USER MOD reduce.3.24.130724 H: found=0, std=0, add=939, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 937 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 55 THR OG1 : rot -62:sc= 2.2 USER MOD Set 1.2: A 57 SER OG : rot -37:sc= 1.03 USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0.41 USER MOD Set 2.2: A 25 ASN : amide:sc= 0.266 K(o=0.68,f=0.16) USER MOD Set 3.1: A 6 LYS NZ :NH3+ -177:sc= 1.09 (180deg=-0.108) USER MOD Set 3.2: A 68 HIS : no HE2:sc= 0 K(o=2.5,f=2) USER MOD Set 3.3: B 338 GLN : amide:sc= 1.42 K(o=2.5,f=-3.7) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 136:sc= 0.0482 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.12) USER MOD Single : A 7 THR OG1 : rot -170:sc= 1.06 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -170:sc= 1.27 (180deg=1.09) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -83:sc= 1.25 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -166:sc= 0.816 (180deg=0.661) USER MOD Single : A 28 SER OG : rot 85:sc= 0.997 USER MOD Single : A 29 LYS NZ :NH3+ 160:sc= 0.873 (180deg=0.585) USER MOD Single : A 31 GLN : amide:sc= -0.0576 X(o=-0.058,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.856 X(o=-0.86,f=-0.42) USER MOD Single : A 41 GLN : amide:sc= -0.472 K(o=-0.47,f=-2.9!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.719 K(o=0.72,f=-5.1!) USER MOD Single : A 59 TYR OH : rot 80:sc= 0.128 USER MOD Single : A 60 ASN : amide:sc= -0.115 X(o=-0.11,f=-0.44) USER MOD Single : A 62 GLN : amide:sc= 0.772 K(o=0.77,f=-0.053) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 47:sc= 0.0517 USER MOD Single : B 332 TYR OH : rot 180:sc= 0 USER MOD Single : B 334 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 335 GLN : amide:sc= 1.4 K(o=1.4,f=-4.6!) USER MOD Single : B 340 ASN : amide:sc= 0.621 X(o=0.62,f=0.59) USER MOD Single : B 342 MET CE :methyl 169:sc= 0 (180deg=-0.243) USER MOD Single : B 350 ASN : amide:sc= 1.06 K(o=1.1,f=-2.6!) USER MOD Single : B 357 SER OG : rot -168:sc= 0.939 USER MOD Single : B 360 SER OG : rot 180:sc= 0 USER MOD Single : B 362 GLN :FLIP amide:sc= -0.75 F(o=-3.3!,f=-0.75) USER MOD Single : B 367 SER OG : rot 75:sc= 0.068 USER MOD Single : B 370 ASN : amide:sc= -0.11 X(o=-0.11,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.177 14.213 -15.185 1.00 0.00 N ATOM 2 CA MET A 1 -2.235 12.909 -14.471 1.00 0.00 C ATOM 3 C MET A 1 -2.585 13.122 -12.994 1.00 0.00 C ATOM 4 O MET A 1 -2.297 14.166 -12.410 1.00 0.00 O ATOM 5 CB MET A 1 -0.939 12.089 -14.710 1.00 0.00 C ATOM 6 CG MET A 1 -0.648 10.901 -13.767 1.00 0.00 C ATOM 7 SD MET A 1 0.622 9.772 -14.416 1.00 0.00 S ATOM 8 CE MET A 1 0.820 8.612 -13.034 1.00 0.00 C ATOM 0 H1 MET A 1 -1.340 14.234 -15.801 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.034 14.331 -15.762 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.117 14.986 -14.492 1.00 0.00 H new ATOM 0 HA MET A 1 -3.041 12.301 -14.883 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.970 11.706 -15.730 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.094 12.775 -14.653 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.325 11.284 -12.799 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.570 10.344 -13.599 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.569 7.863 -13.292 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.141 9.156 -12.146 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.131 8.119 -12.833 1.00 0.00 H new ATOM 20 N GLN A 2 -3.248 12.134 -12.393 1.00 0.00 N ATOM 21 CA GLN A 2 -3.509 12.020 -10.951 1.00 0.00 C ATOM 