 HA GLN A 264 -12.225 -3.045 -6.558 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -12.057 -1.685 -4.609 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -11.529 -0.286 -5.524 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -13.644 0.356 -6.012 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -14.166 -1.277 -6.374 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -15.962 0.236 -5.109 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -16.101 -0.206 -3.404 1.00 0.00 H new ATOM 579 N GLU A 265 -11.631 -0.413 -8.464 1.00 0.00 N ATOM 580 CA GLU A 265 -11.994 0.235 -9.715 1.00 0.00 C ATOM 581 C GLU A 265 -12.364 -0.805 -10.764 1.00 0.00 C ATOM 582 O GLU A 265 -13.521 -0.909 -11.170 1.00 0.00 O ATOM 583 CB GLU A 265 -10.831 1.102 -10.211 1.00 0.00 C ATOM 584 CG GLU A 265 -10.803 1.295 -11.721 1.00 0.00 C ATOM 585 CD GLU A 265 -12.181 1.540 -12.303 1.00 0.00 C ATOM 586 OE1 GLU A 265 -13.014 2.165 -11.613 1.00 0.00 O ATOM 587 OE2 GLU A 265 -12.428 1.107 -13.448 1.00 0.00 O ATOM 0 H GLU A 265 -10.856 0.030 -7.970 1.00 0.00 H new ATOM 0 HA GLU A 265 -12.861 0.873 -9.542 1.00 0.00 H new ATOM 0 HB2 GLU A 265 -10.889 2.079 -9.731 1.00 0.00 H new ATOM 0 HB3 GLU A 265 -9.892 0.647 -9.896 1.00 0.00 H new ATOM 0 HG2 GLU A 265 -10.155 2.137 -11.964 1.00 0.00 H new ATOM 0 HG3 GLU A 265 -10.367 0.412 -12.188 1.00 0.00 H new ATOM 594 N ASN A 266 -11.373 -1.574 -11.195 1.00 0.00 N ATOM 595 CA ASN A 266 -11.596 -2.609 -12.192 1.00 0.00 C ATOM 596 C ASN A 266 -11.638 -3.986 -11.538 1.00 0.00 C ATOM 597 O ASN A 266 -10.608 -4.520 -11.128 1.00 0.00 O ATOM 598 CB ASN A 266 -10.502 -2.566 -13.259 1.00 0.00 C ATOM 599 CG ASN A 266 -11.019 -2.068 -14.595 1.00 0.00 C ATOM 600 OD1 ASN A 266 -12.111 -1.506 -14.682 1.00 0.00 O ATOM 601 ND2 ASN A 266 -10.233 -2.273 -15.647 1.00 0.00 N ATOM 0 H ASN A 266 -10.409 -1.500 -10.870 1.00 0.00 H new ATOM 0 HA ASN A 266 -12.558 -2.422 -12.668 1.00 0.00 H new ATOM 0 HB2 ASN A 266 -9.693 -1.918 -12.921 1.00 0.00 H new ATOM 0 HB3 ASN A 266 -10.080 -3.563 -13.384 1.00 0.00 H new ATOM 0 HD21 ASN A 266 -10.527 -1.960 -16.572 1.00 0.00 H new ATOM 0 HD22 ASN A 266 -9.336 -2.743 -15.529 1.00 0.00 H new ATOM 608 N PRO A 267 -12.836 -4.579 -11.436 1.00 0.00 N ATOM 609 CA PRO A 267 -13.014 -5.899 -10.832 1.00 0.00 C ATOM 610 C PRO A 267 -11.961 -6.895 -11.307 1.00 0.00 C ATOM 611 O PRO A 267 -11.670 -7.879 -10.627 1.00 0.00 O ATOM 612 CB PRO A 267 -14.403 -6.312 -11.312 1.00 0.00 C ATOM 613 CG PRO A 267 -15.137 -5.026 -11.483 1.00 0.00 C ATOM 614 CD PRO A 267 -14.110 -4.007 -11.906 1.00 0.00 C ATOM 0 HA PRO A 267 -12.912 -5.877 -9.747 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -14.350 -6.867 -12.249 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -14.898 -6.958 -10.587 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -15.921 -5.123 -12.234 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -15.621 -4.728 -10.553 