USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 755 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 85 THR OG1 : rot -43:sc= 1.15 USER MOD Set 1.2: A 106 HIS : no HD1:sc= -1.13 X(o=0.021,f=-0.26) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.0033) USER MOD Single : A 39 ASN : amide:sc= -3.8! C(o=-3.8!,f=-9.8!) USER MOD Single : A 43 THR OG1 : rot -67:sc= 1.1 USER MOD Single : A 49 THR OG1 : rot 86:sc= 1.23 USER MOD Single : A 52 SER OG : rot 66:sc= -1.36! USER MOD Single : A 54 TYR OH : rot 180:sc= -0.102 USER MOD Single : A 63 SER OG : rot 178:sc= 1.38 USER MOD Single : A 72 GLN : amide:sc= -0.0695 K(o=-0.07,f=-1.4!) USER MOD Single : A 76 TYR OH : rot 3:sc= 1.46 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot -24:sc= 0.299 USER MOD Single : A 82 GLN : amide:sc= -0.763 K(o=-0.76,f=-3.1!) USER MOD Single : A 84 SER OG : rot 160:sc= -2.25! USER MOD Single : A 91 ASN : amide:sc= -0.969 X(o=-0.97,f=-1.4) USER MOD Single : A 93 ASN : amide:sc= -1.1 K(o=-1.1,f=-3.1!) USER MOD Single : A 96 LYS NZ :NH3+ -166:sc= 0.983 (180deg=0.849) USER MOD Single : A 103 LYS NZ :NH3+ 140:sc= 0.4 (180deg=-0.236) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : B 227 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 244 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 248 LYS NZ :NH3+ -172:sc= -0.122 (180deg=-0.466!) USER MOD Single : B 249 GLN :FLIP amide:sc= -2.65! C(o=-4.2!,f=-2.6!) USER MOD Single : B 250 ASN : amide:sc= 0.453 K(o=0.45,f=-0.089) USER MOD Single : B 253 ASN : amide:sc= -0.0848 X(o=-0.085,f=-0.15) USER MOD ----------------------------------------------------------------- ATOM 101 N ALA A 31 3.991 8.850 4.260 1.00 0.00 N ATOM 102 CA ALA A 31 2.980 8.326 3.365 1.00 0.00 C ATOM 103 C ALA A 31 2.810 6.826 3.525 1.00 0.00 C ATOM 104 O ALA A 31 2.319 6.162 2.620 1.00 0.00 O ATOM 105 CB ALA A 31 3.402 8.626 1.946 1.00 0.00 C ATOM 0 HA ALA A 31 2.026 8.797 3.603 1.00 0.00 H new ATOM 0 HB1 ALA A 31 2.654 8.239 1.254 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.495 9.704 1.814 1.00 0.00 H new ATOM 0 HB3 ALA A 31 4.362 8.151 1.744 1.00 0.00 H new ATOM 111 N TYR A 32 3.193 6.308 4.655 1.00 0.00 N ATOM 112 CA TYR A 32 3.134 4.881 4.876 1.00 0.00 C ATOM 113 C TYR A 32 1.834 4.500 5.553 1.00 0.00 C ATOM 114 O TYR A 32 1.301 5.266 6.371 1.00 0.00 O ATOM 115 CB TYR A 32 4.314 4.412 5.735 1.00 0.00 C ATOM 116 CG TYR A 32 5.689 4.741 5.183 1.00 0.00 C ATOM 117 CD1 TYR A 32 5.896 4.927 3.827 1.00 0.00 C ATOM 118 CD2 TYR A 32 6.782 4.855 6.027 1.00 0.00 C ATOM 119 CE1 TYR A 32 7.138 5.212 3.329 1.00 0.00 C ATOM 120 CE2 TYR A 32 8.037 5.135 5.531 1.00 0.00 C ATOM 121 CZ TYR A 32 8.202 5.313 4.177 1.00 0.00 C ATOM 122 OH TYR A 32 9.442 5.571 3.664 1.00 0.00 O ATOM 0 H TYR A 32 3.551 6.848 5.443 1.00 0.00 H new ATOM 0 HA TYR A 32 3.188 4.392 3.904 1.00 0.00 H new ATOM 0 HB2 TYR A 32 4.222 4.859 6.725 1.00 0.00 H new ATOM 0 HB3 TYR A 32 4.241 3.332 5.864 1.00 0.00 H new ATOM 0 HD1 TYR A 32 5.060 4.845 3.148 1.00 0.00 H new ATOM 0 HD2 TYR A 32 6.648 4.722 7.090 1.00 0.00 H new ATOM 0 HE1 TYR A 32 7.276 5.357 2.268 1.00 0.00 H new ATOM 0 HE2 TYR A 32 8.882 5.214 6.199 1.00 0.00 H new ATOM 0 HH TYR A 32 10.095 5.615 4.393 1.00 0.00 H new ATOM 132 N ILE A 33 1.323 3.337 5.203 1.00 0.00 N ATOM 133 CA ILE A 33 0.127 2.782 5.804 1.00 0.00 C ATOM 134 C ILE A 33 0.252 1.284 5.927 1.00 0.00 C ATOM 135 O ILE A 33 1.104 0.661 5.280 1.00 0.00 O ATOM 136 CB ILE A 33 -1.179 3.087 5.021 1.00 0.00 C ATOM 137 CG1 ILE A 33 -1.042 2.694 3.545 1.00 0.00 C ATOM 138 CG2 ILE A 33 -1.591 4.540 5.178 1.00 0.00 C ATOM 139 CD1 ILE A 33 -2.324 2.791 2.762 1.00 0.00 C ATOM 0 H ILE A 33 1.733 2.742 4.483 1.00 0.00 H new ATOM 0 HA ILE A 33 0.049 3.264 6.779 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.975 2.478 5.450 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.294 3.334 3.078 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.669 1.672 3.485 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.508 4.721 4.618 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.761 4.758 6.232 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.800 5.186 4.797 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -2.142 2.496 1.728 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -3.070 2.129 3.202 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -2.689 3.818 2.788 1.00 0.00 H new ATOM 151 N TYR A 34 -0.576 0.735 6.757 1.00 0.00 N ATOM 152 CA TYR A 34 -0.665 -0.663 6.994 1.00 0.00 C ATOM 153 C TYR A 34 -2.004 -1.145 6.519 1.00 0.00 C ATOM 154 O TYR A 34 -3.044 -0.601 6.917 1.00 0.00 O ATOM 155 CB TYR A 34 -0.505 -0.948 8.499 1.00 0.00 C ATOM 156 CG TYR A 34 -0.982 -2.307 8.949 1.00 0.00 C ATOM 157 CD1 TYR A 34 -0.252 -3.453 8.699 1.00 0.00 C ATOM 158 CD2 TYR A 34 -2.178 -2.423 9.630 1.00 0.00 C ATOM 159 CE1 TYR A 34 -0.710 -4.689 9.118 1.00 0.00 C ATOM 160 CE2 TYR A 34 -2.646 -3.644 10.054 1.00 0.00 C ATOM 161 CZ TYR A 34 -1.910 -4.775 9.797 1.00 0.00 C ATOM 162 OH TYR A 34 -2.372 -6.005 10.223 1.00 0.00 O ATOM 0 H TYR A 34 -1.238 1.278 7.312 1.00 0.00 H new ATOM 0 HA TYR A 34 0.127 -1.184 6.455 1.00 0.00 H new ATOM 0 HB2 TYR A 34 0.548 -0.844 8.762 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -1.050 -0.186 9.057 1.00 0.00 H new ATOM 0 HD1 TYR A 34 0.687 -3.383 8.170 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -2.758 -1.535 9.834 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -0.134 -5.580 8.916 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.584 -3.713 10.585 1.00 0.00 H new ATOM 0 HH TYR A 34 -3.229 -5.891 10.685 1.00 0.00 H new ATOM 172 N ILE A 35 -1.988 -2.108 5.660 1.00 0.00 N ATOM 173 CA ILE A 35 -3.195 -2.723 5.211 1.00 0.00 C ATOM 174 C ILE A 35 -3.217 -4.114 5.809 1.00 0.00 C ATOM 175 O ILE A 35 -2.250 -4.861 5.672 1.00 0.00 O ATOM 176 CB ILE A 35 -3.210 -2.859 3.680 1.00 0.00 C ATOM 177 CG1 ILE A 35 -2.787 -1.559 3.030 1.00 0.00 C ATOM 178 CG2 ILE A 35 -4.631 -3.191 3.227 1.00 0.00 C ATOM 179 CD1 ILE A 35 -2.135 -1.749 1.686 1.00 0.00 C ATOM 0 H ILE A 35 -1.138 -2.493 5.248 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.053 -2.121 5.510 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.517 -3.648 3.388 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.661 -0.917 2.915 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.095 -1.039 3.692 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.653 -3.290 2.142 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.949 -4.129 3.683 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.306 -2.392 3.532 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.857 -0.778 1.276 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.243 -2.365 1.798 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.833 -2.242 1.009 1.00 0.00 H new ATOM 191 N GLY A 36 -4.274 -4.446 6.452 1.00 0.00 N ATOM 192 CA GLY A 36 -4.407 -5.724 7.076 1.00 0.00 C ATOM 193 C GLY A 36 -5.677 -6.387 6.652 1.00 0.00 C ATOM 194 O GLY A 36 -6.563 -5.716 6.109 1.00 0.00 O ATOM 0 H GLY A 36 -5.084 -3.837 6.566 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.557 -6.353 6.813 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.395 -5.608 8.160 1.00 0.00 H new ATOM 198 N ASN A 37 -5.767 -7.689 6.898 1.00 0.00 N ATOM 199 CA ASN A 37 -6.919 -8.527 6.515 1.00 0.00 C ATOM 200 C ASN A 37 -6.964 -8.737 5.027 1.00 0.00 C ATOM 201 O ASN A 37 -8.031 -8.810 4.422 1.00 0.00 O ATOM 202 CB ASN A 37 -8.272 -8.000 7.033 1.00 0.00 C ATOM 203 CG ASN A 37 -8.459 -8.177 8.518 1.00 0.00 C ATOM 204 OD1 ASN A 37 -8.120 -7.305 9.316 1.00 0.00 O ATOM 205 ND2 ASN A 37 -8.996 -9.302 8.912 1.00 0.00 N ATOM 0 H ASN A 37 -5.033 -8.210 7.378 1.00 0.00 H new ATOM 0 HA ASN A 37 -6.761 -9.487 7.006 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -8.358 -6.941 6.788 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -9.078 -8.515 6.510 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.144 -9.476 9.906 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.267 -10.006 8.225 1.00 0.00 H new ATOM 212 N LEU A 38 -5.796 -8.874 4.441 1.00 0.00 N ATOM 213 CA LEU A 38 -5.677 -9.151 3.025 1.00 0.00 C ATOM 214 C LEU A 38 -6.140 -10.541 2.706 1.00 0.00 C ATOM 215 O LEU A 38 -6.124 -11.439 3.558 1.00 0.00 O ATOM 216 CB LEU A 38 -4.236 -8.974 2.504 1.00 0.00 C ATOM 217 CG LEU A 38 -3.858 -7.608 1.942 1.00 0.00 C ATOM 218 CD1 LEU A 38 -4.672 -7.311 0.703 1.00 0.00 C ATOM 219 CD2 LEU A 38 -4.058 -6.528 2.961 1.00 0.00 C ATOM 0 H LEU A 38 -4.904 -8.797 4.929 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.314 -8.423 2.523 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.552 -9.204 3.321 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.065 -9.718 1.726 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.801 -7.633 1.678 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.394 -6.333 0.310 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.478 -8.073 -0.051 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.732 -7.312 0.955 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.780 -5.566 2.531 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.105 -6.502 3.263 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.435 -6.730 3.832 1.00 0.00 H new ATOM 231 N ASN A 39 -6.569 -10.708 1.499 1.00 0.00 N ATOM 232 CA ASN A 39 -6.966 -11.988 1.000 1.00 0.00 C ATOM 233 C ASN A 39 -5.747 -12.598 0.357 1.00 0.00 C ATOM 234 O ASN A 39 -4.877 -11.871 -0.148 1.00 0.00 O ATOM 235 CB ASN A 39 -8.059 -11.827 -0.056 1.00 0.00 C ATOM 236 CG ASN A 39 -8.816 -13.111 -0.343 1.00 0.00 C ATOM 237 OD1 ASN A 39 -8.318 -14.207 -0.137 1.00 0.00 O ATOM 238 ND2 ASN A 39 -9.973 -12.980 -0.894 1.00 0.00 N ATOM 0 H ASN A 39 -6.656 -9.951 0.821 1.00 0.00 H new ATOM 0 HA ASN A 39 -7.355 -12.612 1.805 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -8.764 -11.065 0.275 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -7.610 -11.465 -0.981 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -10.502 -13.807 -1.172 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -10.360 -12.050 -1.052 1.00 0.00 H new ATOM 245 N ARG A 40 -5.696 -13.900 0.326 1.00 0.00 N ATOM 246 CA ARG A 40 -4.586 -14.617 -0.240 1.00 0.00 C ATOM 247 C ARG A 40 -4.527 -14.401 -1.750 1.00 0.00 C ATOM 248 O ARG A 40 -3.466 -14.504 -2.357 1.00 0.00 O ATOM 249 CB ARG A 40 -4.659 -16.122 0.157 1.00 0.00 C ATOM 250 CG ARG A 40 -5.870 -16.917 -0.363 1.00 0.00 C ATOM 251 CD ARG A 40 -5.677 -17.321 -1.812 1.00 0.00 C ATOM 252 NE ARG A 40 -6.771 -18.114 -2.347 1.00 0.00 N ATOM 253 CZ ARG A 40 -6.618 -19.094 -3.242 1.00 0.00 C ATOM 254 NH1 ARG A 40 -5.387 -19.473 -3.624 1.00 0.00 N ATOM 255 NH2 ARG A 40 -7.687 -19.714 -3.740 1.00 0.00 N ATOM 0 H ARG A 40 -6.432 -14.501 0.697 1.00 0.00 H new ATOM 0 HA ARG A 40 -3.653 -14.228 0.167 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -3.753 -16.612 -0.199 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -4.651 -16.188 1.245 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.015 -17.807 0.250 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -6.773 -16.314 -0.268 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -5.561 -16.423 -2.418 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -4.751 -17.888 -1.902 1.00 0.00 H new ATOM 0 HE ARG A 40 -7.715 -17.910 -2.019 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -4.566 -19.012 -3.231 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -5.273 -20.222 -4.307 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -8.622 -19.440 -3.438 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -7.570 -20.462 -4.423 1.00 0.00 H new ATOM 269 N GLU A 41 -5.677 -14.059 -2.333 1.00 0.00 N ATOM 270 CA GLU A 41 -5.777 -13.860 -3.776 1.00 0.00 C ATOM 271 C GLU A 41 -5.505 -12.412 -4.154 1.00 0.00 C ATOM 272 O GLU A 41 -5.365 -12.095 -5.328 1.00 0.00 O ATOM 273 CB GLU A 41 -7.160 -14.261 -4.296 1.00 0.00 C ATOM 274 CG GLU A 41 -8.292 -13.433 -3.734 1.00 0.00 C ATOM 275 CD GLU A 41 -9.621 -13.785 -4.331 1.00 0.00 C ATOM 276 OE1 GLU A 41 -10.173 -14.840 -3.987 1.00 0.00 O ATOM 277 OE2 GLU A 41 -10.131 -13.018 -5.185 1.00 0.00 O ATOM 0 H GLU A 41 -6.551 -13.915 -1.827 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.022 -14.497 -4.236 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -7.167 -14.177 -5.383 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -7.337 -15.310 -4.057 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -8.336 -13.572 -2.654 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -8.087 -12.377 -3.912 1.00 0.00 H new ATOM 284 N LEU A 42 -5.451 -11.538 -3.167 1.00 0.00 N ATOM 285 CA LEU A 42 -5.236 -10.138 -3.436 1.00 0.00 C ATOM 286 C LEU A 42 -3.798 -9.867 -3.740 1.00 0.00 C ATOM 287 O LEU A 42 -2.900 -10.157 -2.939 1.00 0.00 O ATOM 288 CB LEU A 42 -5.777 -9.234 -2.323 1.00 0.00 C ATOM 289 CG LEU A 42 -7.302 -9.079 -2.282 1.00 0.00 C ATOM 290 CD1 LEU A 42 -7.729 -8.247 -1.092 1.00 0.00 C ATOM 291 CD2 LEU A 42 -7.806 -8.439 -3.566 1.00 0.00 C ATOM 0 H LEU A 42 -5.553 -11.775 -2.180 1.00 0.00 H new ATOM 0 HA LEU A 42 -5.813 -9.887 -4.326 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -5.443 -9.629 -1.363 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -5.331 -8.245 -2.433 1.00 0.00 H new ATOM 0 HG LEU A 42 -7.738 -10.073 -2.185 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.815 -8.152 -1.085 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -7.402 -8.732 -0.173 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -7.278 -7.257 -1.160 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.890 -8.336 -3.520 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -7.353 -7.455 -3.684 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.537 -9.067 -4.415 1.00 0.00 H new ATOM 303 N THR A 43 -3.585 -9.357 -4.902 1.00 0.00 N ATOM 304 CA THR A 43 -2.280 -9.083 -5.395 1.00 0.00 C ATOM 305 C THR A 43 -1.988 -7.602 -5.276 1.00 0.00 C ATOM 306 O THR A 43 -2.877 -6.806 -4.914 1.00 0.00 O ATOM 307 CB THR A 43 -2.151 -9.525 -6.873 1.00 0.00 C ATOM 308 OG1 THR A 43 -3.142 -8.850 -7.681 1.00 0.00 O ATOM 309 CG2 THR A 43 -2.327 -11.034 -7.008 1.00 0.00 C ATOM 0 H THR A 43 -4.332 -9.113 -5.553 1.00 0.00 H new ATOM 0 HA THR A 43 -1.559 -9.644 -4.800 1.00 0.00 H new ATOM 0 HB THR A 43 -1.153 -9.257 -7.220 1.00 0.00 H new ATOM 0 HG1 THR A 43 -4.037 -9.159 -7.427 1.00 0.00 H new ATOM 0 HG21 THR A 43 -2.232 -11.319 -8.056 1.00 0.00 H new ATOM 0 HG22 THR A 43 -1.562 -11.543 -6.422 1.00 0.00 H new ATOM 0 HG23 THR A 43 -3.313 -11.319 -6.642 1.00 0.00 H new ATOM 317 N GLU A 44 -0.761 -7.227 -5.574 1.00 0.00 N ATOM 318 CA GLU A 44 -0.347 -5.841 -5.548 1.00 0.00 C ATOM 319 C GLU A 44 -1.127 -5.105 -6.598 1.00 0.00 C ATOM 320 O GLU A 44 -1.499 -3.976 -6.402 1.00 0.00 O ATOM 321 CB GLU A 44 1.147 -5.665 -5.848 1.00 0.00 C ATOM 322 CG GLU A 44 2.054 -6.729 -5.276 1.00 0.00 C ATOM 323 CD GLU A 44 2.158 -7.922 -6.194 1.00 0.00 C ATOM 324 OE1 GLU A 44 1.275 -8.806 -6.166 1.00 0.00 O ATOM 325 OE2 GLU A 44 3.111 -7.979 -6.980 1.00 0.00 O ATOM 0 H GLU A 44 -0.022 -7.877 -5.842 1.00 0.00 H new ATOM 0 HA GLU A 44 -0.531 -5.454 -4.546 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.282 -5.640 -6.929 1.00 0.00 H new ATOM 0 HB3 GLU A 44 1.465 -4.696 -5.464 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.046 -6.310 -5.108 1.00 0.00 H new ATOM 0 HG3 GLU A 44 1.675 -7.048 -4.305 1.00 0.00 H new ATOM 332 N GLY A 45 -1.403 -5.799 -7.702 1.00 0.00 N ATOM 333 CA GLY A 45 -2.178 -5.239 -8.783 1.00 0.00 C ATOM 334 C GLY A 45 -3.552 -4.824 -8.319 1.00 0.00 C ATOM 335 O GLY A 45 -4.051 -3.772 -8.712 1.00 0.00 O ATOM 0 H GLY A 45 -1.093 -6.758 -7.861 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.656 -4.376 -9.197 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.269 -5.972 -9.585 1.00 0.00 H new ATOM 339 N ASP A 46 -4.155 -5.633 -7.448 1.00 0.00 N ATOM 340 CA ASP A 46 -5.469 -5.306 -6.897 1.00 0.00 C ATOM 341 C ASP A 46 -5.363 -4.105 -6.011 1.00 0.00 C ATOM 342 O ASP A 46 -6.090 -3.125 -6.184 1.00 0.00 O ATOM 343 CB ASP A 46 -6.060 -6.452 -6.066 1.00 0.00 C ATOM 344 CG ASP A 46 -6.362 -7.697 -6.842 1.00 0.00 C ATOM 345 OD1 ASP A 46 -7.408 -7.743 -7.532 1.00 0.00 O ATOM 346 OD2 ASP A 46 -5.580 -8.678 -6.743 1.00 0.00 O ATOM 0 H ASP A 46 -3.759 -6.511 -7.112 1.00 0.00 H new ATOM 0 HA ASP A 46 -6.125 -5.117 -7.747 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -5.363 -6.699 -5.266 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.978 -6.104 -5.593 1.00 0.00 H new ATOM 351 N ILE A 47 -4.404 -4.159 -5.102 1.00 0.00 N ATOM 352 CA ILE A 47 -4.190 -3.101 -4.142 1.00 0.00 C ATOM 353 C ILE A 47 -3.877 -1.784 -4.839 1.00 0.00 C ATOM 354 O ILE A 47 -4.505 -0.780 -4.566 1.00 0.00 O ATOM 355 CB ILE A 47 -3.065 -3.457 -3.127 1.00 0.00 C ATOM 356 CG1 ILE A 47 -3.485 -4.652 -2.258 1.00 0.00 C ATOM 357 CG2 ILE A 47 -2.697 -2.259 -2.262 1.00 0.00 C ATOM 358 CD1 ILE A 47 -2.481 -5.015 -1.184 1.00 0.00 C ATOM 0 H ILE A 47 -3.754 -4.940 -5.013 1.00 0.00 H new ATOM 0 HA ILE A 47 -5.118 -2.987 -3.582 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.177 -3.737 -3.694 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -4.441 -4.427 -1.786 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.643 -5.518 -2.901 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.909 -2.542 -1.564 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.345 -1.446 -2.897 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.574 -1.930 -1.704 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -2.850 -5.867 -0.614 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.529 -5.274 -1.648 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -2.340 -4.165 -0.516 1.00 0.00 H new ATOM 370 N LEU A 48 -2.978 -1.832 -5.795 1.00 0.00 N ATOM 371 CA LEU A 48 -2.529 -0.644 -6.506 1.00 0.00 C ATOM 372 C LEU A 48 -3.661 0.024 -7.208 1.00 0.00 C ATOM 373 O LEU A 48 -3.820 1.224 -7.104 1.00 0.00 O ATOM 374 CB LEU A 48 -1.440 -0.984 -7.511 1.00 0.00 C ATOM 375 CG LEU A 48 -0.043 -1.211 -6.955 1.00 0.00 C ATOM 376 CD1 LEU A 48 0.855 -1.775 -8.039 1.00 0.00 C ATOM 377 CD2 LEU A 48 0.533 0.101 -6.432 1.00 0.00 C ATOM 0 H LEU A 48 -2.533 -2.695 -6.107 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.122 0.040 -5.762 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.742 -1.883 -8.049 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.388 -0.177 -8.242 1.00 0.00 H new ATOM 0 HG LEU A 48 -0.100 -1.923 -6.131 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.855 -1.936 -7.636 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.449 -2.723 -8.391 1.00 0.00 H new ATOM 0 HD13 LEU A 48 0.908 -1.072 -8.870 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.534 -0.073 -6.036 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.585 0.825 -7.245 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.108 0.490 -5.641 1.00 0.00 H new ATOM 389 N THR A 49 -4.464 -0.759 -7.878 1.00 0.00 N ATOM 390 CA THR A 49 -5.574 -0.246 -8.623 1.00 0.00 C ATOM 391 C THR A 49 -6.598 0.440 -7.707 1.00 0.00 C ATOM 392 O THR A 49 -7.055 1.555 -7.997 1.00 0.00 O ATOM 393 CB THR A 49 -6.249 -1.379 -9.390 1.00 0.00 C ATOM 394 OG1 THR A 49 -5.288 -2.012 -10.258 1.00 0.00 O ATOM 395 CG2 THR A 49 -7.404 -0.838 -10.190 1.00 0.00 C ATOM 0 H THR A 49 -4.363 -1.773 -7.920 1.00 0.00 H new ATOM 0 HA THR A 49 -5.194 0.499 -9.322 1.00 0.00 H new ATOM 0 HB THR A 49 -6.631 -2.119 -8.686 1.00 0.00 H new ATOM 0 HG1 THR A 49 -4.805 -2.705 -9.761 1.00 0.00 H new ATOM 0 HG21 THR A 49 -7.882 -1.652 -10.735 1.00 0.00 H new ATOM 0 HG22 THR A 49 -8.128 -0.377 -9.518 1.00 0.00 H new ATOM 0 HG23 THR A 49 -7.040 -0.092 -10.897 1.00 0.00 H new ATOM 403 N VAL A 50 -6.918 -0.213 -6.605 1.00 0.00 N ATOM 404 CA VAL A 50 -7.883 0.303 -5.655 1.00 0.00 C ATOM 405 C VAL A 50 -7.349 1.557 -4.965 1.00 0.00 C ATOM 406 O VAL A 50 -8.012 2.587 -4.933 1.00 0.00 O ATOM 407 CB VAL A 50 -8.270 -0.782 -4.615 1.00 0.00 C ATOM 408 CG1 VAL A 50 -9.208 -0.227 -3.566 1.00 0.00 C ATOM 409 CG2 VAL A 50 -8.910 -1.972 -5.316 1.00 0.00 C ATOM 0 H VAL A 50 -6.517 -1.114 -6.345 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.784 0.579 -6.203 1.00 0.00 H new ATOM 0 HB VAL A 50 -7.360 -1.109 -4.112 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -9.461 -1.011 -2.852 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -8.722 0.597 -3.043 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -10.118 0.134 -4.046 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.178 -2.728 -4.578 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -9.807 -1.645 -5.843 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.204 -2.396 -6.030 1.00 0.00 H new ATOM 419 N PHE A 51 -6.123 1.468 -4.492 1.00 0.00 N ATOM 420 CA PHE A 51 -5.456 2.534 -3.795 1.00 0.00 C ATOM 421 C PHE A 51 -5.238 3.750 -4.679 1.00 0.00 C ATOM 422 O PHE A 51 -5.211 4.886 -4.208 1.00 0.00 O ATOM 423 CB PHE A 51 -4.172 2.011 -3.162 1.00 0.00 C ATOM 424 CG PHE A 51 -4.437 1.197 -1.892 1.00 0.00 C ATOM 425 CD1 PHE A 51 -5.402 0.196 -1.856 1.00 0.00 C ATOM 426 CD2 PHE A 51 -3.723 1.443 -0.744 1.00 0.00 C ATOM 427 CE1 PHE A 51 -5.633 -0.530 -0.714 1.00 0.00 C ATOM 428 CE2 PHE A 51 -3.949 0.725 0.398 1.00 0.00 C ATOM 429 CZ PHE A 51 -4.900 -0.264 0.423 1.00 0.00 C ATOM 0 H PHE A 51 -5.553 0.628 -4.587 1.00 0.00 H new ATOM 0 HA PHE A 51 -6.101 2.885 -2.990 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -3.641 1.391 -3.884 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -3.520 2.851 -2.923 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -5.981 -0.014 -2.743 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -2.970 2.217 -0.743 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -6.385 -1.305 -0.706 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -3.374 0.938 1.287 1.00 0.00 H new ATOM 0 HZ PHE A 51 -5.073 -0.830 1.327 1.00 0.00 H new ATOM 439 N SER A 52 -5.180 3.514 -5.975 1.00 0.00 N ATOM 440 CA SER A 52 -5.044 4.577 -6.935 1.00 0.00 C ATOM 441 C SER A 52 -6.288 5.473 -7.010 1.00 0.00 C ATOM 442 O SER A 52 -6.200 6.592 -7.494 1.00 0.00 O ATOM 443 CB SER A 52 -4.689 4.038 -8.298 1.00 0.00 C ATOM 444 OG SER A 52 -3.392 3.487 -8.311 1.00 0.00 O ATOM 0 H SER A 52 -5.226 2.581 -6.385 1.00 0.00 H new ATOM 0 HA SER A 52 -4.224 5.205 -6.586 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.412 3.277 -8.590 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.754 4.838 -9.035 1.00 0.00 H new ATOM 0 HG SER A 52 -3.369 2.691 -7.740 1.00 0.00 H new ATOM 450 N GLU A 53 -7.447 4.994 -6.547 1.00 0.00 N ATOM 451 CA GLU A 53 -8.631 5.867 -6.503 1.00 0.00 C ATOM 452 C GLU A 53 -8.391 7.002 -5.483 1.00 0.00 C ATOM 453 O GLU A 53 -8.852 8.138 -5.651 1.00 0.00 O ATOM 454 CB GLU A 53 -9.906 5.104 -6.071 1.00 0.00 C ATOM 455 CG GLU A 53 -11.157 5.989 -6.110 1.00 0.00 C ATOM 456 CD GLU A 53 -12.368 5.434 -5.381 1.00 0.00 C ATOM 457 OE1 GLU A 53 -13.042 4.521 -5.919 1.00 0.00 O ATOM 458 OE2 GLU A 53 -12.713 5.979 -4.302 1.00 0.00 O ATOM 0 H GLU A 53 -7.593 4.043 -6.208 1.00 0.00 H new ATOM 0 HA GLU A 53 -8.781 6.256 -7.510 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -10.051 4.245 -6.726 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -9.770 4.716 -5.061 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -10.909 6.960 -5.681 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -11.428 6.161 -7.152 1.00 0.00 H new ATOM 465 N TYR A 54 -7.638 6.689 -4.454 1.00 0.00 N ATOM 466 CA TYR A 54 -7.436 7.595 -3.348 1.00 0.00 C ATOM 467 C TYR A 54 -6.250 8.515 -3.585 1.00 0.00 C ATOM 468 O TYR A 54 -6.166 9.613 -3.009 1.00 0.00 O ATOM 469 CB TYR A 54 -7.265 6.790 -2.076 1.00 0.00 C ATOM 470 CG TYR A 54 -8.397 5.799 -1.877 1.00 0.00 C ATOM 471 CD1 TYR A 54 -9.647 6.205 -1.447 1.00 0.00 C ATOM 472 CD2 TYR A 54 -8.204 4.463 -2.138 1.00 0.00 C ATOM 473 CE1 TYR A 54 -10.670 5.293 -1.285 1.00 0.00 C ATOM 474 CE2 TYR A 54 -9.212 3.541 -1.980 1.00 0.00 C ATOM 475 CZ TYR A 54 -10.448 3.963 -1.552 1.00 0.00 C ATOM 476 OH TYR A 54 -11.463 3.052 -1.386 1.00 0.00 O ATOM 0 H TYR A 54 -7.148 5.799 -4.360 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.311 8.238 -3.252 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.316 6.255 -2.110 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.220 7.466 -1.222 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -9.825 7.249 -1.235 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -7.234 4.129 -2.476 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -11.642 5.623 -0.949 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -9.034 2.497 -2.190 1.00 0.00 H new ATOM 0 HH TYR A 54 -11.140 2.156 -1.619 1.00 0.00 H new ATOM 486 N GLY A 55 -5.351 8.094 -4.435 1.00 0.00 N ATOM 487 CA GLY A 55 -4.217 8.901 -4.754 1.00 0.00 C ATOM 488 C GLY A 55 -3.248 8.175 -5.621 1.00 0.00 C ATOM 489 O GLY A 55 -3.596 7.164 -6.222 1.00 0.00 O ATOM 0 H GLY A 55 -5.387 7.195 -4.916 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.547 9.809 -5.259 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.721 9.211 -3.834 1.00 0.00 H new ATOM 493 N VAL A 56 -2.042 8.667 -5.682 1.00 0.00 N ATOM 494 CA VAL A 56 -1.026 8.070 -6.510 1.00 0.00 C ATOM 495 C VAL A 56 -0.088 7.204 -5.667 1.00 0.00 C ATOM 496 O VAL A 56 0.667 7.726 -4.830 1.00 0.00 O ATOM 497 CB VAL A 56 -0.205 9.144 -7.265 1.00 0.00 C ATOM 498 CG1 VAL A 56 0.859 8.502 -8.141 1.00 0.00 C ATOM 499 CG2 VAL A 56 -1.120 10.024 -8.102 1.00 0.00 C ATOM 0 H VAL A 56 -1.734 9.489 -5.163 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.531 7.445 -7.246 1.00 0.00 H new ATOM 0 HB VAL A 56 0.296 9.767 -6.524 1.00 0.00 H new ATOM 0 HG11 VAL A 56 1.421 9.279 -8.660 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.537 7.917 -7.520 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.383 7.849 -8.872 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -0.526 10.773 -8.625 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.651 9.409 -8.829 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.840 10.522 -7.453 1.00 0.00 H new ATOM 509 N PRO A 57 -0.148 5.877 -5.841 1.00 0.00 N ATOM 510 CA PRO A 57 0.727 4.958 -5.139 1.00 0.00 C ATOM 511 C PRO A 57 2.105 4.909 -5.807 1.00 0.00 C ATOM 512 O PRO A 57 2.213 4.848 -7.038 1.00 0.00 O ATOM 513 CB PRO A 57 0.006 3.617 -5.302 1.00 0.00 C ATOM 514 CG PRO A 57 -0.701 3.727 -6.602 1.00 0.00 C ATOM 515 CD PRO A 57 -1.084 5.171 -6.744 1.00 0.00 C ATOM 0 HA PRO A 57 0.904 5.235 -4.100 1.00 0.00 H new ATOM 0 HB2 PRO A 57 0.711 2.786 -5.303 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -0.693 3.441 -4.484 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -0.058 3.411 -7.424 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.582 3.086 -6.622 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -0.980 5.513 -7.774 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -2.121 5.340 -6.455 1.00 0.00 H new ATOM 523 N VAL A 58 3.148 4.923 -5.020 1.00 0.00 N ATOM 524 CA VAL A 58 4.485 4.903 -5.592 1.00 0.00 C ATOM 525 C VAL A 58 5.200 3.593 -5.311 1.00 0.00 C ATOM 526 O VAL A 58 6.033 3.160 -6.101 1.00 0.00 O ATOM 527 CB VAL A 58 5.368 6.121 -5.167 1.00 0.00 C ATOM 528 CG1 VAL A 58 4.764 7.421 -5.632 1.00 0.00 C ATOM 529 CG2 VAL A 58 5.572 6.176 -3.680 1.00 0.00 C ATOM 0 H VAL A 58 3.110 4.948 -4.001 1.00 0.00 H new ATOM 0 HA VAL A 58 4.338 4.991 -6.668 1.00 0.00 H new ATOM 0 HB VAL A 58 6.337 5.981 -5.645 1.00 0.00 H new ATOM 0 HG11 VAL A 58 5.401 8.250 -5.322 1.00 0.00 H new ATOM 0 HG12 VAL A 58 4.680 7.415 -6.719 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.774 7.540 -5.192 1.00 0.00 H new ATOM 0 HG21 VAL A 58 6.191 7.037 -3.429 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.606 6.266 -3.183 1.00 0.00 H new ATOM 0 HG23 VAL A 58 6.067 5.264 -3.347 1.00 0.00 H new ATOM 539 N ASP A 59 4.854 2.948 -4.212 1.00 0.00 N ATOM 540 CA ASP A 59 5.489 1.689 -3.848 1.00 0.00 C ATOM 541 C ASP A 59 4.525 0.852 -3.052 1.00 0.00 C ATOM 542 O ASP A 59 3.745 1.399 -2.253 1.00 0.00 O ATOM 543 CB ASP A 59 6.759 1.933 -3.025 1.00 0.00 C ATOM 544 CG ASP A 59 7.520 0.659 -2.718 1.00 0.00 C ATOM 545 OD1 ASP A 59 8.068 0.039 -3.645 1.00 0.00 O ATOM 546 OD2 ASP A 59 7.624 0.278 -1.541 1.00 0.00 O ATOM 0 H ASP A 59 4.141 3.270 -3.557 1.00 0.00 H new ATOM 0 HA ASP A 59 5.767 1.165 -4.763 1.00 0.00 H new ATOM 0 HB2 ASP A 59 7.411 2.617 -3.568 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.490 2.424 -2.089 1.00 0.00 H new ATOM 551 N VAL A 60 4.541 -0.443 -3.283 1.00 0.00 N ATOM 552 CA VAL A 60 3.672 -1.355 -2.581 1.00 0.00 C ATOM 553 C VAL A 60 4.421 -2.666 -2.286 1.00 0.00 C ATOM 554 O VAL A 60 5.148 -3.194 -3.142 1.00 0.00 O ATOM 555 CB VAL A 60 2.358 -1.630 -3.394 1.00 0.00 C ATOM 556 CG1 VAL A 60 2.638 -2.350 -4.703 1.00 0.00 C ATOM 557 CG2 VAL A 60 1.323 -2.382 -2.564 1.00 0.00 C ATOM 0 H VAL A 60 5.157 -0.890 -3.962 1.00 0.00 H new ATOM 0 HA VAL A 60 3.379 -0.896 -1.637 1.00 0.00 H new ATOM 0 HB VAL A 60 1.936 -0.656 -3.641 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.701 -2.520 -5.233 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.298 -1.740 -5.320 1.00 0.00 H new ATOM 0 HG13 VAL A 60 3.117 -3.307 -4.497 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.429 -2.552 -3.164 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.736 -3.340 -2.249 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.063 -1.792 -1.685 1.00 0.00 H new ATOM 567 N ILE A 61 4.311 -3.138 -1.071 1.00 0.00 N ATOM 568 CA ILE A 61 4.918 -4.386 -0.674 1.00 0.00 C ATOM 569 C ILE A 61 3.858 -5.339 -0.192 1.00 0.00 C ATOM 570 O ILE A 61 3.148 -5.054 0.785 1.00 0.00 O ATOM 571 CB ILE A 61 5.975 -4.196 0.433 1.00 0.00 C ATOM 572 CG1 ILE A 61 7.062 -3.265 -0.059 1.00 0.00 C ATOM 573 CG2 ILE A 61 6.582 -5.547 0.847 1.00 0.00 C ATOM 574 CD1 ILE A 61 8.019 -2.850 1.006 1.00 0.00 C ATOM 0 H ILE A 61 3.797 -2.668 -0.326 1.00 0.00 H new ATOM 0 HA ILE A 61 5.423 -4.793 -1.550 1.00 0.00 H new ATOM 0 HB ILE A 61 5.492 -3.759 1.307 1.00 0.00 H new ATOM 0 HG12 ILE A 61 7.614 -3.756 -0.861 1.00 0.00 H new ATOM 0 HG13 ILE A 61 6.600 -2.376 -0.488 1.00 0.00 H new ATOM 0 HG21 ILE A 61 7.325 -5.388 1.629 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.794 -6.200 1.222 1.00 0.00 H new ATOM 0 HG23 ILE A 61 7.058 -6.012 -0.016 1.00 0.00 H new ATOM 0 HD11 ILE A 61 8.770 -2.184 0.581 1.00 0.00 H new ATOM 0 HD12 ILE A 61 7.479 -2.330 1.798 1.00 0.00 H new ATOM 0 HD13 ILE A 61 8.509 -3.732 1.419 1.00 0.00 H new ATOM 586 N LEU A 62 3.736 -6.439 -0.864 1.00 0.00 N ATOM 587 CA LEU A 62 2.801 -7.445 -0.487 1.00 0.00 C ATOM 588 C LEU A 62 3.566 -8.474 0.309 1.00 0.00 C ATOM 589 O LEU A 62 4.492 -9.096 -0.212 1.00 0.00 O ATOM 590 CB LEU A 62 2.224 -8.125 -1.729 1.00 0.00 C ATOM 591 CG LEU A 62 0.766 -8.623 -1.653 1.00 0.00 C ATOM 592 CD1 LEU A 62 0.467 -9.413 -0.386 1.00 0.00 C ATOM 593 CD2 LEU A 62 -0.190 -7.476 -1.815 1.00 0.00 C ATOM 0 H LEU A 62 4.286 -6.664 -1.693 1.00 0.00 H new ATOM 0 HA LEU A 62 1.983 -7.008 0.085 1.00 0.00 H new ATOM 0 HB2 LEU A 62 2.298 -7.425 -2.561 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.859 -8.977 -1.972 1.00 0.00 H new ATOM 0 HG LEU A 62 0.628 -9.319 -2.480 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.575 -9.734 -0.395 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.116 -10.288 -0.341 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.645 -8.784 0.486 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.214 -7.845 -1.759 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.023 -6.748 -1.021 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.028 -7.001 -2.783 1.00 0.00 H new ATOM 605 N SER A 63 3.210 -8.638 1.538 1.00 0.00 N ATOM 606 CA SER A 63 3.843 -9.606 2.370 1.00 0.00 C ATOM 607 C SER A 63 3.294 -10.972 2.014 1.00 0.00 C ATOM 608 O SER A 63 2.078 -11.198 2.077 1.00 0.00 O ATOM 609 CB SER A 63 3.560 -9.254 3.799 1.00 0.00 C ATOM 610 OG SER A 63 3.970 -7.920 4.034 1.00 0.00 O ATOM 0 H SER A 63 2.471 -8.104 1.995 1.00 0.00 H new ATOM 0 HA SER A 63 4.923 -9.619 2.224 1.00 0.00 H new ATOM 0 HB2 SER A 63 2.496 -9.364 4.010 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.090 -9.934 4.466 1.00 0.00 H new ATOM 0 HG SER A 63 3.761 -7.672 4.959 1.00 0.00 H new ATOM 616 N ARG A 64 4.161 -11.855 1.597 1.00 0.00 N ATOM 617 CA ARG A 64 3.770 -13.159 1.126 1.00 0.00 C ATOM 618 C ARG A 64 4.618 -14.241 1.770 1.00 0.00 C ATOM 619 O ARG A 64 5.832 -14.087 1.921 1.00 0.00 O ATOM 620 CB ARG A 64 3.900 -13.221 -0.398 1.00 0.00 C ATOM 621 CG ARG A 64 2.984 -12.264 -1.147 1.00 0.00 C ATOM 622 CD ARG A 64 3.310 -12.212 -2.626 1.00 0.00 C ATOM 623 NE ARG A 64 4.674 -11.710 -2.875 1.00 0.00 N ATOM 624 CZ ARG A 64 5.129 -11.264 -4.057 1.00 0.00 C ATOM 625 NH1 ARG A 64 4.334 -11.265 -5.130 1.00 0.00 N ATOM 626 NH2 ARG A 64 6.378 -10.822 -4.157 1.00 0.00 N ATOM 0 H ARG A 64 5.167 -11.690 1.574 1.00 0.00 H new ATOM 0 HA ARG A 64 2.730 -13.332 1.404 1.00 0.00 H new ATOM 0 HB2 ARG A 64 4.933 -13.005 -0.671 1.00 0.00 H new ATOM 0 HB3 ARG A 64 3.689 -14.239 -0.727 1.00 0.00 H new ATOM 0 HG2 ARG A 64 1.948 -12.575 -1.014 1.00 0.00 H new ATOM 0 HG3 ARG A 64 3.075 -11.265 -0.720 1.00 0.00 H new ATOM 0 HD2 ARG A 64 3.207 -13.209 -3.055 1.00 0.00 H new ATOM 0 HD3 ARG A 64 2.590 -11.570 -3.133 1.00 0.00 H new ATOM 0 HE ARG A 64 5.323 -11.701 -2.088 1.00 0.00 H new ATOM 0 HH11 ARG A 64 3.376 -11.606 -5.054 1.00 0.00 H new ATOM 0 HH12 ARG A 64 4.685 -10.925 -6.025 1.00 0.00 H new ATOM 0 HH21 ARG A 64 6.986 -10.823 -3.338 1.00 0.00 H new ATOM 0 HH22 ARG A 64 6.729 -10.482 -5.053 1.00 0.00 H new ATOM 728 N GLN A 72 0.334 -12.904 3.202 1.00 0.00 N ATOM 729 CA GLN A 72 0.348 -13.141 4.651 1.00 0.00 C ATOM 730 C GLN A 72 -0.798 -12.446 5.365 1.00 0.00 C ATOM 731 O GLN A 72 -0.861 -12.434 6.594 1.00 0.00 O ATOM 732 CB GLN A 72 1.657 -12.682 5.234 1.00 0.00 C ATOM 733 CG GLN A 72 2.820 -13.425 4.662 1.00 0.00 C ATOM 734 CD GLN A 72 4.071 -13.166 5.401 1.00 0.00 C ATOM 735 OE1 GLN A 72 4.808 -12.226 5.099 1.00 0.00 O ATOM 736 NE2 GLN A 72 4.337 -13.995 6.359 1.00 0.00 N ATOM 0 HA GLN A 72 0.225 -14.214 4.801 1.00 0.00 H new ATOM 0 HB2 GLN A 72 1.782 -11.615 5.047 1.00 0.00 H new ATOM 0 HB3 GLN A 72 1.638 -12.816 6.316 1.00 0.00 H new ATOM 0 HG2 GLN A 72 2.607 -14.494 4.676 1.00 0.00 H new ATOM 0 HG3 GLN A 72 2.952 -13.140 3.618 1.00 0.00 H new ATOM 0 HE21 GLN A 72 3.692 -14.757 6.568 1.00 0.00 H new ATOM 0 HE22 GLN A 72 5.192 -13.886 6.905 1.00 0.00 H new ATOM 745 N GLY A 73 -1.684 -11.855 4.596 1.00 0.00 N ATOM 746 CA GLY A 73 -2.837 -11.204 5.163 1.00 0.00 C ATOM 747 C GLY A 73 -2.621 -9.742 5.451 1.00 0.00 C ATOM 748 O GLY A 73 -3.482 -9.101 6.036 1.00 0.00 O ATOM 0 H GLY A 73 -1.626 -11.813 3.578 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.678 -11.311 4.478 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -3.113 -11.711 6.088 1.00 0.00 H new ATOM 752 N PHE A 74 -1.510 -9.194 5.014 1.00 0.00 N ATOM 753 CA PHE A 74 -1.240 -7.794 5.224 1.00 0.00 C ATOM 754 C PHE A 74 -0.332 -7.293 4.129 1.00 0.00 C ATOM 755 O PHE A 74 0.359 -8.103 3.477 1.00 0.00 O ATOM 756 CB PHE A 74 -0.630 -7.524 6.621 1.00 0.00 C ATOM 757 CG PHE A 74 0.764 -8.041 6.834 1.00 0.00 C ATOM 758 CD1 PHE A 74 0.994 -9.371 7.117 1.00 0.00 C ATOM 759 CD2 PHE A 74 1.843 -7.178 6.767 1.00 0.00 C ATOM 760 CE1 PHE A 74 2.271 -9.840 7.328 1.00 0.00 C ATOM 761 CE2 PHE A 74 3.126 -7.639 6.978 1.00 0.00 C ATOM 762 CZ PHE A 74 3.337 -8.977 7.260 1.00 0.00 C ATOM 0 H PHE A 74 -0.780 -9.698 4.511 1.00 0.00 H new ATOM 0 HA PHE A 74 -2.185 -7.251 5.188 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.629 -6.448 6.795 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -1.281 -7.968 7.374 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.160 -10.055 7.174 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.679 -6.133 6.547 1.00 0.00 H new ATOM 0 HE1 PHE A 74 2.434 -10.885 7.547 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.963 -6.958 6.923 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.340 -9.342 7.427 1.00 0.00 H new ATOM 772 N ALA A 75 -0.346 -6.003 3.899 1.00 0.00 N ATOM 773 CA ALA A 75 0.485 -5.395 2.903 1.00 0.00 C ATOM 774 C ALA A 75 0.782 -3.942 3.260 1.00 0.00 C ATOM 775 O ALA A 75 0.215 -3.392 4.216 1.00 0.00 O ATOM 776 CB ALA A 75 -0.182 -5.482 1.553 1.00 0.00 C ATOM 0 H ALA A 75 -0.940 -5.346 4.404 1.00 0.00 H new ATOM 0 HA ALA A 75 1.432 -5.933 2.864 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.456 -5.018 0.801 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.345 -6.528 1.294 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -1.140 -4.963 1.586 1.00 0.00 H new ATOM 782 N TYR A 76 1.646 -3.340 2.487 1.00 0.00 N ATOM 783 CA TYR A 76 2.088 -1.974 2.671 1.00 0.00 C ATOM 784 C TYR A 76 2.026 -1.238 1.349 1.00 0.00 C ATOM 785 O TYR A 76 2.336 -1.816 0.318 1.00 0.00 O ATOM 786 CB TYR A 76 3.536 -1.994 3.195 1.00 0.00 C ATOM 787 CG TYR A 76 4.364 -0.763 2.886 1.00 0.00 C ATOM 788 CD1 TYR A 76 4.220 0.422 3.590 1.00 0.00 C ATOM 789 CD2 TYR A 76 5.305 -0.810 1.876 1.00 0.00 C ATOM 790 CE1 TYR A 76 5.002 1.518 3.282 1.00 0.00 C ATOM 791 CE2 TYR A 76 6.085 0.263 1.571 1.00 0.00 C ATOM 792 CZ TYR A 76 5.939 1.423 2.270 1.00 0.00 C ATOM 793 OH TYR A 76 6.732 2.490 1.964 1.00 0.00 O ATOM 0 H TYR A 76 2.078 -3.798 1.684 1.00 0.00 H new ATOM 0 HA TYR A 76 1.444 -1.463 3.387 1.00 0.00 H new ATOM 0 HB2 TYR A 76 3.510 -2.130 4.276 1.00 0.00 H new ATOM 0 HB3 TYR A 76 4.042 -2.864 2.777 1.00 0.00 H new ATOM 0 HD1 TYR A 76 3.492 0.489 4.385 1.00 0.00 H new ATOM 0 HD2 TYR A 76 5.425 -1.724 1.313 1.00 0.00 H new ATOM 0 HE1 TYR A 76 4.882 2.442 3.828 1.00 0.00 H new ATOM 0 HE2 TYR A 76 6.816 0.195 0.779 1.00 0.00 H new ATOM 0 HH TYR A 76 6.542 3.227 2.582 1.00 0.00 H new ATOM 803 N LEU A 77 1.651 0.019 1.387 1.00 0.00 N ATOM 804 CA LEU A 77 1.618 0.856 0.209 1.00 0.00 C ATOM 805 C LEU A 77 1.891 2.291 0.631 1.00 0.00 C ATOM 806 O LEU A 77 1.481 2.705 1.708 1.00 0.00 O ATOM 807 CB LEU A 77 0.268 0.701 -0.570 1.00 0.00 C ATOM 808 CG LEU A 77 0.160 1.429 -1.941 1.00 0.00 C ATOM 809 CD1 LEU A 77 -0.865 0.750 -2.825 1.00 0.00 C ATOM 810 CD2 LEU A 77 -0.267 2.862 -1.755 1.00 0.00 C ATOM 0 H LEU A 77 1.358 0.493 2.241 1.00 0.00 H new ATOM 0 HA LEU A 77 2.393 0.544 -0.491 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.092 -0.362 -0.735 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.537 1.062 0.070 1.00 0.00 H new ATOM 0 HG LEU A 77 1.145 1.391 -2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.926 1.273 -3.779 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.569 -0.285 -2.997 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.839 0.772 -2.336 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.336 3.350 -2.727 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.240 2.891 -1.265 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.465 3.383 -1.138 1.00 0.00 H new ATOM 822 N LYS A 78 2.647 3.007 -0.165 1.00 0.00 N ATOM 823 CA LYS A 78 2.950 4.387 0.111 1.00 0.00 C ATOM 824 C LYS A 78 2.522 5.243 -1.069 1.00 0.00 C ATOM 825 O LYS A 78 2.610 4.816 -2.244 1.00 0.00 O ATOM 826 CB LYS A 78 4.438 4.619 0.412 1.00 0.00 C ATOM 827 CG LYS A 78 5.344 4.348 -0.753 1.00 0.00 C ATOM 828 CD LYS A 78 6.784 4.770 -0.495 1.00 0.00 C ATOM 829 CE LYS A 78 6.936 6.280 -0.310 1.00 0.00 C ATOM 830 NZ LYS A 78 8.358 6.658 -0.126 1.00 0.00 N ATOM 0 H LYS A 78 3.069 2.648 -1.022 1.00 0.00 H new ATOM 0 HA LYS A 78 2.397 4.670 1.007 1.00 0.00 H new ATOM 0 HB2 LYS A 78 4.577 5.651 0.735 1.00 0.00 H new ATOM 0 HB3 LYS A 78 4.734 3.982 1.245 1.00 0.00 H new ATOM 0 HG2 LYS A 78 5.319 3.284 -0.986 1.00 0.00 H new ATOM 0 HG3 LYS A 78 4.968 4.875 -1.630 1.00 0.00 H new ATOM 0 HD2 LYS A 78 7.153 4.261 0.395 1.00 0.00 H new ATOM 0 HD3 LYS A 78 7.407 4.446 -1.329 1.00 0.00 H new ATOM 0 HE2 LYS A 78 6.529 6.798 -1.178 1.00 0.00 H new ATOM 0 HE3 LYS A 78 6.356 6.603 0.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 8.430 7.688 -0.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 8.738 6.181 0.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 8.905 6.370 -0.963 1.00 0.00 H new ATOM 844 N TYR A 79 2.055 6.408 -0.771 1.00 0.00 N ATOM 845 CA TYR A 79 1.582 7.338 -1.769 1.00 0.00 C ATOM 846 C TYR A 79 2.565 8.449 -1.975 1.00 0.00 C ATOM 847 O TYR A 79 3.494 8.626 -1.182 1.00 0.00 O ATOM 848 CB TYR A 79 0.252 7.945 -1.367 1.00 0.00 C ATOM 849 CG TYR A 79 -0.888 6.988 -1.347 1.00 0.00 C ATOM 850 CD1 TYR A 79 -1.061 6.113 -0.300 1.00 0.00 C ATOM 851 CD2 TYR A 79 -1.807 6.975 -2.375 1.00 0.00 C ATOM 852 CE1 TYR A 79 -2.111 5.249 -0.273 1.00 0.00 C ATOM 853 CE2 TYR A 79 -2.869 6.120 -2.355 1.00 0.00 C ATOM 854 CZ TYR A 79 -3.016 5.261 -1.304 1.00 0.00 C ATOM 855 OH TYR A 79 -4.064 4.417 -1.281 1.00 0.00 O ATOM 0 H TYR A 79 1.985 6.757 0.185 1.00 0.00 H new ATOM 0 HA TYR A 79 1.461 6.775 -2.695 1.00 0.00 H new ATOM 0 HB2 TYR A 79 0.355 8.387 -0.376 1.00 0.00 H new ATOM 0 HB3 TYR A 79 0.016 8.756 -2.055 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -0.351 6.112 0.514 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.684 7.652 -3.208 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -2.231 4.561 0.551 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -3.586 6.122 -3.162 1.00 0.00 H new ATOM 0 HH TYR A 79 -3.849 3.643 -0.719 1.00 0.00 H new ATOM 865 N GLU A 80 2.377 9.170 -3.050 1.00 0.00 N ATOM 866 CA GLU A 80 3.176 10.335 -3.337 1.00 0.00 C ATOM 867 C GLU A 80 2.757 11.489 -2.395 1.00 0.00 C ATOM 868 O GLU A 80 3.567 12.363 -2.053 1.00 0.00 O ATOM 869 CB GLU A 80 3.003 10.733 -4.817 1.00 0.00 C ATOM 870 CG GLU A 80 3.876 11.895 -5.264 1.00 0.00 C ATOM 871 CD GLU A 80 3.708 12.231 -6.726 1.00 0.00 C ATOM 872 OE1 GLU A 80 2.772 12.966 -7.081 1.00 0.00 O ATOM 873 OE2 GLU A 80 4.525 11.781 -7.547 1.00 0.00 O ATOM 0 H GLU A 80 1.666 8.967 -3.752 1.00 0.00 H new ATOM 0 HA GLU A 80 4.230 10.115 -3.166 1.00 0.00 H new ATOM 0 HB2 GLU A 80 3.225 9.867 -5.441 1.00 0.00 H new ATOM 0 HB3 GLU A 80 1.959 10.992 -4.991 1.00 0.00 H new ATOM 0 HG2 GLU A 80 3.636 12.774 -4.665 1.00 0.00 H new ATOM 0 HG3 GLU A 80 4.921 11.653 -5.070 1.00 0.00 H new ATOM 880 N ASP A 81 1.505 11.466 -1.945 1.00 0.00 N ATOM 881 CA ASP A 81 0.989 12.525 -1.072 1.00 0.00 C ATOM 882 C ASP A 81 0.281 11.920 0.153 1.00 0.00 C ATOM 883 O ASP A 81 -0.412 10.901 0.043 1.00 0.00 O ATOM 884 CB ASP A 81 0.010 13.412 -1.848 1.00 0.00 C ATOM 885 CG ASP A 81 -0.330 14.697 -1.132 1.00 0.00 C ATOM 886 OD1 ASP A 81 -1.010 14.676 -0.101 1.00 0.00 O ATOM 887 OD2 ASP A 81 0.068 15.764 -1.600 1.00 0.00 O ATOM 0 H ASP A 81 0.831 10.733 -2.166 1.00 0.00 H new ATOM 0 HA ASP A 81 1.829 13.128 -0.728 1.00 0.00 H new ATOM 0 HB2 ASP A 81 0.439 13.649 -2.821 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -0.908 12.853 -2.032 1.00 0.00 H new ATOM 892 N GLN A 82 0.466 12.544 1.305 1.00 0.00 N ATOM 893 CA GLN A 82 -0.111 12.100 2.581 1.00 0.00 C ATOM 894 C GLN A 82 -1.630 12.286 2.656 1.00 0.00 C ATOM 895 O GLN A 82 -2.300 11.647 3.453 1.00 0.00 O ATOM 896 CB GLN A 82 0.578 12.762 3.789 1.00 0.00 C ATOM 897 CG GLN A 82 2.026 12.337 4.022 1.00 0.00 C ATOM 898 CD GLN A 82 2.977 12.771 2.923 1.00 0.00 C ATOM 899 OE1 GLN A 82 2.794 13.805 2.291 1.00 0.00 O ATOM 900 NE2 GLN A 82 3.963 11.972 2.658 1.00 0.00 N ATOM 0 H GLN A 82 1.030 13.389 1.390 1.00 0.00 H new ATOM 0 HA GLN A 82 0.079 11.028 2.625 1.00 0.00 H new ATOM 0 HB2 GLN A 82 0.550 13.843 3.656 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.001 12.536 4.686 1.00 0.00 H new ATOM 0 HG2 GLN A 82 2.368 12.752 4.970 1.00 0.00 H new ATOM 0 HG3 GLN A 82 2.065 11.252 4.116 1.00 0.00 H new ATOM 0 HE21 GLN A 82 4.088 11.119 3.202 1.00 0.00 H new ATOM 0 HE22 GLN A 82 4.613 12.197 1.905 1.00 0.00 H new ATOM 909 N ARG A 83 -2.166 13.163 1.838 1.00 0.00 N ATOM 910 CA ARG A 83 -3.613 13.372 1.774 1.00 0.00 C ATOM 911 C ARG A 83 -4.285 12.113 1.253 1.00 0.00 C ATOM 912 O ARG A 83 -5.386 11.758 1.633 1.00 0.00 O ATOM 913 CB ARG A 83 -3.950 14.578 0.915 1.00 0.00 C ATOM 914 CG ARG A 83 -3.540 15.905 1.534 1.00 0.00 C ATOM 915 CD ARG A 83 -3.677 17.042 0.542 1.00 0.00 C ATOM 916 NE ARG A 83 -2.727 16.899 -0.567 1.00 0.00 N ATOM 917 CZ ARG A 83 -2.710 17.643 -1.679 1.00 0.00 C ATOM 918 NH1 ARG A 83 -3.685 18.513 -1.918 1.00 0.00 N ATOM 919 NH2 ARG A 83 -1.731 17.488 -2.557 1.00 0.00 N ATOM 0 H ARG A 83 -1.627 13.750 1.201 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.989 13.577 2.776 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.459 14.472 -0.053 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -5.024 14.591 0.728 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.158 16.107 2.409 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.508 15.844 1.880 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.694 17.066 0.151 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.507 17.992 1.049 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.019 16.170 -0.483 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.451 18.616 -1.252 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -3.668 19.078 -2.767 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -0.994 16.804 -2.384 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -1.713 18.053 -3.406 1.00 0.00 H new ATOM 933 N SER A 84 -3.603 11.467 0.380 1.00 0.00 N ATOM 934 CA SER A 84 -4.038 10.239 -0.200 1.00 0.00 C ATOM 935 C SER A 84 -4.117 9.098 0.836 1.00 0.00 C ATOM 936 O SER A 84 -5.020 8.260 0.760 1.00 0.00 O ATOM 937 CB SER A 84 -3.137 9.893 -1.354 1.00 0.00 C ATOM 938 OG SER A 84 -3.182 10.910 -2.332 1.00 0.00 O ATOM 0 H SER A 84 -2.697 11.784 0.035 1.00 0.00 H new ATOM 0 HA SER A 84 -5.055 10.368 -0.571 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.114 9.764 -1.000 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.444 8.944 -1.792 1.00 0.00 H new ATOM 0 HG SER A 84 -2.387 10.851 -2.902 1.00 0.00 H new ATOM 944 N THR A 85 -3.178 9.058 1.797 1.00 0.00 N ATOM 945 CA THR A 85 -3.169 7.970 2.768 1.00 0.00 C ATOM 946 C THR A 85 -4.415 8.018 3.651 1.00 0.00 C ATOM 