22 C GLN A 2 -3.320 10.570 -10.508 1.00 0.00 C ATOM 23 O GLN A 2 -3.305 9.667 -11.343 1.00 0.00 O ATOM 24 CB GLN A 2 -4.935 12.510 -10.620 1.00 0.00 C ATOM 25 CG GLN A 2 -6.033 11.569 -11.137 1.00 0.00 C ATOM 26 CD GLN A 2 -7.404 12.240 -11.103 1.00 0.00 C ATOM 27 OE1 GLN A 2 -7.853 12.847 -12.067 1.00 0.00 O ATOM 28 NE2 GLN A 2 -8.122 12.169 -10.002 1.00 0.00 N ATOM 0 H GLN A 2 -3.638 11.352 -12.920 1.00 0.00 H new ATOM 0 HA GLN A 2 -2.802 12.649 -10.410 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -5.035 12.615 -9.540 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -5.081 13.500 -11.051 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -5.801 11.263 -12.157 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -6.054 10.664 -10.530 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -7.762 11.667 -9.190 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -9.038 12.616 -9.961 1.00 0.00 H new ATOM 37 N ILE A 3 -3.260 10.345 -9.201 1.00 0.00 N ATOM 38 CA ILE A 3 -3.290 9.033 -8.539 1.00 0.00 C ATOM 39 C ILE A 3 -4.047 9.135 -7.205 1.00 0.00 C ATOM 40 O ILE A 3 -4.335 10.233 -6.728 1.00 0.00 O ATOM 41 CB ILE A 3 -1.863 8.454 -8.346 1.00 0.00 C ATOM 42 CG1 ILE A 3 -0.957 9.329 -7.449 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.160 8.229 -9.694 1.00 0.00 C ATOM 44 CD1 ILE A 3 -0.824 8.788 -6.027 1.00 0.00 C ATOM 0 H ILE A 3 -3.185 11.111 -8.532 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.823 8.335 -9.184 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.012 7.501 -7.839 1.00 0.00 H new ATOM 0 HG12 ILE A 3 0.033 9.398 -7.900 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.361 10.341 -7.411 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.163 7.823 -9.521 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.739 7.527 -10.294 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.078 9.178 -10.225 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.176 9.445 -5.447 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.808 8.745 -5.561 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.392 7.788 -6.057 1.00 0.00 H new ATOM 56 N PHE A 4 -4.368 8.001 -6.590 1.00 0.00 N ATOM 57 CA PHE A 4 -5.087 7.895 -5.319 1.00 0.00 C ATOM 58 C PHE A 4 -4.291 7.015 -4.341 1.00 0.00 C ATOM 59 O PHE A 4 -3.610 6.079 -4.767 1.00 0.00 O ATOM 60 CB PHE A 4 -6.494 7.314 -5.546 1.00 0.00 C ATOM 61 CG PHE A 4 -7.461 8.106 -6.417 1.00 0.00 C ATOM 62 CD1 PHE A 4 -7.240 8.235 -7.803 1.00 0.00 C ATOM 63 CD2 PHE A 4 -8.642 8.632 -5.860 1.00 0.00 C ATOM 64 CE1 PHE A 4 -8.170 8.900 -8.622 1.00 0.00 C ATOM 65 CE2 PHE A 4 -9.577 9.297 -6.676 1.00 0.00 C ATOM 66 CZ PHE A 4 -9.340 9.434 -8.056 1.00 0.00 C ATOM 0 H PHE A 4 -4.125 7.090 -6.978 1.00 0.00 H new ATOM 0 HA PHE A 4 -5.194 8.891 -4.888 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -6.380 6.324 -5.988 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -6.960 7.175 -4.570 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -6.345 7.818 -8.242 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -8.832 8.525 -4.802 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -7.986 9.000 -9.681 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -10.479 9.703 -6.241 1.00 0.00 H new ATOM 0 HZ PHE A 4 -10.056 9.949 -8.679 1.00 0.00 H new ATOM 76 N VAL A 5 -4.379 7.294 -3.035 1.00 0.00 N ATOM 77 CA VAL A 5 -3.597 6.594 -1.993 1.00 0.00 C ATOM 78 C VAL A 5 -4.448 6.288 -0.762 1.00 0.00 C ATOM 79 O VAL A 5 -5.092 7.183 -0.224 1.00 0.00 O ATOM 80 CB VAL A 5 -2.349 7.385 -1.548 1.00 0.00 C ATOM 81 CG1 VAL