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -14.110 -3.863 -12.986 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -14.302 -3.034 -11.455 1.00 0.00 H new ATOM 622 N GLN A 268 -11.392 -6.629 -12.477 1.00 0.00 N ATOM 623 CA GLN A 268 -10.368 -7.496 -13.046 1.00 0.00 C ATOM 624 C GLN A 268 -8.974 -6.991 -12.691 1.00 0.00 C ATOM 625 O GLN A 268 -8.014 -7.761 -12.654 1.00 0.00 O ATOM 626 CB GLN A 268 -10.523 -7.576 -14.565 1.00 0.00 C ATOM 627 CG GLN A 268 -9.483 -8.459 -15.237 1.00 0.00 C ATOM 628 CD GLN A 268 -9.936 -8.965 -16.592 1.00 0.00 C ATOM 629 OE1 GLN A 268 -9.330 -8.654 -17.618 1.00 0.00 O ATOM 630 NE2 GLN A 268 -11.008 -9.749 -16.603 1.00 0.00 N ATOM 0 H GLN A 268 -11.623 -5.818 -13.051 1.00 0.00 H new ATOM 0 HA GLN A 268 -10.494 -8.493 -12.624 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -11.517 -7.956 -14.801 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -10.458 -6.571 -14.982 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -8.556 -7.898 -15.354 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -9.261 -9.309 -14.591 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -11.479 -9.981 -15.729 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -11.360 -10.119 -17.486 1.00 0.00 H new ATOM 639 N LEU A 269 -8.869 -5.690 -12.433 1.00 0.00 N ATOM 640 CA LEU A 269 -7.591 -5.083 -12.083 1.00 0.00 C ATOM 641 C LEU A 269 -6.903 -5.873 -10.976 1.00 0.00 C ATOM 642 O LEU A 269 -5.783 -6.350 -11.145 1.00 0.00 O ATOM 643 CB LEU A 269 -7.788 -3.632 -11.641 1.00 0.00 C ATOM 644 CG LEU A 269 -6.850 -2.624 -12.307 1.00 0.00 C ATOM 645 CD1 LEU A 269 -7.246 -2.405 -13.760 1.00 0.00 C ATOM 646 CD2 LEU A 269 -6.855 -1.306 -11.548 1.00 0.00 C ATOM 0 H LEU A 269 -9.653 -5.038 -12.460 1.00 0.00 H new ATOM 0 HA LEU A 269 -6.957 -5.099 -12.970 1.00 0.00 H new ATOM 0 HB2 LEU A 269 -8.818 -3.341 -11.849 1.00 0.00 H new ATOM 0 HB3 LEU A 269 -7.652 -3.575 -10.561 1.00 0.00 H new ATOM 0 HG LEU A 269 -5.838 -3.029 -12.284 1.00 0.00 H new ATOM 0 HD11 LEU A 269 -6.568 -1.685 -14.217 1.00 0.00 H new ATOM 0 HD12 LEU A 269 -7.189 -3.351 -14.299 1.00 0.00 H new ATOM 0 HD13 LEU A 269 -8.266 -2.022 -13.806 1.00 0.00 H new ATOM 0 HD21 LEU A 269 -6.182 -0.602 -12.037 1.00 0.00 H new ATOM 0 HD22 LEU A 269 -7.865 -0.896 -11.538 1.00 0.00 H new ATOM 0 HD23 LEU A 269 -6.522 -1.475 -10.524 1.00 0.00 H new ATOM 658 N LEU A 270 -7.584 -6.009 -9.844 1.00 0.00 N ATOM 659 CA LEU A 270 -7.038 -6.744 -8.710 1.00 0.00 C ATOM 660 C LEU A 270 -6.315 -8.005 -9.174 1.00 0.00 C ATOM 661 O LEU A 270 -5.152 -8.228 -8.836 1.00 0.00 O ATOM 662 CB LEU A 270 -8.153 -7.114 -7.730 1.00 0.00 C ATOM 663 CG LEU A 270 -7.684 -7.779 -6.436 1.00 0.00 C ATOM 664 CD1 LEU A 270 -6.945 -6.779 -5.560 1.00 0.00 C ATOM 665 CD2 LEU A 270 -8.865 -8.377 -5.686 1.00 0.00 C ATOM 0 H LEU A 270 -8.514 -5.620 -9.687 1.00 0.00 H new ATOM 0 HA LEU A 270 -6.318 -6.099 -8.205 1.00 0.00 H new ATOM 0 HB2 