947 O THR A 85 -5.085 7.008 3.830 1.00 0.00 O ATOM 948 CB THR A 85 -1.880 7.951 3.644 1.00 0.00 C ATOM 949 OG1 THR A 85 -1.761 9.139 4.423 1.00 0.00 O ATOM 950 CG2 THR A 85 -0.654 7.827 2.778 1.00 0.00 C ATOM 0 H THR A 85 -2.438 9.750 1.915 1.00 0.00 H new ATOM 0 HA THR A 85 -3.175 7.043 2.194 1.00 0.00 H new ATOM 0 HB THR A 85 -1.959 7.091 4.309 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.986 9.916 3.870 1.00 0.00 H new ATOM 0 HG21 THR A 85 0.236 7.815 3.407 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.705 6.901 2.205 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.604 8.675 2.094 1.00 0.00 H new ATOM 958 N ILE A 86 -4.760 9.213 4.127 1.00 0.00 N ATOM 959 CA ILE A 86 -5.964 9.414 4.932 1.00 0.00 C ATOM 960 C ILE A 86 -7.216 9.100 4.129 1.00 0.00 C ATOM 961 O ILE A 86 -8.161 8.485 4.652 1.00 0.00 O ATOM 962 CB ILE A 86 -6.027 10.831 5.582 1.00 0.00 C ATOM 963 CG1 ILE A 86 -5.744 11.914 4.548 1.00 0.00 C ATOM 964 CG2 ILE A 86 -5.062 10.928 6.739 1.00 0.00 C ATOM 965 CD1 ILE A 86 -5.511 13.283 5.116 1.00 0.00 C ATOM 0 H ILE A 86 -4.218 10.063 3.968 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.913 8.708 5.761 1.00 0.00 H new ATOM 0 HB ILE A 86 -7.036 10.986 5.965 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -4.868 11.623 3.969 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -6.583 11.962 3.854 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.121 11.923 7.179 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.320 10.183 7.491 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -4.048 10.748 6.383 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.318 13.985 4.305 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -6.394 13.602 5.670 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -4.652 13.258 5.786 1.00 0.00 H new ATOM 977 N LEU A 87 -7.203 9.486 2.847 1.00 0.00 N ATOM 978 CA LEU A 87 -8.302 9.180 1.932 1.00 0.00 C ATOM 979 C LEU A 87 -8.502 7.688 1.790 1.00 0.00 C ATOM 980 O LEU A 87 -9.640 7.193 1.843 1.00 0.00 O ATOM 981 CB LEU A 87 -8.045 9.788 0.542 1.00 0.00 C ATOM 982 CG LEU A 87 -8.263 11.283 0.414 1.00 0.00 C ATOM 983 CD1 LEU A 87 -7.853 11.787 -0.966 1.00 0.00 C ATOM 984 CD2 LEU A 87 -9.711 11.578 0.642 1.00 0.00 C ATOM 0 H LEU A 87 -6.440 10.012 2.422 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.204 9.619 2.358 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.017 9.566 0.256 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.692 9.285 -0.177 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.646 11.792 1.155 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -8.022 12.862 -1.026 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.797 11.576 -1.131 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.447 11.284 -1.729 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -9.882 12.651 0.553 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.311 11.052 -0.101 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -9.997 11.247 1.640 1.00 0.00 H new ATOM 996 N ALA A 88 -7.412 6.973 1.646 1.00 0.00 N ATOM 997 CA ALA A 88 -7.476 5.545 1.486 1.00 0.00 C ATOM 998 C ALA A 88 -7.863 4.851 2.774 1.00 0.00 C ATOM 999 O ALA A 88 -8.764 4.037 2.779 1.00 0.00 O ATOM 1000 CB ALA A 88 -6.180 5.003 0.914 1.00 0.00 C ATOM 0 H ALA A 88 -6.469 7.361 1.637 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.266 5.328 0.767 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.255 3.921 0.803 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.995 5.455 -0.060 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.357 5.242 1.587 1.00 0.00 H new ATOM 1006 N VAL A 89 -7.232 5.234 3.872 1.00 0.00 N ATOM 1007 CA VAL A 89 -7.489 4.607 5.170 1.00 0.00 C ATOM 1008 C VAL A 89 -8.958 4.676 5.557 1.00 0.00 C ATOM 1009 O VAL A 89 -9.560 3.665 5.847 1.00 0.00 O ATOM 1010 CB VAL A 89 -6.621 5.230 6.307 1.00 0.00 C ATOM 1011 CG1 VAL A 89 -7.072 4.731 7.678 1.00 0.00 C ATOM 1012 CG2 VAL A 89 -5.160 4.881 6.106 1.00 0.00 C ATOM 0 H VAL A 89 -6.535 5.978 3.896 1.00 0.00 H new ATOM 0 HA VAL A 89 -7.208 3.560 5.054 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.748 6.312 6.266 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.450 5.181 8.452 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -8.113 5.009 7.842 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.975 3.646 7.720 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.567 5.323 6.907 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -5.039 3.798 6.120 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.821 5.271 5.146 1.00 0.00 H new ATOM 1022 N ASP A 90 -9.531 5.844 5.449 1.00 0.00 N ATOM 1023 CA ASP A 90 -10.898 6.093 5.914 1.00 0.00 C ATOM 1024 C ASP A 90 -11.924 5.258 5.183 1.00 0.00 C ATOM 1025 O ASP A 90 -12.789 4.642 5.800 1.00 0.00 O ATOM 1026 CB ASP A 90 -11.265 7.578 5.778 1.00 0.00 C ATOM 1027 CG ASP A 90 -12.720 7.859 6.120 1.00 0.00 C ATOM 1028 OD1 ASP A 90 -13.056 7.992 7.309 1.00 0.00 O ATOM 1029 OD2 ASP A 90 -13.551 7.972 5.204 1.00 0.00 O ATOM 0 H ASP A 90 -9.076 6.660 5.038 1.00 0.00 H new ATOM 0 HA ASP A 90 -10.916 5.804 6.965 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -10.622 8.168 6.432 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.067 7.905 4.757 1.00 0.00 H new ATOM 1034 N ASN A 91 -11.776 5.182 3.897 1.00 0.00 N ATOM 1035 CA ASN A 91 -12.792 4.584 3.044 1.00 0.00 C ATOM 1036 C ASN A 91 -12.533 3.102 2.783 1.00 0.00 C ATOM 1037 O ASN A 91 -13.438 2.360 2.414 1.00 0.00 O ATOM 1038 CB ASN A 91 -12.915 5.391 1.752 1.00 0.00 C ATOM 1039 CG ASN A 91 -14.145 5.061 0.919 1.00 0.00 C ATOM 1040 OD1 ASN A 91 -15.160 4.576 1.428 1.00 0.00 O ATOM 1041 ND2 ASN A 91 -14.108 5.413 -0.335 1.00 0.00 N ATOM 0 H ASN A 91 -10.957 5.527 3.397 1.00 0.00 H new ATOM 0 HA ASN A 91 -13.748 4.622 3.566 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -12.934 6.452 2.001 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -12.025 5.222 1.146 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -14.932 5.290 -0.924 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -13.255 5.811 -0.728 1.00 0.00 H new ATOM 1048 N LEU A 92 -11.308 2.677 2.980 1.00 0.00 N ATOM 1049 CA LEU A 92 -10.950 1.277 2.774 1.00 0.00 C ATOM 1050 C LEU A 92 -11.067 0.500 4.041 1.00 0.00 C ATOM 1051 O LEU A 92 -11.271 -0.714 4.020 1.00 0.00 O ATOM 1052 CB LEU A 92 -9.548 1.155 2.243 1.00 0.00 C ATOM 1053 CG LEU A 92 -9.383 1.257 0.757 1.00 0.00 C ATOM 1054 CD1 LEU A 92 -7.969 1.664 0.454 1.00 0.00 C ATOM 1055 CD2 LEU A 92 -9.676 -0.097 0.131 1.00 0.00 C ATOM 0 H LEU A 92 -10.537 3.272 3.282 1.00 0.00 H new ATOM 0 HA LEU A 92 -11.647 0.868 2.043 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.939 1.930 2.708 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.143 0.196 2.566 1.00 0.00 H new ATOM 0 HG LEU A 92 -10.071 1.998 0.350 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -7.836 1.742 -0.625 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.761 2.629 0.916 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -7.282 0.917 0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.558 -0.031 -0.951 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -8.982 -0.839 0.527 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.698 -0.394 0.367 1.00 0.00 H new ATOM 1067 N ASN A 93 -10.895 1.170 5.147 1.00 0.00 N ATOM 1068 CA ASN A 93 -11.025 0.518 6.415 1.00 0.00 C ATOM 1069 C ASN A 93 -12.469 0.077 6.593 1.00 0.00 C ATOM 1070 O ASN A 93 -13.401 0.890 6.498 1.00 0.00 O ATOM 1071 CB ASN A 93 -10.624 1.489 7.507 1.00 0.00 C ATOM 1072 CG ASN A 93 -10.686 0.925 8.887 1.00 0.00 C ATOM 1073 OD1 ASN A 93 -10.494 -0.270 9.101 1.00 0.00 O ATOM 1074 ND2 ASN A 93 -10.918 1.773 9.828 1.00 0.00 N ATOM 0 H ASN A 93 -10.666 2.163 5.194 1.00 0.00 H new ATOM 0 HA ASN A 93 -10.379 -0.358 6.467 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -9.608 1.834 7.314 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -11.273 2.363 7.455 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -10.948 1.462 10.799 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -11.072 2.756 9.602 1.00 0.00 H new ATOM 1081 N GLY A 94 -12.650 -1.193 6.840 1.00 0.00 N ATOM 1082 CA GLY A 94 -13.965 -1.739 7.007 1.00 0.00 C ATOM 1083 C GLY A 94 -14.581 -2.181 5.690 1.00 0.00 C ATOM 1084 O GLY A 94 -15.706 -2.691 5.674 1.00 0.00 O ATOM 0 H GLY A 94 -11.894 -1.872 6.930 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.918 -2.590 7.687 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.608 -0.993 7.474 1.00 0.00 H new ATOM 1088 N PHE A 95 -13.861 -1.992 4.590 1.00 0.00 N ATOM 1089 CA PHE A 95 -14.361 -2.362 3.277 1.00 0.00 C ATOM 1090 C PHE A 95 -14.186 -3.857 3.106 1.00 0.00 C ATOM 1091 O PHE A 95 -13.110 -4.384 3.354 1.00 0.00 O ATOM 1092 CB PHE A 95 -13.585 -1.614 2.166 1.00 0.00 C ATOM 1093 CG PHE A 95 -14.202 -1.689 0.781 1.00 0.00 C ATOM 1094 CD1 PHE A 95 -14.248 -2.871 0.077 1.00 0.00 C ATOM 1095 CD2 PHE A 95 -14.718 -0.566 0.189 1.00 0.00 C ATOM 1096 CE1 PHE A 95 -14.802 -2.933 -1.180 1.00 0.00 C ATOM 1097 CE2 PHE A 95 -15.274 -0.621 -1.066 1.00 0.00 C ATOM 1098 CZ PHE A 95 -15.316 -1.804 -1.748 1.00 0.00 C ATOM 0 H PHE A 95 -12.927 -1.583 4.585 1.00 0.00 H new ATOM 0 HA PHE A 95 -15.413 -2.089 3.197 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -13.497 -0.565 2.450 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -12.574 -2.017 2.118 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -13.841 -3.768 0.521 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -14.687 0.376 0.717 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -14.830 -3.871 -1.715 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -15.679 0.274 -1.515 1.00 0.00 H new ATOM 0 HZ PHE A 95 -15.755 -1.845 -2.734 1.00 0.00 H new ATOM 1108 N LYS A 96 -15.222 -4.532 2.706 1.00 0.00 N ATOM 1109 CA LYS A 96 -15.136 -5.956 2.503 1.00 0.00 C ATOM 1110 C LYS A 96 -14.725 -6.258 1.078 1.00 0.00 C ATOM 1111 O LYS A 96 -15.443 -5.927 0.140 1.00 0.00 O ATOM 1112 CB LYS A 96 -16.466 -6.689 2.842 1.00 0.00 C ATOM 1113 CG LYS A 96 -16.873 -6.712 4.330 1.00 0.00 C ATOM 1114 CD LYS A 96 -17.246 -5.330 4.861 1.00 0.00 C ATOM 1115 CE LYS A 96 -17.616 -5.357 6.335 1.00 0.00 C ATOM 1116 NZ LYS A 96 -17.947 -4.005 6.837 1.00 0.00 N ATOM 0 H LYS A 96 -16.137 -4.125 2.513 1.00 0.00 H new ATOM 0 HA LYS A 96 -14.378 -6.331 3.190 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -17.270 -6.220 2.275 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -16.388 -7.719 2.493 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -17.719 -7.387 4.461 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.050 -7.114 4.921 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.409 -4.648 4.712 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -18.084 -4.937 4.286 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -18.468 -6.020 6.485 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.787 -5.767 6.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.962 -4.015 7.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.230 -3.327 6.