A 5 -1.249 6.392 -1.174 1.00 0.00 C ATOM 82 CG2 VAL A 5 -1.758 8.314 -2.608 1.00 0.00 C ATOM 0 H VAL A 5 -4.997 8.015 -2.663 1.00 0.00 H new ATOM 0 HA VAL A 5 -3.269 5.663 -2.455 1.00 0.00 H new ATOM 0 HB VAL A 5 -2.684 8.009 -0.719 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -0.360 6.937 -0.857 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -1.595 5.756 -0.359 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -1.007 5.774 -2.039 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -0.886 8.824 -2.199 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -1.462 7.730 -3.479 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -2.505 9.051 -2.903 1.00 0.00 H new ATOM 92 N LYS A 6 -4.454 5.039 -0.295 1.00 0.00 N ATOM 93 CA LYS A 6 -5.371 4.531 0.736 1.00 0.00 C ATOM 94 C LYS A 6 -4.649 4.133 2.030 1.00 0.00 C ATOM 95 O LYS A 6 -3.719 3.326 2.000 1.00 0.00 O ATOM 96 CB LYS A 6 -6.167 3.380 0.102 1.00 0.00 C ATOM 97 CG LYS A 6 -7.614 3.313 0.585 1.00 0.00 C ATOM 98 CD LYS A 6 -7.782 2.827 2.023 1.00 0.00 C ATOM 99 CE LYS A 6 -9.255 2.440 2.211 1.00 0.00 C ATOM 100 NZ LYS A 6 -9.564 1.109 1.629 1.00 0.00 N ATOM 0 H LYS A 6 -3.803 4.329 -0.631 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.054 5.317 1.057 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -6.157 3.494 -0.982 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -5.671 2.436 0.328 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.059 4.304 0.496 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.174 2.651 -0.076 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -7.134 1.973 2.217 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.498 3.609 2.727 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.494 2.434 3.274 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.889 3.194 1.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -10.580 0.911 1.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -9.313 1.105 0.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.016 0.377 2.125 1.00 0.00 H new ATOM 114 N THR A 7 -5.025 4.735 3.161 1.00 0.00 N ATOM 115 CA THR A 7 -4.418 4.463 4.480 1.00 0.00 C ATOM 116 C THR A 7 -4.780 3.075 5.030 1.00 0.00 C ATOM 117 O THR A 7 -5.731 2.424 4.586 1.00 0.00 O ATOM 118 CB THR A 7 -4.802 5.521 5.538 1.00 0.00 C ATOM 119 OG1 THR A 7 -6.153 5.423 5.922 1.00 0.00 O ATOM 120 CG2 THR A 7 -4.602 6.968 5.102 1.00 0.00 C ATOM 0 H THR A 7 -5.767 5.434 3.194 1.00 0.00 H new ATOM 0 HA THR A 7 -3.344 4.504 4.300 1.00 0.00 H new ATOM 0 HB THR A 7 -4.121 5.292 6.358 1.00 0.00 H new ATOM 0 HG1 THR A 7 -6.395 6.200 6.468 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.899 7.636 5.911 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.552 7.134 4.861 1.00 0.00 H new ATOM 0 HG23 THR A 7 -5.212 7.170 4.222 1.00 0.00 H new ATOM 128 N LEU A 8 -4.046 2.633 6.058 1.00 0.00 N ATOM 129 CA LEU A 8 -4.378 1.443 6.852 1.00 0.00 C ATOM 130 C LEU A 8 -5.643 1.656 7.710 1.00 0.00 C ATOM 131 O LEU A 8 -6.397 0.710 7.945 1.00 0.00 O ATOM 132 CB LEU A 8 -3.176 1.083 7.743 1.00 0.00 C ATOM 133 CG LEU A 8 -1.982 0.507 6.958 1.00 0.00 C ATOM 134 CD1 LEU A 8 -0.719 0.581 7.817 1.00 0.00 C ATOM 135 CD2 LEU A 8 -2.208 -0.960 6.584 1.00 0.00 C ATOM 0 H LEU A 8 -3.192 3.098 6.366 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.594 0.622 6.169 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.852 1.974 8.280 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.493 0.357 8.492 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.876 1.097 6.048 