LEU A 270 -8.707 -6.210 -7.476 1.00 0.00 H new ATOM 0 HB3 LEU A 270 -8.850 -7.784 -8.233 1.00 0.00 H new ATOM 0 HG LEU A 270 -6.996 -8.585 -6.692 1.00 0.00 H new ATOM 0 HD11 LEU A 270 -6.619 -7.270 -4.643 1.00 0.00 H new ATOM 0 HD12 LEU A 270 -6.076 -6.398 -6.097 1.00 0.00 H new ATOM 0 HD13 LEU A 270 -7.610 -5.952 -5.312 1.00 0.00 H new ATOM 0 HD21 LEU A 270 -8.513 -8.846 -4.767 1.00 0.00 H new ATOM 0 HD22 LEU A 270 -9.577 -7.589 -5.441 1.00 0.00 H new ATOM 0 HD23 LEU A 270 -9.352 -9.125 -6.312 1.00 0.00 H new ATOM 677 N GLN A 271 -7.012 -8.826 -9.953 1.00 0.00 N ATOM 678 CA GLN A 271 -6.440 -10.066 -10.465 1.00 0.00 C ATOM 679 C GLN A 271 -5.045 -9.830 -11.036 1.00 0.00 C ATOM 680 O GLN A 271 -4.053 -10.319 -10.497 1.00 0.00 O ATOM 681 CB GLN A 271 -7.349 -10.663 -11.541 1.00 0.00 C ATOM 682 CG GLN A 271 -8.817 -10.689 -11.151 1.00 0.00 C ATOM 683 CD GLN A 271 -9.048 -11.306 -9.785 1.00 0.00 C ATOM 684 OE1 GLN A 271 -9.305 -10.462 -8.792 1.00 0.00 O flip ATOM 685 NE2 GLN A 271 -8.994 -12.525 -9.625 1.00 0.00 N flip ATOM 0 H GLN A 271 -7.975 -8.655 -10.244 1.00 0.00 H new ATOM 0 HA GLN A 271 -6.358 -10.768 -9.635 1.00 0.00 H new ATOM 0 HB2 GLN A 271 -7.236 -10.088 -12.460 1.00 0.00 H new ATOM 0 HB3 GLN A 271 -7.021 -11.680 -11.759 1.00 0.00 H new ATOM 0 HG2 GLN A 271 -9.208 -9.672 -11.157 1.00 0.00 H new ATOM 0 HG3 GLN A 271 -9.378 -11.250 -11.898 1.00 0.00 H new ATOM 0 HE21 GLN A 271 -8.793 -13.135 -10.418 1.00 0.00 H new ATOM 0 HE22 GLN A 271 -9.150 -12.925 -8.700 1.00 0.00 H new ATOM 694 N GLN A 272 -4.976 -9.081 -12.131 1.00 0.00 N ATOM 695 CA GLN A 272 -3.703 -8.783 -12.775 1.00 0.00 C ATOM 696 C GLN A 272 -2.738 -8.118 -11.798 1.00 0.00 C ATOM 697 O GLN A 272 -1.593 -8.547 -11.652 1.00 0.00 O ATOM 698 CB GLN A 272 -3.921 -7.879 -13.990 1.00 0.00 C ATOM 699 CG GLN A 272 -4.880 -8.459 -15.016 1.00 0.00 C ATOM 700 CD GLN A 272 -4.584 -7.983 -16.425 1.00 0.00 C ATOM 701 OE1 GLN A 272 -5.251 -7.088 -16.944 1.00 0.00 O ATOM 702 NE2 GLN A 272 -3.578 -8.582 -17.052 1.00 0.00 N ATOM 0 H GLN A 272 -5.788 -8.669 -12.591 1.00 0.00 H new ATOM 0 HA GLN A 272 -3.264 -9.725 -13.105 1.00 0.00 H new ATOM 0 HB2 GLN A 272 -4.303 -6.916 -13.652 1.00 0.00 H new ATOM 0 HB3 GLN A 272 -2.960 -7.690 -14.469 1.00 0.00 H new ATOM 0 HG2 GLN A 272 -4.825 -9.547 -14.985 1.00 0.00 H new ATOM 0 HG3 GLN A 272 -5.901 -8.184 -14.750 1.00 0.00 H new ATOM 0 HE21 GLN A 272 -3.052 -9.320 -16.583 1.00 0.00 H new ATOM 0 HE22 GLN A 272 -3.332 -8.304 -18.002 1.00 0.00 H new ATOM 711 N ILE A 273 -3.208 -7.069 -11.131 1.00 0.00 N ATOM 712 CA ILE A 273 -2.389 -6.345 -10.168 1.00 0.00 C ATOM 713 C ILE A 273 -1.635 -7.309 -9.260 1.00 0.00 C ATOM 714 O ILE A 273 -0.550 -6.998 -8.769 1.00 0.00 O ATOM 715 CB ILE A 273 -3.242 -5.399 -9.300 1.00 0.00 C ATOM 716 CG1 ILE A 273 -3.810 -4.261 -10.151 1.00 0.00 C ATOM 717 CG2 ILE A 273 -2.419 -4.840 -8.150 1.00 0.00 C ATOM 718 CD1 ILE A 273 -4.329 -3.100 -9.333 1.00 0.00 C ATOM 0 H ILE A 273 -4.153 -6.702 -11.241 1.00 0.00 H new ATOM 0 HA ILE A 273 -1.675 -5.752 -10.740 1.00 0.00 H new ATOM 0 HB ILE A 273 -4.072 -5.970 -8.884 1.00 0.00 H new ATOM 0 HG12 ILE A 273 -3.035 -3.901 -10.827 1.00 0.00 H new ATOM 0 HG13 ILE A 273 -4.618 -4.649 -10.771 1.00 0.00 H new ATOM 0 HG21 ILE A 273 -3.039 -4.175 -7.549 1.00 0.00 H new ATOM 0 HG22 ILE A 273 -2.058 -5.660 -7.529 1.00 0.00 H new ATOM 0 HG23 ILE A 273 -1.569 -4.284 -8.547 1.00 0.00 H new ATOM 0 HD11 ILE A 273 -4.717 -2.330 -10.000 1.00 0.00 H new ATOM 0 HD12 ILE A 273 -5.127 -3.446 -8.676 1.00 0.00 H new ATOM 0 HD13 ILE A 273 -3.518 -2.686 -8.733 1.00 0.00 H new ATOM 730 N SER A 274 -2.218 -8.484 -9.043 1.00 0.00 N ATOM 731 CA SER A 274 -1.601 -9.497 -8.196 1.00 0.00 C ATOM 732 C SER A 274 -0.188 -9.819 -8.673 1.00 0.00 C ATOM 733 O SER A 274 0.616 -10.382 -7.930 1.00 0.00 O ATOM 734 CB SER A 274 -2.452 -10.769 -8.186 1.00 0.00 C ATOM 735 OG SER A 274 -2.497 -11.343 -6.891 1.00 0.00 O ATOM 0 H SER A 274 -3.116 -8.757 -9.442 1.00 0.00 H new ATOM 0 HA SER A 274 -1.540 -9.100 -7.183 1.00 0.00 H new ATOM 0 HB2 SER A 274 -3.463 -10.536 -8.519 1.00 0.00 H new ATOM 0 HB3 SER A 274 -2.042 -11.490 -8.893 1.00 0.00 H new ATOM 0 HG SER A 274 -3.048 -12.153 -6.911 1.00 0.00 H new ATOM 741 N ARG A 275 0.109 -9.457 -9.918 1.00 0.00 N ATOM 742 CA ARG A 275 1.424 -9.705 -10.494 1.00 0.00 C ATOM 743 C ARG A 275 2.525 -9.124 -9.612 1.00 0.00 C ATOM 744 O ARG A 275 3.423 -9.841 -9.170 1.00 0.00 O ATOM 745 CB ARG A 275 1.511 -9.104 -11.898 1.00 0.00 C ATOM 746 CG ARG A 275 2.244 -9.987 -12.895 1.00 0.00 C ATOM 747 CD ARG A 275 1.776 -11.431 -12.807 1.00 0.00 C ATOM 748 NE ARG A 275 1.704 -12.064 -14.121 1.00 0.00 N ATOM 749 CZ ARG A 275 1.297 -13.314 -14.313 1.00 0.00 C ATOM 750 NH1 ARG A 275 0.929 -14.060 -13.281 1.00 0.00 N ATOM 751 NH2 ARG A 275 1.258 -13.820 -15.539 1.00 0.00 N ATOM 0 H ARG A 275 -0.545 -8.991 -10.547 1.00 0.00 H new ATOM 0 HA ARG A 275 1.566 -10.784 -10.558 1.00 0.00 H new ATOM 0 HB2 ARG A 275 0.503 -8.915 -12.266 1.00 0.00 H new ATOM 0 HB3 ARG A 275 2.015 -8.139 -11.840 1.00 0.00 H new ATOM 0 HG2 ARG A 275 2.081 -9.611 -13.905 1.00 0.00 H new ATOM 0 HG3 ARG A 275 3.316 -9.938 -12.706 1.00 0.00 H new ATOM 0 HD2 ARG A 275 2.458 -11.995 -12.170 1.00 0.00 H new ATOM 0 HD3 ARG A 275 0.795 -11.466 -12.334 1.00 0.00 H new ATOM 0 HE ARG A 275 1.981 -11.517 -14.936 1.00 0.00 H new ATOM 0 HH11 ARG A 275 0.958 -13.675 -12.337 1.00 0.00 H new ATOM 0 HH12 ARG A 275 0.617 -15.019 -13.431 1.00 0.00 H new ATOM 0 HH21 ARG A 275 1.541 -13.249 -16.336 1.00 0.00 H new ATOM 0 HH22 ARG A 275 0.945 -14.780 -15.685 1.00 0.00 H new ATOM 765 N HIS A 276 2.448 -7.822 -9.359 1.00 0.00 N ATOM 766 CA HIS A 276 3.439 -7.146 -8.529 1.00 0.00 C ATOM 767 C HIS A 276 2.913 -6.942 -7.112 1.00 0.00 C ATOM 768 O HIS A 276 3.279 -5.979 -6.436 1.00 0.00 O ATOM 769 CB HIS A 276 3.817 -5.797 -9.145 