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.882 -3.721 6.480 1.00 0.00 H new ATOM 1130 N ILE A 97 -13.566 -6.852 0.923 1.00 0.00 N ATOM 1131 CA ILE A 97 -13.096 -7.308 -0.367 1.00 0.00 C ATOM 1132 C ILE A 97 -12.845 -8.793 -0.213 1.00 0.00 C ATOM 1133 O ILE A 97 -12.350 -9.219 0.829 1.00 0.00 O ATOM 1134 CB ILE A 97 -11.747 -6.609 -0.787 1.00 0.00 C ATOM 1135 CG1 ILE A 97 -11.901 -5.082 -0.868 1.00 0.00 C ATOM 1136 CG2 ILE A 97 -11.228 -7.155 -2.114 1.00 0.00 C ATOM 1137 CD1 ILE A 97 -10.654 -4.343 -1.316 1.00 0.00 C ATOM 0 H ILE A 97 -12.919 -7.034 1.690 1.00 0.00 H new ATOM 0 HA ILE A 97 -13.832 -7.073 -1.135 1.00 0.00 H new ATOM 0 HB ILE A 97 -11.017 -6.837 -0.010 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -12.713 -4.848 -1.557 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -12.197 -4.708 0.112 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -10.297 -6.652 -2.375 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -11.049 -8.226 -2.021 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -11.968 -6.977 -2.895 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -10.856 -3.272 -1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -9.842 -4.541 -0.616 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -10.367 -4.684 -2.311 1.00 0.00 H new ATOM 1149 N GLY A 98 -13.168 -9.575 -1.227 1.00 0.00 N ATOM 1150 CA GLY A 98 -12.971 -11.015 -1.177 1.00 0.00 C ATOM 1151 C GLY A 98 -13.689 -11.684 -0.012 1.00 0.00 C ATOM 1152 O GLY A 98 -13.296 -12.763 0.417 1.00 0.00 O ATOM 0 H GLY A 98 -13.570 -9.236 -2.101 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -13.321 -11.455 -2.111 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -11.904 -11.226 -1.106 1.00 0.00 H new ATOM 1156 N GLY A 99 -14.711 -11.027 0.511 1.00 0.00 N ATOM 1157 CA GLY A 99 -15.455 -11.567 1.615 1.00 0.00 C ATOM 1158 C GLY A 99 -14.848 -11.246 2.974 1.00 0.00 C ATOM 1159 O GLY A 99 -15.312 -11.760 3.993 1.00 0.00 O ATOM 0 H GLY A 99 -15.037 -10.118 0.182 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -16.473 -11.179 1.580 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.522 -12.649 1.503 1.00 0.00 H new ATOM 1163 N ARG A 100 -13.832 -10.408 3.009 1.00 0.00 N ATOM 1164 CA ARG A 100 -13.182 -10.061 4.260 1.00 0.00 C ATOM 1165 C ARG A 100 -13.012 -8.549 4.376 1.00 0.00 C ATOM 1166 O ARG A 100 -12.718 -7.876 3.392 1.00 0.00 O ATOM 1167 CB ARG A 100 -11.838 -10.810 4.408 1.00 0.00 C ATOM 1168 CG ARG A 100 -10.838 -10.567 3.279 1.00 0.00 C ATOM 1169 CD ARG A 100 -9.597 -11.428 3.435 1.00 0.00 C ATOM 1170 NE ARG A 100 -9.905 -12.863 3.349 1.00 0.00 N ATOM 1171 CZ ARG A 100 -9.039 -13.871 3.557 1.00 0.00 C ATOM 1172 NH1 ARG A 100 -7.762 -13.626 3.876 1.00 0.00 N ATOM 1173 NH2 ARG A 100 -9.460 -15.119 3.436 1.00 0.00 N ATOM 0 H ARG A 100 -13.437 -9.953 2.186 1.00 0.00 H new ATOM 0 HA ARG A 100 -13.819 -10.380 5.085 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -11.377 -10.516 5.351 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -12.040 -11.879 4.471 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -11.312 -10.781 2.321 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -10.552 -9.515 3.266 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -8.875 -11.166 2.662 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -9.127 -11.215 4.395 1.00 0.00 H new ATOM 0 HE ARG A 100 -10.863 -13.118 3.110 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -7.434 -12.664 3.964 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -7.117 -14.401 4.031 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -10.431 -15.308 3.188 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -8.814 -15.893 3.591 1.00 0.00 H new ATOM 1187 N ALA A 101 -13.243 -8.024 5.555 1.00 0.00 N ATOM 1188 CA ALA A 101 -13.160 -6.590 5.792 1.00 0.00 C ATOM 1189 C ALA A 101 -11.732 -6.138 6.000 1.00 0.00 C ATOM 1190 O ALA A 101 -11.065 -6.599 6.931 1.00 0.00 O ATOM 1191 CB ALA A 101 -14.011 -6.202 6.987 1.00 0.00 C ATOM 0 H ALA A 101 -13.493 -8.570 6.379 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.541 -6.088 4.903 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -13.939 -5.127 7.152 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -15.050 -6.471 6.796 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -13.656 -6.729 7.873 1.00 0.00 H new ATOM 1197 N LEU A 102 -11.281 -5.248 5.136 1.00 0.00 N ATOM 1198 CA LEU A 102 -9.952 -4.675 5.194 1.00 0.00 C ATOM 1199 C LEU A 102 -9.745 -3.811 6.404 1.00 0.00 C ATOM 1200 O LEU A 102 -10.673 -3.137 6.887 1.00 0.00 O ATOM 1201 CB LEU A 102 -9.658 -3.833 3.954 1.00 0.00 C ATOM 1202 CG LEU A 102 -9.032 -4.538 2.765 1.00 0.00 C ATOM 1203 CD1 LEU A 102 -8.827 -3.547 1.638 1.00 0.00 C ATOM 1204 CD2 LEU A 102 -7.699 -5.109 3.184 1.00 0.00 C ATOM 0 H LEU A 102 -11.841 -4.897 4.359 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.270 -5.524 5.247 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -10.593 -3.381 3.624 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.997 -3.018 4.249 1.00 0.00 H new ATOM 0 HG LEU A 102 -9.687 -5.339 2.422 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -8.377 -4.054 0.785 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -9.789 -3.126 1.344 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -8.167 -2.746 1.973 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -7.239 -5.619 2.337 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -7.047 -4.303 3.520 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.847 -5.819 3.998 1.00 0.00 H new ATOM 1216 N LYS A 103 -8.541 -3.821 6.892 1.00 0.00 N ATOM 1217 CA LYS A 103 -8.167 -2.973 7.969 1.00 0.00 C ATOM 1218 C LYS A 103 -7.045 -2.088 7.523 1.00 0.00 C ATOM 1219 O LYS A 103 -6.005 -2.568 7.142 1.00 0.00 O ATOM 1220 CB LYS A 103 -7.751 -3.765 9.216 1.00 0.00 C ATOM 1221 CG LYS A 103 -7.351 -2.896 10.420 1.00 0.00 C ATOM 1222 CD LYS A 103 -8.510 -2.020 10.882 1.00 0.00 C ATOM 1223 CE LYS A 103 -8.154 -1.149 12.078 1.00 0.00 C ATOM 1224 NZ LYS A 103 -7.105 -0.152 11.759 1.00 0.00 N ATOM 0 H LYS A 103 -7.792 -4.422 6.549 1.00 0.00 H new ATOM 0 HA LYS A 103 -9.035 -2.375 8.248 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -8.576 -4.414 9.511 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -6.913 -4.412 8.957 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.027 -3.536 11.241 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.502 -2.267 10.151 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -8.829 -1.383 10.057 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -9.358 -2.654 11.141 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -9.048 -0.632 12.427 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -7.812 -1.783 12.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -7.333 0.752 12.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -6.185 -0.494 12.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -7.060 -0.013 10.729 1.00 0.00 H new ATOM 1238 N ILE A 104 -7.254 -0.812 7.536 1.00 0.00 N ATOM 1239 CA ILE A 104 -6.198 0.086 7.155 1.00 0.00 C ATOM 1240 C ILE A 104 -5.848 0.887 8.380 1.00 0.00 C ATOM 1241 O ILE A 104 -6.737 1.205 9.188 1.00 0.00 O ATOM 1242 CB ILE A 104 -6.589 1.068 6.019 1.00 0.00 C ATOM 1243 CG1 ILE A 104 -7.589 0.440 5.039 1.00 0.00 C ATOM 1244 CG2 ILE A 104 -5.328 1.479 5.255 1.00 0.00 C ATOM 1245 CD1 ILE A 104 -7.075 -0.768 4.268 1.00 0.00 C ATOM 0 H ILE A 104 -8.132 -0.366 7.802 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.368 -0.509 6.773 1.00 0.00 H new ATOM 0 HB ILE A 104 -7.065 1.936 6.474 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -8.479 0.144 5.594 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -7.898 1.202 4.324 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -5.596 2.169 4.455 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -4.632 1.967 5.937 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -4.857 0.594 4.828 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -7.857 -1.136 3.604 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -6.205 -0.480 3.678 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -6.794 -1.554 4.969 1.00 0.00 H new ATOM 1257 N ASP A 105 -4.591 1.104 8.592 1.00 0.00 N ATOM 1258 CA ASP A 105 -4.122 1.880 9.723 1.00 0.00 C ATOM 1259 C ASP A 105 -2.895 2.651 9.293 1.00 0.00 C ATOM 1260 O ASP A 105 -2.179 2.206 8.399 1.00 0.00 O ATOM 1261 CB ASP A 105 -3.785 0.922 10.857 1.00 0.00 C ATOM 1262 CG ASP A 105 -3.487 1.574 12.191 1.00 0.00 C ATOM 1263 OD1 ASP A 105 -4.356 2.281 12.728 1.00 0.00 O ATOM 1264 OD2 ASP A 105 -2.422 1.307 12.770 1.00 0.00 O ATOM 0 H ASP A 105 -3.847 0.752 7.990 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.883 2.582 10.066 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.619 0.232 10.987 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.921 0.326 10.562 1.00 0.00 H new ATOM 1269 N HIS A 106 -2.656 3.786 9.877 1.00 0.00 N ATOM 1270 CA HIS A 106 -1.454 4.550 9.562 1.00 0.00 C ATOM 1271 C HIS A 106 -0.322 4.010 10.385 1.00 0.00 C ATOM 1272 O HIS A 106 -0.460 3.847 11.599 1.00 0.00 O ATOM 1273 CB HIS A 106 -1.616 6.054 9.827 1.00 0.00 C ATOM 1274 CG HIS A 106 -2.577 6.761 8.922 1.00 0.00 C ATOM 1275 ND1 HIS A 106 -2.194 7.602 7.899 1.00 0.00 N ATOM 1276 CD2 HIS A 106 -3.924 6.774 8.924 1.00 0.00 C ATOM 1277 CE1 HIS A 106 -3.287 8.087 7.330 1.00 0.00 C ATOM 1278 NE2 HIS A 106 -4.373 7.616 7.913 1.00 0.00 N ATOM 0 H HIS A 106 -3.265 4.215 10.574 1.00 0.00 H new ATOM 0 HA HIS A 106 -1.255 4.441 8.496 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -1.944 6.192 10.857 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -0.640 6.530 9.737 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -4.555 6.219 9.603 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -3.289 8.777 6.499 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -5.342 7.826 7.672 1.00 0.00 H new ATOM 1286 N THR A 107 0.774 3.739 9.760 1.00 0.00 N ATOM 1287 CA THR A 107 1.891 3.145 10.423 1.00 0.00 C ATOM 1288 C THR A 107 3.136 3.670 9.717 1.00 0.00 C ATOM 1289 O THR A 107 3.019 4.222 8.624 1.00 0.00 O ATOM 1290 CB THR A 107 1.818 1.565 10.287 1.00 0.00 C ATOM 1291 OG1 THR A 107 2.668 0.921 11.245 1.00 0.00 O ATOM 1292 CG2 THR A 107 2.253 1.119 8.886 1.00 0.00 C ATOM 0 H THR A 107 0.923 3.924 8.768 1.00 0.00 H new ATOM 0 HA THR A 107 1.903 3.391 11.485 1.00 0.00 H new ATOM 0 HB THR A 107 0.782 1.278 10.466 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.602 -0.051 11.140 1.00 0.00 H new ATOM 0 HG21 THR A 107 2.195 0.033 8.816 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.595 1.566 8.141 1.00 0.00 H new ATOM 0 HG23 THR A 107 3.279 1.440 8.704 1.00 0.00 H new ATOM 1300 N PHE A 108 4.287 3.546 10.319 1.00 0.00 N ATOM 1301 CA PHE A 108 5.491 3.875 9.620 1.00 0.00 C ATOM 1302 C PHE A 108 6.214 2.579 9.358 1.00 0.00 C ATOM 1303 O PHE A 108 6.711 1.929 10.273 1.00 0.00 O ATOM 1304 CB PHE A 108 6.356 4.851 10.421 1.00 0.00 C ATOM 1305 CG PHE A 108 5.677 6.171 10.688 1.00 0.00 C ATOM 1306 CD1 PHE A 108 5.602 7.140 9.697 1.00 0.00 C ATOM 1307 CD2 PHE A 108 5.102 6.433 11.921 1.00 0.00 C ATOM 1308 CE1 PHE A 108 4.969 8.345 9.934 1.00 0.00 C ATOM 1309 CE2 PHE A 108 4.468 7.636 12.164 1.00 0.00 C ATOM 1310 CZ PHE A 108 4.401 8.595 11.169 1.00 0.00 C ATOM 0 H PHE A 108 4.413 3.224 11.279 1.00 0.00 H new ATOM 0 HA PHE A 108 5.263 4.381 8.682 1.00 0.00 H new ATOM 0 HB2 PHE A 108 6.626 4.391 11.371 1.00 0.00 H new ATOM 0 HB3 PHE A 108 7.285 5.031 9.879 1.00 0.00 H new ATOM 0 HD1 PHE A 108 6.043 6.950 8.730 1.00 0.00 H new ATOM 0 HD2 PHE A 108 5.150 5.688 12.701 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.918 9.091 9.155 1.00 0.00 H new ATOM 0 HE2 PHE A 108 4.025 7.828 13.130 1.00 0.00 H new ATOM 0 HZ PHE A 108 3.906 9.536 11.357 1.00 0.00 H new ATOM 1320 N TYR A 109 6.278 2.218 8.125 1.00 0.00 N ATOM 1321 CA TYR A 109 6.810 0.949 7.723 