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.124 0.173 7.260 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -0.515 1.620 8.075 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.865 0.003 8.729 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.345 -1.332 6.031 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.340 -1.550 7.491 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.100 -1.044 5.963 1.00 0.00 H new ATOM 147 N THR A 9 -5.898 2.897 8.144 1.00 0.00 N ATOM 148 CA THR A 9 -7.113 3.316 8.869 1.00 0.00 C ATOM 149 C THR A 9 -8.366 3.208 7.989 1.00 0.00 C ATOM 150 O THR A 9 -9.410 2.746 8.456 1.00 0.00 O ATOM 151 CB THR A 9 -6.963 4.758 9.391 1.00 0.00 C ATOM 152 OG1 THR A 9 -5.767 4.874 10.138 1.00 0.00 O ATOM 153 CG2 THR A 9 -8.112 5.184 10.304 1.00 0.00 C ATOM 0 H THR A 9 -5.244 3.666 7.997 1.00 0.00 H new ATOM 0 HA THR A 9 -7.235 2.639 9.714 1.00 0.00 H new ATOM 0 HB THR A 9 -6.959 5.401 8.511 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.674 5.793 10.467 1.00 0.00 H new ATOM 0 HG21 THR A 9 -7.950 6.208 10.639 1.00 0.00 H new ATOM 0 HG22 THR A 9 -9.053 5.126 9.756 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.154 4.522 11.169 1.00 0.00 H new ATOM 161 N GLY A 10 -8.262 3.594 6.711 1.00 0.00 N ATOM 162 CA GLY A 10 -9.275 3.372 5.676 1.00 0.00 C ATOM 163 C GLY A 10 -9.682 4.599 4.844 1.00 0.00 C ATOM 164 O GLY A 10 -10.673 4.536 4.115 1.00 0.00 O ATOM 0 H GLY A 10 -7.441 4.086 6.359 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -8.906 2.605 4.995 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.169 2.971 6.153 1.00 0.00 H new ATOM 168 N LYS A 11 -8.942 5.710 4.932 1.00 0.00 N ATOM 169 CA LYS A 11 -9.133 6.943 4.154 1.00 0.00 C ATOM 170 C LYS A 11 -8.480 6.826 2.774 1.00 0.00 C ATOM 171 O LYS A 11 -7.325 6.416 2.672 1.00 0.00 O ATOM 172 CB LYS A 11 -8.526 8.110 4.960 1.00 0.00 C ATOM 173 CG LYS A 11 -8.527 9.474 4.248 1.00 0.00 C ATOM 174 CD LYS A 11 -9.920 9.944 3.804 1.00 0.00 C ATOM 175 CE LYS A 11 -9.899 11.354 3.192 1.00 0.00 C ATOM 176 NZ LYS A 11 -9.751 12.424 4.212 1.00 0.00 N ATOM 0 H LYS A 11 -8.156 5.779 5.578 1.00 0.00 H new ATOM 0 HA LYS A 11 -10.195 7.120 3.986 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -9.076 8.207 5.896 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.498 7.855 5.219 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -8.098 10.221 4.915 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.878 9.417 3.374 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.322 9.241 3.074 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -10.594 9.934 4.661 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -9.078 11.423 2.479 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -10.821 11.516 2.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -9.912 13.351 3.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -10.446 12.278 4.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.791 12.393 4.611 1.00 0.00 H new ATOM 190 N THR A 12 -9.191 7.245 1.731 1.00 0.00 N ATOM 191 CA THR A 12 -8.685 7.380 0.355 1.00 0.00 C ATOM 192 C THR A 12 -8.346 8.842 0.054 1.00 0.00 C ATOM 193 O THR A 12 -9.219 9.714 0.067 1.00 0.00 O ATOM 194 CB THR A 12 -9.700 6.867 -0.680 1.00 0.00 C ATOM 195 OG1 THR A 12 -10.219 5.609 -0.298 1.00 0.00 O ATOM 196 CG2 THR A 12 -9.044 6.687 -2.049 1.00 0.00 C ATOM 0 H THR A 12 -10.172 7.511 1.817 1.00 0.00 H new ATOM 0 HA THR A 12 -7.785 6.770 0.280 1.00 0.00 H new ATOM 0 HB THR A 12 -10.496 7.610 -0.733 1.00 0.00 H new ATOM 0 HG1 THR A 12 -10.863 5.303 -0.970 