1.00 0.00 C ATOM 770 CG HIS A 276 5.219 -5.752 -9.669 1.00 0.00 C ATOM 771 ND1 HIS A 276 6.075 -4.696 -9.438 1.00 0.00 N ATOM 772 CD2 HIS A 276 5.915 -6.641 -10.417 1.00 0.00 C ATOM 773 CE1 HIS A 276 7.236 -4.936 -10.023 1.00 0.00 C ATOM 774 NE2 HIS A 276 7.165 -6.110 -10.623 1.00 0.00 N ATOM 0 H HIS A 276 1.711 -7.214 -9.716 1.00 0.00 H new ATOM 0 HA HIS A 276 4.327 -7.776 -8.481 1.00 0.00 H new ATOM 0 HB2 HIS A 276 3.126 -5.571 -9.958 1.00 0.00 H new ATOM 0 HB3 HIS A 276 3.693 -5.016 -8.395 1.00 0.00 H new ATOM 0 HD2 HIS A 276 5.554 -7.591 -10.783 1.00 0.00 H new ATOM 0 HE1 HIS A 276 8.096 -4.283 -10.012 1.00 0.00 H new ATOM 0 HE2 HIS A 276 7.916 -6.551 -11.153 1.00 0.00 H new ATOM 783 N GLN A 277 2.054 -7.852 -6.668 1.00 0.00 N ATOM 784 CA GLN A 277 1.478 -7.770 -5.331 1.00 0.00 C ATOM 785 C GLN A 277 2.572 -7.751 -4.269 1.00 0.00 C ATOM 786 O GLN A 277 2.526 -6.954 -3.331 1.00 0.00 O ATOM 787 CB GLN A 277 0.535 -8.950 -5.086 1.00 0.00 C ATOM 788 CG GLN A 277 -0.840 -8.536 -4.585 1.00 0.00 C ATOM 789 CD GLN A 277 -1.243 -9.265 -3.318 1.00 0.00 C ATOM 790 OE1 GLN A 277 -2.310 -9.876 -3.252 1.00 0.00 O ATOM 791 NE2 GLN A 277 -0.388 -9.203 -2.304 1.00 0.00 N ATOM 0 H GLN A 277 1.741 -8.655 -7.214 1.00 0.00 H new ATOM 0 HA GLN A 277 0.912 -6.841 -5.262 1.00 0.00 H new ATOM 0 HB2 GLN A 277 0.421 -9.512 -6.013 1.00 0.00 H new ATOM 0 HB3 GLN A 277 0.990 -9.623 -4.359 1.00 0.00 H new ATOM 0 HG2 GLN A 277 -0.847 -7.462 -4.400 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -1.579 -8.730 -5.362 1.00 0.00 H new ATOM 0 HE21 GLN A 277 0.485 -8.685 -2.404 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -0.604 -9.674 -1.425 1.00 0.00 H new ATOM 800 N GLU A 278 3.556 -8.630 -4.423 1.00 0.00 N ATOM 801 CA GLU A 278 4.663 -8.712 -3.478 1.00 0.00 C ATOM 802 C GLU A 278 5.492 -7.432 -3.501 1.00 0.00 C ATOM 803 O GLU A 278 5.801 -6.861 -2.455 1.00 0.00 O ATOM 804 CB GLU A 278 5.551 -9.914 -3.804 1.00 0.00 C ATOM 805 CG GLU A 278 6.847 -9.949 -3.011 1.00 0.00 C ATOM 806 CD GLU A 278 6.763 -10.856 -1.800 1.00 0.00 C ATOM 807 OE1 GLU A 278 5.723 -10.830 -1.109 1.00 0.00 O ATOM 808 OE2 GLU A 278 7.738 -11.594 -1.542 1.00 0.00 O ATOM 0 H GLU A 278 3.609 -9.296 -5.194 1.00 0.00 H new ATOM 0 HA GLU A 278 4.247 -8.837 -2.478 1.00 0.00 H new ATOM 0 HB2 GLU A 278 4.993 -10.830 -3.611 1.00 0.00 H new ATOM 0 HB3 GLU A 278 5.787 -9.902 -4.868 1.00 0.00 H new ATOM 0 HG2 GLU A 278 7.656 -10.287 -3.658 1.00 0.00 H new ATOM 0 HG3 GLU A 278 7.098 -8.939 -2.687 1.00 0.00 H new ATOM 815 N GLN A 279 5.846 -6.985 -4.702 1.00 0.00 N ATOM 816 CA GLN A 279 6.636 -5.771 -4.864 1.00 0.00 C ATOM 817 C GLN A 279 5.838 -4.545 -4.433 1.00 0.00 C ATOM 818 O GLN A 279 6.336 -3.696 -3.692 1.00 0.00 O ATOM 819 CB GLN A 279 7.084 -5.618 -6.319 1.00 0.00 C ATOM 820 CG GLN A 279 8.361 -6.375 -6.645 1.00 0.00 C ATOM 821 CD GLN A 279 8.095 -7.795 -7.104 1.00 0.00 C ATOM 822 OE1 GLN A 279 7.270 -8.030 -7.987 1.00 0.00 O ATOM 823 NE2 GLN A 279 8.794 -8.752 -6.505 1.00 0.00 N ATOM 0 H GLN A 279 5.598 -7.446 -5.577 1.00 0.00 H new ATOM 0 HA GLN A 279 7.518 -5.852 -4.228 1.00 0.00 H new ATOM 0 HB2 GLN A 279 6.287 -5.968 -6.975 1.00 0.00 H new ATOM 0 HB3 GLN A 279 7.233 -4.560 -6.535 1.00 0.00 H new ATOM 0 HG2 GLN A 279 8.907 -5.842 -7.423 1.00 0.00 H new ATOM 0 HG3 GLN A 279 9.002 -6.396 -5.764 1.00 0.00 H new ATOM 0 HE21 GLN A 279 9.468 -8.512 -5.778 1.00 0.00 H new ATOM 0 HE22 GLN A 279 8.657 -9.727 -6.772 1.00 0.00 H new ATOM 832 N PHE A 280 4.596 -4.459 -4.898 1.00 0.00 N ATOM 833 CA PHE A 280 3.729 -3.339 -4.556 1.00 0.00 C ATOM 834 C PHE A 280 3.605 -3.194 -3.043 1.00 0.00 C ATOM 835 O PHE A 280 3.892 -2.135 -2.484 1.00 0.00 O ATOM 836 CB PHE A 280 2.345 -3.527 -5.178 1.00 0.00 C ATOM 837 CG PHE A 280 1.472 -2.309 -5.079 1.00 0.00 C ATOM 838 CD1 PHE A 280 1.093 -1.812 -3.842 1.00 0.00 C ATOM 839 CD2 PHE A 280 1.030 -1.663 -6.222 1.00 0.00 C ATOM 840 CE1 PHE A 280 0.290 -0.691 -3.747 1.00 0.00 C ATOM 841 CE2 PHE A 280 0.226 -0.542 -6.133 1.00 0.00 C ATOM 842 CZ PHE A 280 -0.144 -0.056 -4.894 1.00 0.00 C ATOM 0 H PHE A 280 4.168 -5.152 -5.512 1.00 0.00 H new ATOM 0 HA PHE A 280 4.176 -2.429 -4.956 1.00 0.00 H new ATOM 0 HB2 PHE A 280 2.461 -3.796 -6.228 1.00 0.00 H new ATOM 0 HB3 PHE A 280 1.846 -4.363 -4.688 1.00 0.00 H new ATOM 0 HD1 PHE A 280 1.429 -2.306 -2.942 1.00 0.00 H new ATOM 0 HD2 PHE A 280 1.317 -2.039 -7.193 1.00 0.00 H new ATOM 0 HE1 PHE A 280 0.002 -0.312 -2.777 1.00 0.00 H new ATOM 0 HE2 PHE A 280 -0.112 -0.047 -7.031 1.00 0.00 H new ATOM 0 HZ PHE A 280 -0.772 0.820 -4.822 1.00 0.00 H new ATOM 852 N ILE A 281 3.182 -4.268 -2.385 1.00 0.00 N ATOM 853 CA ILE A 281 3.029 -4.262 -0.937 1.00 0.00 C ATOM 854 C ILE A 281 4.386 -4.174 -0.253 1.00 0.00 C ATOM 855 O ILE A 281 4.502 -3.671 0.864 1.00 0.00 O ATOM 856 CB ILE A 281 2.295 -5.522 -0.439 1.00 0.00 C ATOM 857 CG1 ILE A 281 1.006 -5.737 -1.234 1.00 0.00 C ATOM 858 CG2 ILE A 281 1.994 -5.406 1.047 1.00 0.00 C ATOM 859 CD1 ILE A 281 -0.099 -4.770 -0.866 1.00 0.00 C ATOM 0 H ILE A 281 2.940 -5.152 -2.832 1.00 0.00 H new ATOM 0 HA ILE A 281 2.432 -3.386 -0.683 1.00 0.00 H new ATOM 0 HB ILE A 281 2.942 -6.386 -0.593 1.00 0.00 H new ATOM 0 HG12 ILE A 281 1.224 -5.640 -2.298 1.00 0.00 H new ATOM 0 HG13 ILE A 281 0.655 -6.756 -1.073 1.00 0.00 H new ATOM 0 HG21 ILE A 281 1.475 -6.303 1.384 1.00 0.00 H new ATOM 0 HG22 ILE A 281 2.927 -5.297 1.600 1.00 0.00 H new ATOM 0 HG23 ILE A 281 1.363 -4.535 1.224 1.00 0.00 H new ATOM 0 HD11 ILE A 281 -0.982 -4.981 -1.469 1.00 0.00 H new ATOM 0 HD12 ILE A 281 -0.345 -4.883 0.190 1.00 0.00 H new ATOM 0 HD13 ILE A 281 0.233 -3.749 -1.054 1.00 0.00 H new ATOM 871 N GLN A 282 5.415 -4.664 -0.939 1.00 0.00 N ATOM 872 CA GLN A 282 6.769 -4.637 -0.404 1.00 0.00 C ATOM 873 C GLN A 282 7.178 -3.209 -0.062 1.00 0.00 C ATOM 874 O GLN A 282 7.723 -2.947 1.012 1.00 0.00 