1.00 0.00 C ATOM 1322 C TYR A 109 8.184 1.129 7.125 1.00 0.00 C ATOM 1323 O TYR A 109 8.413 2.073 6.381 1.00 0.00 O ATOM 1324 CB TYR A 109 5.839 0.318 6.714 1.00 0.00 C ATOM 1325 CG TYR A 109 6.219 -1.047 6.175 1.00 0.00 C ATOM 1326 CD1 TYR A 109 7.127 -1.170 5.137 1.00 0.00 C ATOM 1327 CD2 TYR A 109 5.650 -2.202 6.686 1.00 0.00 C ATOM 1328 CE1 TYR A 109 7.466 -2.389 4.626 1.00 0.00 C ATOM 1329 CE2 TYR A 109 5.981 -3.440 6.174 1.00 0.00 C ATOM 1330 CZ TYR A 109 6.893 -3.528 5.142 1.00 0.00 C ATOM 1331 OH TYR A 109 7.229 -4.766 4.628 1.00 0.00 O ATOM 0 H TYR A 109 5.959 2.800 7.350 1.00 0.00 H new ATOM 0 HA TYR A 109 6.913 0.288 8.583 1.00 0.00 H new ATOM 0 HB2 TYR A 109 4.860 0.238 7.186 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.732 1.000 5.871 1.00 0.00 H new ATOM 0 HD1 TYR A 109 7.577 -0.280 4.722 1.00 0.00 H new ATOM 0 HD2 TYR A 109 4.938 -2.133 7.495 1.00 0.00 H new ATOM 0 HE1 TYR A 109 8.181 -2.459 3.820 1.00 0.00 H new ATOM 0 HE2 TYR A 109 5.529 -4.334 6.578 1.00 0.00 H new ATOM 0 HH TYR A 109 6.735 -5.464 5.106 1.00 0.00 H new ATOM 1497 N ILE B 226 -7.137 15.023 -5.000 1.00 0.00 N ATOM 1498 CA ILE B 226 -5.924 14.386 -5.419 1.00 0.00 C ATOM 1499 C ILE B 226 -6.220 13.572 -6.656 1.00 0.00 C ATOM 1500 O ILE B 226 -7.255 12.887 -6.722 1.00 0.00 O ATOM 1501 CB ILE B 226 -5.270 13.475 -4.303 1.00 0.00 C ATOM 1502 CG1 ILE B 226 -4.718 14.291 -3.132 1.00 0.00 C ATOM 1503 CG2 ILE B 226 -4.183 12.587 -4.852 1.00 0.00 C ATOM 1504 CD1 ILE B 226 -5.743 14.726 -2.136 1.00 0.00 C ATOM 0 HA ILE B 226 -5.192 15.166 -5.627 1.00 0.00 H new ATOM 0 HB ILE B 226 -6.080 12.845 -3.934 1.00 0.00 H new ATOM 0 HG12 ILE B 226 -3.961 13.698 -2.619 1.00 0.00 H new ATOM 0 HG13 ILE B 226 -4.217 15.175 -3.527 1.00 0.00 H new ATOM 0 HG21 ILE B 226 -3.766 11.982 -4.047 1.00 0.00 H new ATOM 0 HG22 ILE B 226 -4.599 11.934 -5.619 1.00 0.00 H new ATOM 0 HG23 ILE B 226 -3.396 13.202 -5.288 1.00 0.00 H new ATOM 0 HD11 ILE B 226 -5.260 15.297 -1.343 1.00 0.00 H new ATOM 0 HD12 ILE B 226 -6.489 15.349 -2.630 1.00 0.00 H new ATOM 0 HD13 ILE B 226 -6.229 13.849 -1.707 1.00 0.00 H new ATOM 1516 N MET B 227 -5.341 13.667 -7.623 1.00 0.00 N ATOM 1517 CA MET B 227 -5.485 12.956 -8.866 1.00 0.00 C ATOM 1518 C MET B 227 -5.315 11.468 -8.626 1.00 0.00 C ATOM 1519 O MET B 227 -4.446 11.060 -7.846 1.00 0.00 O ATOM 1520 CB MET B 227 -4.447 13.444 -9.874 1.00 0.00 C ATOM 1521 CG MET B 227 -4.607 14.896 -10.269 1.00 0.00 C ATOM 1522 SD MET B 227 -3.243 15.498 -11.280 1.00 0.00 S ATOM 1523 CE MET B 227 -3.781 17.184 -11.574 1.00 0.00 C ATOM 0 H MET B 227 -4.501 14.243 -7.568 1.00 0.00 H new ATOM 0 HA MET B 227 -6.480 13.143 -9.270 1.00 0.00 H new ATOM 0 HB2 MET B 227 -3.452 13.300 -9.453 1.00 0.00 H new ATOM 0 HB3 MET B 227 -4.507 12.826 -10.770 1.00 0.00 H new ATOM 0 HG2 MET B 227 -5.541 15.018 -10.817 1.00 0.00 H new ATOM 0 HG3 MET B 227 -4.683 15.506 -9.369 1.00 0.00 H new ATOM 0 HE1 MET B 227 -3.043 17.699 -12.189 1.00 0.00 H new ATOM 0 HE2 MET B 227 -4.741 17.175 -12.090 1.00 0.00 H new ATOM 0 HE3 MET B 227 -3.886 17.704 -10.622 1.00 0.00 H new ATOM 1533 N PRO B 228 -6.158 10.647 -9.245 1.00 0.00 N ATOM 1534 CA PRO B 228 -6.071 9.203 -9.111 1.00 0.00 C ATOM 1535 C PRO B 228 -4.805 8.661 -9.776 1.00 0.00 C ATOM 1536 O PRO B 228 -4.338 9.206 -10.789 1.00 0.00 O ATOM 1537 CB PRO B 228 -7.326 8.695 -9.836 1.00 0.00 C ATOM 1538 CG PRO B 228 -7.679 9.782 -10.789 1.00 0.00 C ATOM 1539 CD PRO B 228 -7.275 11.059 -10.120 1.00 0.00 C ATOM 0 HA PRO B 228 -6.020 8.882 -8.071 1.00 0.00 H new ATOM 0 HB2 PRO B 228 -7.130 7.759 -10.359 1.00 0.00 H new ATOM 0 HB3 PRO B 228 -8.138 8.504 -9.135 1.00 0.00 H new ATOM 0 HG2 PRO B 228 -7.157 9.655 -11.737 1.00 0.00 H new ATOM 0 HG3 PRO B 228 -8.746 9.777 -11.010 1.00 0.00 H new ATOM 0 HD2 PRO B 228 -6.962 11.811 -10.844 1.00 0.00 H new ATOM 0 HD3 PRO B 228 -8.096 11.490 -9.548 1.00 0.00 H new ATOM 1547 N GLY B 229 -4.255 7.618 -9.204 1.00 0.00 N ATOM 1548 CA GLY B 229 -3.060 7.007 -9.727 1.00 0.00 C ATOM 1549 C GLY B 229 -3.284 6.371 -11.079 1.00 0.00 C ATOM 1550 O GLY B 229 -4.421 6.059 -11.458 1.00 0.00 O ATOM 0 H GLY B 229 -4.623 7.170 -8.365 1.00 0.00 H new ATOM 0 HA2 GLY B 229 -2.276 7.760 -9.808 1.00 0.00 H new ATOM 0 HA3 GLY B 229 -2.705 6.251 -9.027 1.00 0.00 H new ATOM 1554 N SER B 230 -2.217 6.143 -11.782 1.00 0.00 N ATOM 1555 CA SER B 230 -2.256 5.590 -13.115 1.00 0.00 C ATOM 1556 C SER B 230 -2.575 4.088 -13.100 1.00 0.00 C ATOM 1557 O SER B 230 -2.870 3.490 -14.138 1.00 0.00 O ATOM 1558 CB SER B 230 -0.954 5.889 -13.836 1.00 0.00 C ATOM 1559 OG SER B 230 -0.700 7.286 -13.824 1.00 0.00 O ATOM 0 H SER B 230 -1.274 6.337 -11.445 1.00 0.00 H new ATOM 0 HA SER B 230 -3.068 6.067 -13.664 1.00 0.00 H new ATOM 0 HB2 SER B 230 -0.133 5.358 -13.355 1.00 0.00 H new ATOM 0 HB3 SER B 230 -1.007 5.530 -14.864 1.00 0.00 H new ATOM 0 HG SER B 230 0.143 7.469 -14.290 1.00 0.00 H new ATOM 1565 N ARG B 231 -2.505 3.488 -11.926 1.00 0.00 N ATOM 1566 CA ARG B 231 -2.813 2.070 -11.753 1.00 0.00 C ATOM 1567 C ARG B 231 -4.336 1.864 -11.713 1.00 0.00 C ATOM 1568 O ARG B 231 -4.827 0.749 -11.850 1.00 0.00 O ATOM 1569 CB ARG B 231 -2.229 1.572 -10.426 1.00 0.00 C ATOM 1570 CG ARG B 231 -0.719 1.728 -10.244 1.00 0.00 C ATOM 1571 CD ARG B 231 0.087 0.748 -11.084 1.00 0.00 C ATOM 1572 NE ARG B 231 0.020 1.008 -12.525 1.00 0.00 N ATOM 1573 CZ ARG B 231 -0.376 0.126 -13.446 1.00 0.00 C ATOM 1574 NH1 ARG B 231 -0.900 -1.032 -13.074 1.00 0.00 N ATOM 1575 NH2 ARG B 231 -0.267 0.415 -14.733 1.00 0.00 N ATOM 0 H ARG B 231 -2.235 3.963 -11.065 1.00 0.00 H new ATOM 0 HA ARG B 231 -2.382 1.518 -12.588 1.00 0.00 H new ATOM 0 HB2 ARG B 231 -2.727 2.102 -9.614 1.00 0.00 H new ATOM 0 HB3 ARG B 231 -2.478 0.516 -10.318 1.00 0.00 H new ATOM 0 HG2 ARG B 231 -0.430 2.746 -10.507 1.00 0.00 H new ATOM 0 HG3 ARG B 231 -0.469 1.587 -9.192 1.00 0.00 H new ATOM 0 HD2 ARG B 231 1.129 0.783 -10.766 1.00 0.00 H new ATOM 0 HD3 ARG B 231 -0.272 -0.263 -10.890 1.00 0.00 H new ATOM 0 HE ARG B 231 0.297 1.934 -12.849 1.00 0.00 H new ATOM 0 HH11 ARG B 231 -1.001 -1.251 -12.083 1.00 0.00 H new ATOM 0 HH12 ARG B 231 -1.202 -1.705 -13.779 1.00 0.00 H new ATOM 0 HH21 ARG B 231 0.120 1.313 -15.023 1.00 0.00 H new ATOM 0 HH22 ARG B 231 -0.570 -0.260 -15.435 1.00 0.00 H new ATOM 1589 N TRP B 232 -5.063 2.953 -11.536 1.00 0.00 N ATOM 1590 CA TRP B 232 -6.510 2.923 -11.392 1.00 0.00 C ATOM 1591 C TRP B 232 -7.211 2.605 -12.711 1.00 0.00 C ATOM 1592 O TRP B 232 -7.001 3.295 -13.714 1.00 0.00 O ATOM 1593 CB TRP B 232 -7.001 4.264 -10.844 1.00 0.00 C ATOM 1594 CG TRP B 232 -8.464 4.320 -10.655 1.00 0.00 C ATOM 1595 CD1 TRP B 232 -9.203 3.483 -9.903 1.00 0.00 C ATOM 1596 CD2 TRP B 232 -9.372 5.273 -11.213 1.00 0.00 C ATOM 1597 NE1 TRP B 232 -10.505 3.827 -9.976 1.00 0.00 N ATOM 1598 CE2 TRP B 232 -10.644 4.928 -10.760 1.00 0.00 C ATOM 1599 CE3 TRP B 232 -9.230 6.377 -12.047 1.00 0.00 C ATOM 1600 CZ2 TRP B 232 -11.785 5.639 -11.111 1.00 0.00 C ATOM 1601 CZ3 TRP B 232 -10.357 7.093 -12.400 1.00 0.00 C ATOM 1602 CH2 TRP B 232 -11.622 6.720 -11.930 1.00 0.00 C ATOM 0 H TRP B 232 -4.664 3.890 -11.488 1.00 0.00 H new ATOM 0 HA TRP B 232 -6.759 2.125 -10.692 1.00 0.00 H new ATOM 0 HB2 TRP B 232 -6.511 4.459 -9.890 1.00 0.00 H new ATOM 0 HB3 TRP B 232 -6.700 5.059 -11.526 1.00 0.00 H new ATOM 0 HD1 TRP B 232 -8.811 2.658 -9.327 1.00 0.00 H new ATOM 0 HE1 TRP B 232 -11.269 3.335 -9.513 1.00 0.00 H new ATOM 0 HE3 TRP B 232 -8.256 6.669 -12.412 1.00 0.00 H new ATOM 0 HZ2 TRP B 232 -12.761 5.349 -10.751 1.00 0.00 H new ATOM 0 HZ3 TRP B 232 -10.261 7.952 -13.047 1.00 0.00 H new ATOM 0 HH2 TRP B 232 -12.486 7.299 -12.221 1.00 0.00 H new ATOM 1613 N ASP B 233 -8.014 1.548 -12.716 1.00 0.00 N ATOM 1614 CA ASP B 233 -8.777 1.179 -13.911 1.00 0.00 C ATOM 1615 C ASP B 233 -10.242 1.044 -13.569 1.00 0.00 C ATOM 1616 O ASP B 233 -10.616 0.042 -13.010 1.00 0.00 O ATOM 1617 CB ASP B 233 -8.292 -0.185 -14.406 1.00 0.00 C ATOM 1618 CG ASP B 233 -9.016 -0.688 -15.652 1.00 0.00 C ATOM 1619 OD1 ASP B 233 -8.673 -0.273 -16.774 1.00 0.00 O ATOM 1620 OD2 ASP B 233 -9.914 -1.544 -15.529 1.00 0.00 O ATOM 0 H ASP B 233 -8.156 0.933 -11.915 1.00 0.00 H new ATOM 0 HA ASP B 233 -8.637 1.949 -14.670 1.00 0.00 H new ATOM 0 HB2 ASP B 233 -7.225 -0.124 -14.619 1.00 0.00 H new ATOM 0 HB3 ASP B 233 -8.417 -0.915 -13.606 1.00 0.00 H new ATOM 1625 N GLY B 234 -11.057 2.010 -13.979 1.00 0.00 N ATOM 1626 CA GLY B 234 -12.539 1.992 -13.796 1.00 0.00 C ATOM 1627 C GLY B 234 -13.047 1.361 -12.488 1.00 0.00 C ATOM 1628 O GLY B 234 -14.060 0.663 -12.488 1.00 0.00 O ATOM 0 H GLY B 234 -10.722 2.847 -14.456 1.00 0.00 H new ATOM 0 HA2 GLY B 234 -12.905 3.018 -13.848 1.00 0.00 H new ATOM 0 HA3 GLY B 234 -12.983 1.453 -14.633 1.00 0.00 H new ATOM 1714 N GLY B 240 -17.620 3.676 2.596 1.00 0.00 N ATOM 1715 CA GLY B 240 -18.381 4.772 3.039 1.00 0.00 C ATOM 1716 C GLY B 240 -18.976 5.456 1.850 1.00 0.00 C ATOM 1717 O GLY B 240 -18.613 6.556 1.516 1.00 0.00 O ATOM 0 HA2 GLY B 240 -19.168 4.437 3.715 1.00 0.00 H new ATOM 0 HA3 GLY B 240 -17.754 5.466 3.599 1.00 0.00 H new ATOM 1721 N PHE B 241 -19.818 4.746 1.157 1.00 0.00 N ATOM 1722 CA PHE B 241 -20.485 5.268 -0.021 1.00 0.00 C ATOM 1723 C PHE B 241 -21.623 6.222 0.343 1.00 0.00 C ATOM 1724 O PHE B 241 -21.844 7.227 -0.332 1.00 0.00 O ATOM 1725 CB PHE B 241 -20.965 4.120 -0.949 1.00 0.00 C ATOM 1726 CG PHE B 241 -21.766 3.027 -0.265 1.00 0.00 C ATOM 1727 CD1 PHE B 241 -23.129 3.158 -0.061 1.00 0.00 C ATOM 1728 CD2 PHE B 241 -21.142 1.869 0.170 1.00 0.00 C ATOM 1729 CE1 PHE B 241 -23.852 2.163 0.563 1.00 0.00 C ATOM 1730 CE2 PHE B 241 -21.858 0.871 0.794 1.00 0.00 C ATOM 1731 CZ PHE B 241 -23.215 1.018 0.991 1.00 0.00 C ATOM 0 H PHE B 241 -20.069 3.784 1.386 1.00 0.00 H new ATOM 0 HA PHE B 241 -19.754 5.854 -0.578 1.00 0.00 H new ATOM 0 HB2 PHE B 241 -21.573 4.549 -1.746 1.00 0.00 H new ATOM 0 HB3 PHE B 241 -20.093 3.668 -1.421 1.00 0.00 H new ATOM 0 HD1 PHE B 241 -23.634 4.052 -0.395 1.00 0.00 H new ATOM 0 HD2 PHE B 241 -20.080 1.747 0.018 1.00 0.00 H new ATOM 0 HE1 PHE B 241 -24.915 2.281 0.716 1.00 0.00 H new ATOM 0 HE2 PHE B 241 -21.357 -0.025 1.129 1.00 0.00 H new ATOM 0 HZ PHE B 241 -23.778 0.237 1.480 1.00 0.00 H new ATOM 1741 N GLU B 242 -22.301 5.919 1.430 1.00 0.00 N ATOM 1742 CA GLU B 242 -23.456 6.684 1.870 1.00 0.00 C ATOM 1743 C GLU B 242 -23.060 8.096 2.317 1.00 0.00 C ATOM 1744 O GLU B 242 -23.718 9.080 1.962 1.00 0.00 O ATOM 1745 CB GLU B 242 -24.188 5.931 2.974 1.00 0.00 C ATOM 1746 CG GLU B 242 -25.386 6.644 3.534 1.00 0.00 C ATOM 1747 CD GLU B 242 -26.033 5.862 4.628 1.00 0.00 C ATOM 1748 OE1 GLU B 242 -25.496 5.837 5.753 1.00 0.00 O ATOM 1749 OE2 GLU B 242 -27.085 5.225 4.384 1.00 0.00 O ATOM 0 H GLU B 242 -22.068 5.133 2.037 1.00 0.00 H new ATOM 0 HA GLU B 242 -24.134 6.802 1.025 1.00 0.00 H new ATOM 0 HB2 GLU B 242 -24.507 4.964 2.585 1.00 0.00 H new ATOM 0 HB3 GLU B 242 -23.488 5.733 3.786 1.00 0.00 H new ATOM 0 HG2 GLU B 242 -25.084 7.620 3.914 1.00 0.00 H new ATOM 0 HG3 GLU B 242 -26.109 6.822 2.738 1.00 0.00 H new ATOM 1756 N GLU B 243 -21.953 8.190 3.048 1.00 0.00 N ATOM 1757 CA GLU B 243 -21.437 9.461 3.557 1.00 0.00 C ATOM 1758 C GLU B 243 -21.166 10.442 2.433 1.00 0.00 C ATOM 1759 O GLU B 243 -21.300 11.643 2.601 1.00 0.00 O ATOM 1760 CB GLU B 243 -20.177 9.277 4.397 1.00 0.00 C ATOM 1761 CG GLU B 243 -19.030 8.601 3.669 1.00 0.00 C ATOM 1762 CD GLU B 243 -17.809 8.461 4.525 1.00 0.00 C ATOM 1763 OE1 GLU B 243 -17.673 7.447 5.237 1.00 