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.784 6.323 -2.762 1.00 0.00 H new ATOM 0 HG22 THR A 12 -8.649 7.643 -2.392 1.00 0.00 H new ATOM 0 HG23 THR A 12 -8.231 5.966 -1.971 1.00 0.00 H new ATOM 204 N ILE A 13 -7.069 9.115 -0.200 1.00 0.00 N ATOM 205 CA ILE A 13 -6.515 10.391 -0.674 1.00 0.00 C ATOM 206 C ILE A 13 -6.493 10.411 -2.211 1.00 0.00 C ATOM 207 O ILE A 13 -6.448 9.358 -2.849 1.00 0.00 O ATOM 208 CB ILE A 13 -5.082 10.592 -0.109 1.00 0.00 C ATOM 209 CG1 ILE A 13 -4.935 10.234 1.390 1.00 0.00 C ATOM 210 CG2 ILE A 13 -4.583 12.035 -0.317 1.00 0.00 C ATOM 211 CD1 ILE A 13 -5.820 11.065 2.324 1.00 0.00 C ATOM 0 H ILE A 13 -6.343 8.410 -0.074 1.00 0.00 H new ATOM 0 HA ILE A 13 -7.145 11.208 -0.321 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.470 9.893 -0.679 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -5.174 9.179 1.525 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -3.893 10.365 1.683 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -3.577 12.135 0.092 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -4.566 12.264 -1.383 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -5.252 12.728 0.193 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -5.656 10.751 3.355 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -5.567 12.120 2.221 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.867 10.916 2.061 1.00 0.00 H new ATOM 223 N THR A 14 -6.439 11.602 -2.806 1.00 0.00 N ATOM 224 CA THR A 14 -6.220 11.841 -4.245 1.00 0.00 C ATOM 225 C THR A 14 -5.140 12.911 -4.418 1.00 0.00 C ATOM 226 O THR A 14 -5.179 13.936 -3.736 1.00 0.00 O ATOM 227 CB THR A 14 -7.508 12.315 -4.941 1.00 0.00 C ATOM 228 OG1 THR A 14 -8.634 11.562 -4.541 1.00 0.00 O ATOM 229 CG2 THR A 14 -7.395 12.185 -6.462 1.00 0.00 C ATOM 0 H THR A 14 -6.551 12.469 -2.281 1.00 0.00 H new ATOM 0 HA THR A 14 -5.909 10.901 -4.701 1.00 0.00 H new ATOM 0 HB THR A 14 -7.636 13.358 -4.650 1.00 0.00 H new ATOM 0 HG1 THR A 14 -8.681 10.738 -5.069 1.00 0.00 H new ATOM 0 HG21 THR A 14 -8.320 12.527 -6.926 1.00 0.00 H new ATOM 0 HG22 THR A 14 -6.563 12.793 -6.818 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.221 11.142 -6.726 1.00 0.00 H new ATOM 237 N LEU A 15 -4.174 12.688 -5.312 1.00 0.00 N ATOM 238 CA LEU A 15 -3.020 13.561 -5.561 1.00 0.00 C ATOM 239 C LEU A 15 -2.832 13.839 -7.064 1.00 0.00 C ATOM 240 O LEU A 15 -3.166 13.003 -7.903 1.00 0.00 O ATOM 241 CB LEU A 15 -1.748 12.872 -5.032 1.00 0.00 C ATOM 242 CG LEU A 15 -1.734 12.453 -3.552 1.00 0.00 C ATOM 243 CD1 LEU A 15 -0.447 11.665 -3.328 1.00 0.00 C ATOM 244 CD2 LEU A 15 -1.787 13.641 -2.592 1.00 0.00 C ATOM 0 H LEU A 15 -4.173 11.860 -5.908 1.00 0.00 H new ATOM 0 HA LEU A 15 -3.198 14.508 -5.052 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.571 11.982 -5.636 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.906 13.544 -5.200 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.624 11.860 -3.344 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.393 11.345 -2.287 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.439 10.790 -3.977 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.411 12.296 -3.559 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.774 13.279 -1.564 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.923 14.284 -2.761 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.701 14.208 -2.765 1.00 0.00 H new ATOM 256 N GLU A 16 -2.216 14.971 -7.410 1.00 0.00 N ATOM 257 CA GLU A 16 -1.929 15.394 -8.792 1.00 0.00 C ATOM 258 C GLU A 16 -0.420 15.313 -9.092 1.00 0.00 C ATOM 259 O