O ATOM 875 CB GLN A 282 7.753 -5.235 -1.412 1.00 0.00 C ATOM 876 CG GLN A 282 9.195 -4.819 -1.175 1.00 0.00 C ATOM 877 CD GLN A 282 10.177 -5.619 -2.009 1.00 0.00 C ATOM 878 OE1 GLN A 282 9.882 -6.735 -2.436 1.00 0.00 O ATOM 879 NE2 GLN A 282 11.353 -5.050 -2.245 1.00 0.00 N ATOM 0 H GLN A 282 5.335 -5.084 -1.865 1.00 0.00 H new ATOM 0 HA GLN A 282 6.790 -5.236 0.506 1.00 0.00 H new ATOM 0 HB2 GLN A 282 7.686 -6.322 -1.371 1.00 0.00 H new ATOM 0 HB3 GLN A 282 7.458 -4.935 -2.417 1.00 0.00 H new ATOM 0 HG2 GLN A 282 9.306 -3.760 -1.406 1.00 0.00 H new ATOM 0 HG3 GLN A 282 9.436 -4.942 -0.119 1.00 0.00 H new ATOM 0 HE21 GLN A 282 11.555 -4.123 -1.871 1.00 0.00 H new ATOM 0 HE22 GLN A 282 12.054 -5.540 -2.800 1.00 0.00 H new ATOM 888 N MET A 283 6.905 -2.288 -0.980 1.00 0.00 N ATOM 889 CA MET A 283 7.237 -0.882 -0.779 1.00 0.00 C ATOM 890 C MET A 283 6.234 -0.222 0.163 1.00 0.00 C ATOM 891 O MET A 283 6.600 0.618 0.984 1.00 0.00 O ATOM 892 CB MET A 283 7.263 -0.144 -2.118 1.00 0.00 C ATOM 893 CG MET A 283 8.639 -0.102 -2.761 1.00 0.00 C ATOM 894 SD MET A 283 9.235 -1.736 -3.234 1.00 0.00 S ATOM 895 CE MET A 283 8.857 -1.742 -4.984 1.00 0.00 C ATOM 0 H MET A 283 6.454 -2.490 -1.872 1.00 0.00 H new ATOM 0 HA MET A 283 8.227 -0.826 -0.327 1.00 0.00 H new ATOM 0 HB2 MET A 283 6.565 -0.626 -2.803 1.00 0.00 H new ATOM 0 HB3 MET A 283 6.909 0.876 -1.968 1.00 0.00 H new ATOM 0 HG2 MET A 283 8.604 0.537 -3.643 1.00 0.00 H new ATOM 0 HG3 MET A 283 9.346 0.352 -2.067 1.00 0.00 H new ATOM 0 HE1 MET A 283 9.168 -2.691 -5.420 1.00 0.00 H new ATOM 0 HE2 MET A 283 7.784 -1.612 -5.125 1.00 0.00 H new ATOM 0 HE3 MET A 283 9.388 -0.926 -5.474 1.00 0.00 H new ATOM 905 N LEU A 284 4.969 -0.611 0.038 1.00 0.00 N ATOM 906 CA LEU A 284 3.915 -0.060 0.881 1.00 0.00 C ATOM 907 C LEU A 284 4.407 0.108 2.313 1.00 0.00 C ATOM 908 O LEU A 284 4.068 1.079 2.989 1.00 0.00 O ATOM 909 CB LEU A 284 2.685 -0.970 0.854 1.00 0.00 C ATOM 910 CG LEU A 284 1.345 -0.251 1.008 1.00 0.00 C ATOM 911 CD1 LEU A 284 1.231 0.375 2.388 1.00 0.00 C ATOM 912 CD2 LEU A 284 1.180 0.805 -0.075 1.00 0.00 C ATOM 0 H LEU A 284 4.650 -1.305 -0.638 1.00 0.00 H new ATOM 0 HA LEU A 284 3.640 0.920 0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 284 2.679 -1.520 -0.087 1.00 0.00 H new ATOM 0 HB3 LEU A 284 2.779 -1.706 1.652 1.00 0.00 H new ATOM 0 HG LEU A 284 0.546 -0.984 0.898 1.00 0.00 H new ATOM 0 HD11 LEU A 284 0.271 0.882 2.479 1.00 0.00 H new ATOM 0 HD12 LEU A 284 1.304 -0.403 3.148 1.00 0.00 H new ATOM 0 HD13 LEU A 284 2.037 1.096 2.528 1.00 0.00 H new ATOM 0 HD21 LEU A 284 0.221 1.307 0.050 1.00 0.00 H new ATOM 0 HD22 LEU A 284 1.985 1.536 0.004 1.00 0.00 H new ATOM 0 HD23 LEU A 284 1.216 0.330 -1.055 1.00 0.00 H new ATOM 924 N ASN A 285 5.217 -0.844 2.766 1.00 0.00 N ATOM 925 CA ASN A 285 5.766 -0.804 4.115 1.00 0.00 C ATOM 926 C ASN A 285 7.085 -0.038 4.140 1.00 0.00 C ATOM 927 O ASN A 285 8.000 -0.383 4.886 1.00 0.00 O ATOM 928 CB ASN A 285 5.977 -2.224 4.645 1.00 0.00 C ATOM 929 CG ASN A 285 4.670 -2.964 4.853 1.00 0.00 C ATOM 930 OD1 ASN A 285 4.480 -4.068 4.344 1.00 0.00 O ATOM 931 ND2 ASN A 285 3.759 -2.356 5.603 1.00 0.00 N ATOM 0 H ASN A 285 5.507 -1.653 2.217 1.00 0.00 H new ATOM 0 HA ASN A 285 5.053 -0.287 4.757 1.00 0.00 H new ATOM 0 HB2 ASN A 285 6.599 -2.781 3.945 1.00 0.00 H new ATOM 0 HB3 ASN A 285 6.520 -2.180 5.589 1.00 0.00 H new ATOM 0 HD21 ASN A 285 2.859 -2.804 5.777 1.00 0.00 H new ATOM 0 HD22 ASN A 285 3.959 -1.440 6.006 1.00 0.00 H new ATOM 938 N GLU A 286 7.173 1.002 3.314 1.00 0.00 N ATOM 939 CA GLU A 286 8.376 1.824 3.232 1.00 0.00 C ATOM 940 C GLU A 286 9.069 1.921 4.588 1.00 0.00 C ATOM 941 O GLU A 286 8.596 2.609 5.492 1.00 0.00 O ATOM 942 CB GLU A 286 8.025 3.225 2.726 1.00 0.00 C ATOM 943 CG GLU A 286 9.090 4.267 3.031 1.00 0.00 C ATOM 944 CD GLU A 286 10.432 3.927 2.411 1.00 0.00 C ATOM 945 OE1 GLU A 286 10.531 2.872 1.751 1.00 0.00 O ATOM 946 OE2 GLU A 286 11.382 4.718 2.583 1.00 0.00 O ATOM 0 H GLU A 286 6.422 1.296 2.690 1.00 0.00 H new ATOM 0 HA GLU A 286 9.061 1.349 2.530 1.00 0.00 H new ATOM 0 HB2 GLU A 286 7.867 3.184 1.648 1.00 0.00 H new ATOM 0 HB3 GLU A 286 7.083 3.539 3.175 1.00 0.00 H new ATOM 0 HG2 GLU A 286 8.759 5.238 2.663 1.00 0.00 H new ATOM 0 HG3 GLU A 286 9.205 4.358 4.111 1.00 0.00 H new ATOM 953 N PRO A 287 10.207 1.228 4.743 1.00 0.00 N ATOM 954 CA PRO A 287 10.975 1.231 5.992 1.00 0.00 C ATOM 955 C PRO A 287 11.601 2.591 6.282 1.00 0.00 C ATOM 956 O PRO A 287 12.346 3.130 5.463 1.00 0.00 O ATOM 957 CB PRO A 287 12.062 0.181 5.748 1.00 0.00 C ATOM 958 CG PRO A 287 12.201 0.115 4.266 1.00 0.00 C ATOM 959 CD PRO A 287 10.832 0.386 3.709 1.00 0.00 C ATOM 0 HA PRO A 287 10.347 1.016 6.856 1.00 0.00 H new ATOM 0 HB2 PRO A 287 13.001 0.467 6.221 1.00 0.00 H new ATOM 0 HB3 PRO A 287 11.778 -0.786 6.162 1.00 0.00 H new ATOM 0 HG2 PRO A 287 12.921 0.852 3.908 1.00 0.00 H new ATOM 0 HG3 PRO A 287 12.564 -0.864 3.951 1.00 0.00 H new ATOM 0 HD2 PRO A 287 10.883 0.899 2.749 1.00 0.00 H new ATOM 0 HD3 PRO A 287 10.273 -0.536 3.549 1.00 0.00 H new ATOM 967 N PRO A 288 11.306 3.162 7.458 1.00 0.00 N ATOM 968 CA PRO A 288 11.841 4.465 7.863 1.00 0.00 C ATOM 969 C PRO A 288 13.318 4.397 8.234 1.00 0.00 C ATOM 970 O PRO A 288 13.695 3.737 9.204 1.00 0.00 O ATOM 971 CB PRO A 288 10.997 4.825 9.086 1.00 0.00 C ATOM 972 CG PRO A 288 10.584 3.513 9.657 1.00 0.00 C ATOM 973 CD PRO A 288 10.426 2.579 8.487 1.00 0.00 C ATOM 0 HA PRO A 288 11.787 5.198 7.058 1.00 0.00 H new ATOM 0 HB2 PRO A 288 11.571 5.408 9.806 1.00 0.00 H new ATOM 0 HB3 PRO A 288 10.132 5.426 8.807 1.00 0.00 H new ATOM 0 HG2 PRO A 288 11.333 3.139 10.356 1.00 0.00 H new ATOM 0 HG3 PRO A 288 9.650 3.606 10.210 1.00 0.00 H new ATOM 0 HD2 PRO A 288 10.726 1.562 8.742 1.00 0.00 H new ATOM 0 HD3 PRO A 288 9.391 2.531 8.149 1.00 0.00 H new TER 981 PRO A 288