0.00 O ATOM 1764 OE2 GLU B 243 -16.947 9.365 4.506 1.00 0.00 O ATOM 0 H GLU B 243 -21.384 7.384 3.306 1.00 0.00 H new ATOM 0 HA GLU B 243 -22.216 9.870 4.200 1.00 0.00 H new ATOM 0 HB2 GLU B 243 -19.843 10.254 4.748 1.00 0.00 H new ATOM 0 HB3 GLU B 243 -20.427 8.689 5.280 1.00 0.00 H new ATOM 0 HG2 GLU B 243 -19.349 7.614 3.333 1.00 0.00 H new ATOM 0 HG3 GLU B 243 -18.781 9.176 2.778 1.00 0.00 H new ATOM 1771 N LYS B 244 -20.749 9.912 1.308 1.00 0.00 N ATOM 1772 CA LYS B 244 -20.417 10.695 0.138 1.00 0.00 C ATOM 1773 C LYS B 244 -21.653 11.440 -0.338 1.00 0.00 C ATOM 1774 O LYS B 244 -21.610 12.651 -0.595 1.00 0.00 O ATOM 1775 CB LYS B 244 -19.921 9.757 -0.946 1.00 0.00 C ATOM 1776 CG LYS B 244 -18.826 8.809 -0.478 1.00 0.00 C ATOM 1777 CD LYS B 244 -17.489 9.474 -0.288 1.00 0.00 C ATOM 1778 CE LYS B 244 -16.424 8.443 0.076 1.00 0.00 C ATOM 1779 NZ LYS B 244 -15.081 9.038 0.165 1.00 0.00 N ATOM 0 H LYS B 244 -20.628 8.908 1.176 1.00 0.00 H new ATOM 0 HA LYS B 244 -19.640 11.422 0.376 1.00 0.00 H new ATOM 0 HB2 LYS B 244 -20.761 9.172 -1.321 1.00 0.00 H new ATOM 0 HB3 LYS B 244 -19.546 10.347 -1.782 1.00 0.00 H new ATOM 0 HG2 LYS B 244 -19.131 8.352 0.463 1.00 0.00 H new ATOM 0 HG3 LYS B 244 -18.721 8.003 -1.204 1.00 0.00 H new ATOM 0 HD2 LYS B 244 -17.202 9.994 -1.202 1.00 0.00 H new ATOM 0 HD3 LYS B 244 -17.559 10.226 0.498 1.00 0.00 H new ATOM 0 HE2 LYS B 244 -16.679 7.981 1.030 1.00 0.00 H new ATOM 0 HE3 LYS B 244 -16.419 7.649 -0.671 1.00 0.00 H new ATOM 0 HZ1 LYS B 244 -14.391 8.301 0.414 1.00 0.00 H new ATOM 0 HZ2 LYS B 244 -14.825 9.456 -0.752 1.00 0.00 H new ATOM 0 HZ3 LYS B 244 -15.077 9.778 0.896 1.00 0.00 H new ATOM 1793 N TRP B 245 -22.759 10.724 -0.399 1.00 0.00 N ATOM 1794 CA TRP B 245 -24.031 11.289 -0.808 1.00 0.00 C ATOM 1795 C TRP B 245 -24.524 12.234 0.255 1.00 0.00 C ATOM 1796 O TRP B 245 -25.030 13.301 -0.039 1.00 0.00 O ATOM 1797 CB TRP B 245 -25.072 10.204 -1.025 1.00 0.00 C ATOM 1798 CG TRP B 245 -24.625 9.118 -1.928 1.00 0.00 C ATOM 1799 CD1 TRP B 245 -23.870 9.242 -3.054 1.00 0.00 C ATOM 1800 CD2 TRP B 245 -24.933 7.738 -1.796 1.00 0.00 C ATOM 1801 NE1 TRP B 245 -23.658 8.017 -3.604 1.00 0.00 N ATOM 1802 CE2 TRP B 245 -24.312 7.073 -2.860 1.00 0.00 C ATOM 1803 CE3 TRP B 245 -25.669 6.999 -0.871 1.00 0.00 C ATOM 1804 CZ2 TRP B 245 -24.404 5.702 -3.028 1.00 0.00 C ATOM 1805 CZ3 TRP B 245 -25.761 5.640 -1.040 1.00 0.00 C ATOM 1806 CH2 TRP B 245 -25.134 5.002 -2.111 1.00 0.00 C ATOM 0 H TRP B 245 -22.801 9.732 -0.166 1.00 0.00 H new ATOM 0 HA TRP B 245 -23.880 11.819 -1.749 1.00 0.00 H new ATOM 0 HB2 TRP B 245 -25.341 9.774 -0.060 1.00 0.00 H new ATOM 0 HB3 TRP B 245 -25.975 10.657 -1.435 1.00 0.00 H new ATOM 0 HD1 TRP B 245 -23.496 10.174 -3.451 1.00 0.00 H new ATOM 0 HE1 TRP B 245 -23.101 7.831 -4.438 1.00 0.00 H new ATOM 0 HE3 TRP B 245 -26.156 7.486 -0.039 1.00 0.00 H new ATOM 0 HZ2 TRP B 245 -23.917 5.205 -3.854 1.00 0.00 H new ATOM 0 HZ3 TRP B 245 -26.328 5.054 -0.332 1.00 0.00 H new ATOM 0 HH2 TRP B 245 -25.228 3.931 -2.217 1.00 0.00 H new ATOM 1817 N PHE B 246 -24.318 11.850 1.497 1.00 0.00 N ATOM 1818 CA PHE B 246 -24.714 12.634 2.644 1.00 0.00 C ATOM 1819 C PHE B 246 -23.989 13.975 2.665 1.00 0.00 C ATOM 1820 O PHE B 246 -24.535 14.982 3.077 1.00 0.00 O ATOM 1821 CB PHE B 246 -24.454 11.812 3.917 1.00 0.00 C ATOM 1822 CG PHE B 246 -24.244 12.606 5.166 1.00 0.00 C ATOM 1823 CD1 PHE B 246 -25.306 13.082 5.907 1.00 0.00 C ATOM 1824 CD2 PHE B 246 -22.957 12.879 5.582 1.00 0.00 C ATOM 1825 CE1 PHE B 246 -25.082 13.823 7.052 1.00 0.00 C ATOM 1826 CE2 PHE B 246 -22.720 13.616 6.716 1.00 0.00 C ATOM 1827 CZ PHE B 246 -23.785 14.093 7.458 1.00 0.00 C ATOM 0 H PHE B 246 -23.863 10.970 1.740 1.00 0.00 H new ATOM 0 HA PHE B 246 -25.778 12.863 2.589 1.00 0.00 H new ATOM 0 HB2 PHE B 246 -25.298 11.140 4.073 1.00 0.00 H new ATOM 0 HB3 PHE B 246 -23.575 11.188 3.752 1.00 0.00 H new ATOM 0 HD1 PHE B 246 -26.318 12.875 5.591 1.00 0.00 H new ATOM 0 HD2 PHE B 246 -22.122 12.507 5.006 1.00 0.00 H new ATOM 0 HE1 PHE B 246 -25.917 14.191 7.630 1.00 0.00 H new ATOM 0 HE2 PHE B 246 -21.707 13.822 7.027 1.00 0.00 H new ATOM 0 HZ PHE B 246 -23.606 14.674 8.351 1.00 0.00 H new ATOM 1837 N ALA B 247 -22.785 13.975 2.195 1.00 0.00 N ATOM 1838 CA ALA B 247 -21.982 15.157 2.155 1.00 0.00 C ATOM 1839 C ALA B 247 -22.407 16.091 1.015 1.00 0.00 C ATOM 1840 O ALA B 247 -22.322 17.311 1.139 1.00 0.00 O ATOM 1841 CB ALA B 247 -20.530 14.761 2.026 1.00 0.00 C ATOM 0 H ALA B 247 -22.324 13.145 1.823 1.00 0.00 H new ATOM 0 HA ALA B 247 -22.124 15.713 3.082 1.00 0.00 H new ATOM 0 HB1 ALA B 247 -19.910 15.657 1.995 1.00 0.00 H new ATOM 0 HB2 ALA B 247 -20.242 14.150 2.882 1.00 0.00 H new ATOM 0 HB3 ALA B 247 -20.389 14.190 1.108 1.00 0.00 H new ATOM 1847 N LYS B 248 -22.909 15.532 -0.075 1.00 0.00 N ATOM 1848 CA LYS B 248 -23.265 16.340 -1.229 1.00 0.00 C ATOM 1849 C LYS B 248 -24.744 16.675 -1.257 1.00 0.00 C ATOM 1850 O LYS B 248 -25.160 17.534 -1.989 1.00 0.00 O ATOM 1851 CB LYS B 248 -22.851 15.638 -2.524 1.00 0.00 C ATOM 1852 CG LYS B 248 -23.548 14.303 -2.782 1.00 0.00 C ATOM 1853 CD LYS B 248 -24.838 14.424 -3.620 1.00 0.00 C ATOM 1854 CE LYS B 248 -24.564 14.547 -5.126 1.00 0.00 C ATOM 1855 NZ LYS B 248 -23.913 15.813 -5.548 1.00 0.00 N ATOM 0 H LYS B 248 -23.078 14.532 -0.184 1.00 0.00 H new ATOM 0 HA LYS B 248 -22.721 17.281 -1.145 1.00 0.00 H new ATOM 0 HB2 LYS B 248 -23.053 16.305 -3.362 1.00 0.00 H new ATOM 0 HB3 LYS B 248 -21.774 15.471 -2.502 1.00 0.00 H new ATOM 0 HG2 LYS B 248 -22.855 13.635 -3.294 1.00 0.00 H new ATOM 0 HG3 LYS B 248 -23.790 13.839 -1.826 1.00 0.00 H new ATOM 0 HD2 LYS B 248 -25.465 13.551 -3.440 1.00 0.00 H new ATOM 0 HD3 LYS B 248 -25.402 15.295 -3.286 1.00 0.00 H new ATOM 0 HE2 LYS B 248 -23.934 13.713 -5.434 1.00 0.00 H new ATOM 0 HE3 LYS B 248 -25.509 14.447 -5.660 1.00 0.00 H new ATOM 0 HZ1 LYS B 248 -23.892 15.863 -6.587 1.00 0.00 H new ATOM 0 HZ2 LYS B 248 -24.450 16.621 -5.173 1.00 0.00 H new ATOM 0 HZ3 LYS B 248 -22.941 15.843 -5.180 1.00 0.00 H new ATOM 1869 N GLN B 249 -25.520 16.007 -0.428 1.00 0.00 N ATOM 1870 CA GLN B 249 -26.992 16.164 -0.393 1.00 0.00 C ATOM 1871 C GLN B 249 -27.424 17.520 0.167 1.00 0.00 C ATOM 1872 O GLN B 249 -28.616 17.800 0.315 1.00 0.00 O ATOM 1873 CB GLN B 249 -27.638 15.012 0.376 1.00 0.00 C ATOM 1874 CG GLN B 249 -27.410 15.015 1.870 1.00 0.00 C ATOM 1875 CD GLN B 249 -27.957 13.769 2.551 1.00 0.00 C ATOM 1876 OE1 GLN B 249 -27.923 12.651 1.872 1.00 0.00 O flip ATOM 1877 NE2 GLN B 249 -28.391 13.811 3.695 1.00 0.00 N flip ATOM 0 H GLN B 249 -25.163 15.333 0.250 1.00 0.00 H new ATOM 0 HA GLN B 249 -27.344 16.131 -1.424 1.00 0.00 H new ATOM 0 HB2 GLN B 249 -28.712 15.032 0.190 1.00 0.00 H new ATOM 0 HB3 GLN B 249 -27.262 14.072 -0.029 1.00 0.00 H new ATOM 0 HG2 GLN B 249 -26.341 15.094 2.070 1.00 0.00 H new ATOM 0 HG3 GLN B 249 -27.881 15.897 2.303 1.00 0.00 H new ATOM 0 HE21 GLN B 249 -28.406 14.696 4.202 1.00 0.00 H new ATOM 0 HE22 GLN B 249 -28.737 12.961 4.141 1.00 0.00 H new ATOM 1886 N ASN B 250 -26.441 18.337 0.474 1.00 0.00 N ATOM 1887 CA ASN B 250 -26.646 19.703 0.954 1.00 0.00 C ATOM 1888 C ASN B 250 -27.323 20.544 -0.110 1.00 0.00 C ATOM 1889 O ASN B 250 -28.061 21.484 0.195 1.00 0.00 O ATOM 1890 CB ASN B 250 -25.320 20.374 1.351 1.00 0.00 C ATOM 1891 CG ASN B 250 -24.364 20.585 0.196 1.00 0.00 C ATOM 1892 OD1 ASN B 250 -24.379 21.620 -0.475 1.00 0.00 O ATOM 1893 ND2 ASN B 250 -23.522 19.631 -0.030 1.00 0.00 N ATOM 0 H ASN B 250 -25.458 18.075 0.399 1.00 0.00 H new ATOM 0 HA ASN B 250 -27.282 19.638 1.837 1.00 0.00 H new ATOM 0 HB2 ASN B 250 -25.536 21.339 1.810 1.00 0.00 H new ATOM 0 HB3 ASN B 250 -24.829 19.763 2.108 1.00 0.00 H new ATOM 0 HD21 ASN B 250 -22.841 19.720 -0.784 1.00 0.00 H new ATOM 0 HD22 ASN B 250 -23.539 18.789 0.545 1.00 0.00 H new ATOM 1900 N GLU B 251 -27.058 20.200 -1.349 1.00 0.00 N ATOM 1901 CA GLU B 251 -27.606 20.887 -2.481 1.00 0.00 C ATOM 1902 C GLU B 251 -29.064 20.526 -2.684 1.00 0.00 C ATOM 1903 O GLU B 251 -29.426 19.398 -3.034 1.00 0.00 O ATOM 1904 CB GLU B 251 -26.757 20.648 -3.728 1.00 0.00 C ATOM 1905 CG GLU B 251 -26.543 19.184 -4.046 1.00 0.00 C ATOM 1906 CD GLU B 251 -25.400 18.930 -4.992 1.00 0.00 C ATOM 1907 OE1 GLU B 251 -24.368 19.638 -4.913 1.00 0.00 O ATOM 1908 OE2 GLU B 251 -25.454 17.970 -5.777 1.00 0.00 O ATOM 0 H GLU B 251 -26.446 19.422 -1.596 1.00 0.00 H new ATOM 0 HA GLU B 251 -27.577 21.959 -2.284 1.00 0.00 H new ATOM 0 HB2 GLU B 251 -27.236 21.130 -4.581 1.00 0.00 H new ATOM 0 HB3 GLU B 251 -25.787 21.127 -3.594 1.00 0.00 H new ATOM 0 HG2 GLU B 251 -26.361 18.643 -3.118 1.00 0.00 H new ATOM 0 HG3 GLU B 251 -27.458 18.778 -4.478 1.00 0.00 H new ATOM 1915 N ILE B 252 -29.884 21.467 -2.390 1.00 0.00 N ATOM 1916 CA ILE B 252 -31.306 21.306 -2.516 1.00 0.00 C ATOM 1917 C ILE B 252 -31.844 22.136 -3.647 1.00 0.00 C ATOM 1918 O ILE B 252 -32.781 21.742 -4.325 1.00 0.00 O ATOM 1919 CB ILE B 252 -32.063 21.630 -1.205 1.00 0.00 C ATOM 1920 CG1 ILE B 252 -31.734 23.033 -0.680 1.00 0.00 C ATOM 1921 CG2 ILE B 252 -31.751 20.589 -0.152 1.00 0.00 C ATOM 1922 CD1 ILE B 252 -32.521 23.429 0.553 1.00 0.00 C ATOM 0 H ILE B 252 -29.595 22.385 -2.051 1.00 0.00 H new ATOM 0 HA ILE B 252 -31.478 20.252 -2.735 1.00 0.00 H new ATOM 0 HB ILE B 252 -33.129 21.609 -1.429 1.00 0.00 H new ATOM 0 HG12 ILE B 252 -30.670 23.084 -0.451 1.00 0.00 H new ATOM 0 HG13 ILE B 252 -31.925 23.760 -1.470 1.00 0.00 H new ATOM 0 HG21 ILE B 252 -32.289 20.827 0.766 1.00 0.00 H new ATOM 0 HG22 ILE B 252 -32.060 19.606 -0.509 1.00 0.00 H new ATOM 0 HG23 ILE B 252 -30.679 20.582 0.047 1.00 0.00 H new ATOM 0 HD11 ILE B 252 -32.232 24.433 0.862 1.00 0.00 H new ATOM 0 HD12 ILE B 252 -33.587 23.412 0.325 1.00 0.00 H new ATOM 0 HD13 ILE B 252 -32.311 22.726 1.360 1.00 0.00 H new ATOM 1934 N ASN B 253 -31.251 23.282 -3.856 1.00 0.00 N ATOM 1935 CA ASN B 253 -31.680 24.151 -4.940 1.00 0.00 C ATOM 1936 C ASN B 253 -30.724 24.007 -6.087 1.00 0.00 C ATOM 1937 O ASN B 253 -31.080 24.229 -7.242 1.00 0.00 O ATOM 1938 CB ASN B 253 -31.718 25.629 -4.506 1.00 0.00 C ATOM 1939 CG ASN B 253 -30.343 26.258 -4.378 1.00 0.00 C ATOM 1940 OD1 ASN B 253 -29.830 26.866 -5.321 1.00 0.00 O ATOM 1941 ND2 ASN B 253 -29.728 26.084 -3.251 1.00 0.00 N ATOM 0 H ASN B 253 -30.475 23.641 -3.300 1.00 0.00 H new ATOM 0 HA ASN B 253 -32.688 23.856 -5.232 1.00 0.00 H new ATOM 0 HB2 ASN B 253 -32.303 26.197 -5.230 1.00 0.00 H new ATOM 0 HB3 ASN B 253 -32.234 25.705 -3.549 1.00 0.00 H new ATOM 0 HD21 ASN B 253 -28.787 26.455 -3.121 1.00 0.00 H new ATOM 0 HD22 ASN B 253 -30.185 25.576 -2.494 1.00 0.00 H new ATOM 1948 N GLU B 254 -29.509 23.629 -5.757 1.00 0.00 N ATOM 1949 CA GLU B 254 -28.476 23.526 -6.726 1.00 0.00 C ATOM 1950 C GLU B 254 -28.575 22.171 -7.395 1.00 0.00 C ATOM 1951 O GLU B 254 -29.132 21.227 -6.811 1.00 0.00 O ATOM 1952 CB GLU B 254 -27.110 23.745 -6.077 1.00 0.00 C ATOM 1953 CG GLU B 254 -26.077 24.303 -7.028 1.00 0.00 C ATOM 1954 CD GLU B 254 -24.736 24.540 -6.384 1.00 0.00 C ATOM 1955 OE1 GLU B 254 -24.545 25.592 -5.751 1.00 0.00 O ATOM 1956 OE2 GLU B 254 -23.840 23.694 -6.507 1.00 0.00 O ATOM 0 H GLU B 254 -29.224 23.388 -4.808 1.00 0.00 H new ATOM 0 HA GLU B 254 -28.591 24.300 -7.485 1.00 0.00 H new ATOM 0 HB2 GLU B 254 -27.222 24.426 -5.233 1.00 0.00 H new ATOM 0 HB3 GLU B 254 -26.750 22.797 -5.676 1.00 0.00 H new ATOM 0 HG2 GLU B 254 -25.954 23.614 -7.864 1.00 0.00 H new ATOM 0 HG3 GLU B 254 -26.444 25.242 -7.441 1.00 0.00 H new