GLU A 16 0.345 16.199 -8.700 1.00 0.00 O ATOM 260 CB GLU A 16 -2.509 16.801 -9.019 1.00 0.00 C ATOM 261 CG GLU A 16 -2.438 17.235 -10.489 1.00 0.00 C ATOM 262 CD GLU A 16 -3.009 18.655 -10.674 1.00 0.00 C ATOM 263 OE1 GLU A 16 -4.241 18.800 -10.872 1.00 0.00 O ATOM 264 OE2 GLU A 16 -2.230 19.640 -10.632 1.00 0.00 O ATOM 0 H GLU A 16 -1.890 15.644 -6.717 1.00 0.00 H new ATOM 0 HA GLU A 16 -2.411 14.715 -9.496 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.547 16.820 -8.687 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.965 17.518 -8.405 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.403 17.208 -10.830 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.996 16.531 -11.107 1.00 0.00 H new ATOM 271 N VAL A 17 0.018 14.235 -9.751 1.00 0.00 N ATOM 272 CA VAL A 17 1.423 13.932 -10.102 1.00 0.00 C ATOM 273 C VAL A 17 1.594 13.664 -11.606 1.00 0.00 C ATOM 274 O VAL A 17 0.622 13.619 -12.356 1.00 0.00 O ATOM 275 CB VAL A 17 1.940 12.717 -9.295 1.00 0.00 C ATOM 276 CG1 VAL A 17 2.083 13.047 -7.801 1.00 0.00 C ATOM 277 CG2 VAL A 17 1.055 11.476 -9.492 1.00 0.00 C ATOM 0 H VAL A 17 -0.624 13.510 -10.073 1.00 0.00 H new ATOM 0 HA VAL A 17 2.012 14.813 -9.846 1.00 0.00 H new ATOM 0 HB VAL A 17 2.930 12.484 -9.686 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.448 12.169 -7.268 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.789 13.868 -7.676 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.113 13.339 -7.398 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.455 10.647 -8.907 1.00 0.00 H new ATOM 0 HG22 VAL A 17 0.040 11.697 -9.161 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.042 11.202 -10.547 1.00 0.00 H new ATOM 287 N GLU A 18 2.827 13.450 -12.057 1.00 0.00 N ATOM 288 CA GLU A 18 3.184 12.965 -13.394 1.00 0.00 C ATOM 289 C GLU A 18 3.761 11.546 -13.294 1.00 0.00 C ATOM 290 O GLU A 18 4.201 11.114 -12.227 1.00 0.00 O ATOM 291 CB GLU A 18 4.218 13.910 -14.032 1.00 0.00 C ATOM 292 CG GLU A 18 3.603 15.258 -14.430 1.00 0.00 C ATOM 293 CD GLU A 18 4.633 16.149 -15.150 1.00 0.00 C ATOM 294 OE1 GLU A 18 4.828 15.986 -16.381 1.00 0.00 O ATOM 295 OE2 GLU A 18 5.251 17.029 -14.500 1.00 0.00 O ATOM 0 H GLU A 18 3.647 13.617 -11.474 1.00 0.00 H new ATOM 0 HA GLU A 18 2.291 12.942 -14.019 1.00 0.00 H new ATOM 0 HB2 GLU A 18 5.035 14.078 -13.331 1.00 0.00 H new ATOM 0 HB3 GLU A 18 4.647 13.434 -14.914 1.00 0.00 H new ATOM 0 HG2 GLU A 18 2.745 15.091 -15.081 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.234 15.769 -13.541 1.00 0.00 H new ATOM 302 N SER A 19 3.850 10.830 -14.417 1.00 0.00 N ATOM 303 CA SER A 19 4.519 9.520 -14.493 1.00 0.00 C ATOM 304 C SER A 19 6.017 9.577 -14.137 1.00 0.00 C ATOM 305 O SER A 19 6.609 8.553 -13.791 1.00 0.00 O ATOM 306 CB SER A 19 4.322 8.911 -15.886 1.00 0.00 C ATOM 307 OG SER A 19 4.767 9.801 -16.899 1.00 0.00 O ATOM 0 H SER A 19 3.459 11.140 -15.307 1.00 0.00 H new ATOM 0 HA SER A 19 4.051 8.884 -13.741 1.00 0.00 H new ATOM 0 HB2 SER A 19 4.870 7.971 -15.957 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.268 8.678 -16.039 1.00 0.00 H new ATOM 0 HG SER A 19 4.633 9.389 -17.778 1.00 0.00 H new ATOM 313 N SER A 20 6.612 10.776 -14.152 1.00 0.00 N ATOM 314 CA SER A 20 8.034 11.043 -13.904 1.00 0.00 C ATOM 315 C SER A 20 8.324 11.581 -12.495 1.00 0.00 C ATOM 316 O SER A 20 9.495 11.751 -12.146 1.00 0.00 O ATOM 317 CB SER A 20 8.573 12.039 -14.943 1.00 0.00 C ATOM 318 OG SER A 20 8.424 11.530 -16.263 1.00 0.00 O ATOM 0 H SER A 20 6.088 11.629 -14.347 1.00 0.00 H new ATOM 0 HA SER A 20 8.540 10.081 -13.989 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.042 12.987 -14.853 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.625 12.243 -14.745 1.00 0.00 H new ATOM 0 HG SER A 20 8.772 12.182 -16.906 1.00 0.00 H new ATOM 324 N ASP A 21 7.303 11.847 -11.666 1.00 0.00 N ATOM 325 CA ASP A 21 7.531 12.153 -10.244 1.00 0.00 C ATOM 326 C ASP A 21 8.134 10.942 -9.507 1.00 0.00 C ATOM 327 O ASP A 21 7.898 9.795 -9.894 1.00 0.00 O ATOM 328 CB ASP A 21 6.232 12.601 -9.554 1.00 0.00 C ATOM 329 CG ASP A 21 5.936 14.089 -9.784 1.00 0.00 C ATOM 330 OD1 ASP A 21 6.774 14.938 -9.398 1.00 0.00 O ATOM 331 OD2 ASP A 21 4.853 14.409 -10.322 1.00 0.00 O ATOM 0 H ASP A 21 6.323 11.857 -11.950 1.00 0.00 H new ATOM 0 HA ASP A 21 8.244 12.976 -10.199 1.00 0.00 H new ATOM 0 HB2 ASP A 21 5.400 12.005 -9.928 1.00 0.00 H new ATOM 0 HB3 ASP A 21 6.306 12.408 -8.484 1.00 0.00 H new ATOM 336 N THR A 22 8.903 11.174 -8.438 1.00 0.00 N ATOM 337 CA THR A 22 9.450 10.087 -7.607 1.00 0.00 C ATOM 338 C THR A 22 8.449 9.588 -6.563 1.00 0.00 C ATOM 339 O THR A 22 7.547 10.315 -6.145 1.00 0.00 O ATOM 340 CB THR A 22 10.761 10.474 -6.906 1.00 0.00 C ATOM 341 OG1 THR A 22 10.590 11.586 -6.055 1.00 0.00 O ATOM 342 CG2 THR A 22 11.864 10.813 -7.908 1.00 0.00 C ATOM 0 H THR A 22 9.164 12.109 -8.124 1.00 0.00 H new ATOM 0 HA THR A 22 9.660 9.279 -8.307 1.00 0.00 H new ATOM 0 HB THR A 22 11.052 9.602 -6.321 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.443 11.803 -5.625 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.774 11.081 -7.371 1.00 0.00 H new ATOM 0 HG22 THR A 22 12.058 9.948 -8.542 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.548 11.652 -8.527 1.00 0.00 H new ATOM 350 N ILE A 23 8.636 8.362 -6.069 1.00 0.00 N ATOM 351 CA ILE A 23 7.902 7.798 -4.925 1.00 0.00 C ATOM 352 C ILE A 23 8.060 8.702 -3.687 1.00 0.00 C ATOM 353 O ILE A 23 7.077 8.991 -3.005 1.00 0.00 O ATOM 354 CB ILE A 23 8.383 6.349 -4.677 1.00 0.00 C ATOM 355 CG1 ILE A 23 8.013 5.379 -5.825 1.00 0.00 C ATOM 356 CG2 ILE A 23 7.903 5.781 -3.333 1.00 0.00 C ATOM 357 CD1 ILE A 23 6.522 5.081 -6.003 1.00 0.00 C ATOM 0 H ILE A 23 9.319 7.714 -6.461 1.00 0.00 H new ATOM 0 HA ILE A 23 6.835 7.759 -5.143 1.00 0.00 H new ATOM 0 HB ILE A 23 9.470 6.424 -4.643 1.00 0.00 H new ATOM 0 HG12 ILE A 23 8.394 5.792 -6.759 1.00 0.00 H new ATOM 0 HG13 ILE A 23 8.533 4.436 -5.658 1.00 0.00 H new ATOM 0 HG21 ILE A 23 8.272 4.762 -3.216 1.00 0.00 H new ATOM 0 HG22 ILE A 23 8.283 6.400 -2.520 1.00 0.00 H new ATOM 0 HG23 ILE A 23 6.813 5.777 -3.308 1.00 0.00 H new ATOM 0 HD11 ILE A 23 6.386 4.391 -6.836 1.00 0.00 H new ATOM 0 HD12 ILE A 23 6.129 4.631 -5.091 1.00 0.00 H new ATOM 0 HD13 ILE A 23 5.988 6.008 -6.209 1.00 0.00 H new ATOM 369 N ASP A 24 9.267 9.222 -3.435 1.00 0.00 N ATOM 370 CA ASP A 24 9.538 10.244 -2.411 1.00 0.00 C ATOM 371 C ASP A 24 8.654 11.496 -2.555 1.00 0.00 C ATOM 372 O ASP A 24 8.103 11.990 -1.568 1.00 0.00 O ATOM 373 CB ASP A 24 11.014 10.646 -2.490 1.00 0.00 C ATOM 374 CG ASP A 24 11.411 11.596 -1.348 1.00 0.00 C ATOM 375 OD1 ASP A 24 11.469 11.144 -0.180 1.00 0.00 O ATOM 376 OD2 ASP A 24 11.689 12.789 -1.620 1.00 0.00 O ATOM 0 H ASP A 24 10.102 8.939 -3.947 1.00 0.00 H new ATOM 0 HA ASP A 24 9.302 9.804 -1.442 1.00 0.00 H new ATOM 0 HB2 ASP A 24 11.636 9.752 -2.452 1.00 0.00 H new ATOM 0 HB3 ASP A 24 11.208 11.129 -3.448 1.00 0.00 H new ATOM 381 N ASN A 25 8.483 11.991 -3.786 1.00 0.00 N ATOM 382 CA ASN A 25 7.593 13.112 -4.088 1.00 0.00 C ATOM 383 C ASN A 25 6.139 12.749 -3.791 1.00 0.00 C ATOM 384 O ASN A 25 5.455 13.520 -3.126 1.00 0.00 O ATOM 385 CB ASN A 25 7.742 13.585 -5.543 1.00 0.00 C ATOM 386 CG ASN A 25 8.730 14.731 -5.658 1.00 0.00 C ATOM 387 OD1 ASN A 25 8.381 15.876 -5.912 1.00 0.00 O ATOM 388 ND2 ASN A 25 9.991 14.464 -5.429 1.00 0.00 N ATOM 0 H ASN A 25 8.964 11.620 -4.606 1.00 0.00 H new ATOM 0 HA ASN A 25 7.885 13.938 -3.440 1.00 0.00 H new ATOM 0 HB2 ASN A 25 8.074 12.753 -6.165 1.00 0.00 H new ATOM 0 HB3 ASN A 25 6.771 13.901 -5.925 1.00 0.00 H new ATOM 0 HD21 ASN A 25 10.685 15.211 -5.462 1.00 0.00 H new ATOM 0 HD22 ASN A 25 10.280 13.509 -5.217 1.00 0.00 H new ATOM 395 N VAL A 26 5.665 11.583 -4.236 1.00 0.00 N ATOM 396 CA VAL A 26 4.284 11.144 -3.986 1.00 0.00 C ATOM 397 C VAL A 26 3.970 11.149 -2.493 1.00 0.00 C ATOM 398 O VAL A 26 3.006 11.802 -2.101 1.00 0.00 O ATOM 399 CB VAL A 26 3.978 9.764 -4.581 1.00 0.00 C ATOM 400 CG1 VAL A 26 2.516 9.382 -4.322 1.00 0.00 C ATOM 401 CG2 VAL A 26 4.196 9.719 -6.096 1.00 0.00 C ATOM 0 H VAL A 26 6.220 10.919 -4.776 1.00 0.00 H new ATOM 0 HA VAL A 26 3.641 11.864 -4.492 1.00 0.00 H new ATOM 0 HB VAL A 26 4.663 9.068 -4.097 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.315 8.400 -4.751 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.332 9.354 -3.248 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.860 10.120 -4.783 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.966 8.720 -6.467 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.543 10.446 -6.579 1.00 0.00 H new ATOM 0 HG23 VAL A 26 5.235 9.959 -6.321 1.00 0.00 H new ATOM 411 N LYS A 27 4.799 10.512 -1.647 1.00 0.00 N ATOM 412 CA LYS A 27 4.649 10.530 -0.174 1.00 0.00 C ATOM 413 C LYS A 27 4.496 11.955 0.361 1.00 0.00 C ATOM 414 O LYS A 27 3.601 12.260 1.148 1.00 0.00 O ATOM 415 CB LYS A 27 5.885 9.909 0.483 1.00 0.00 C ATOM 416 CG LYS A 27 6.104 8.424 0.195 1.00 0.00 C ATOM 417 CD LYS A 27 7.494 8.069 0.730 1.00 0.00 C ATOM 418 CE LYS A 27 7.817 6.614 0.420 1.00 0.00 C ATOM 419 NZ LYS A 27 8.931 6.125 1.277 1.00 0.00 N ATOM 0 H LYS A 27 5.599 9.965 -1.965 1.00 0.00 H new ATOM 0 HA LYS A 27 3.752 9.960 0.066 1.00 0.00 H new ATOM 0 HB2 LYS A 27 6.766 10.459 0.153 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.809 10.045 1.562 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.337 7.819 0.680 1.00 0.00 H new ATOM 0 HG3 LYS A 27 6.039 8.224 -0.875 1.00 0.00 H new ATOM 0 HD2 LYS A 27 8.243 8.720 0.279 1.00 0.00 H new ATOM 0 HD3 LYS A 27 7.532 8.237 1.806 1.00 0.00 H new ATOM 0 HE2 LYS A 27 6.932 5.998 0.580 1.00 0.00 H new ATOM 0 HE3 LYS A 27 8.089 6.513 -0.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 9.293 5.227 0.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 9.696 6.829 1.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 8.584 5.976 2.246 1.00 0.00 H new ATOM 433 N SER A 28 5.373 12.830 -0.119 1.00 0.00 N ATOM 434 CA SER A 28 5.456 14.254 0.211 1.00 0.00 C ATOM 435 C SER A 28 4.231 15.061 -0.245 1.00 0.00 C ATOM 436 O SER A 28 4.028 16.173 0.246 1.00 0.00 O ATOM 437 CB SER A 28 6.734 14.852 -0.398 1.00 0.00 C ATOM 438 OG SER A 28 7.893 14.226 0.123 1.00 0.00 O ATOM 0 H SER A 28 6.089 12.550 -0.789 1.00 0.00 H new ATOM 0 HA SER A 28 5.483 14.323 1.298 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.712 14.737 -1.482 1.00 0.00 H new ATOM 0 HB3 SER A 28 6.772 15.922 -0.192 1.00 0.00 H new ATOM 0 HG SER A 28 8.083 13.412 -0.388 1.00 0.00 H new ATOM 444 N LYS A 29 3.373 14.515 -1.124 1.00 0.00 N ATOM 445 CA LYS A 29 2.115 15.142 -1.552 1.00 0.00 C ATOM 446 C LYS A 29 0.963 14.774 -0.613 1.00 0.00 C ATOM 447 O LYS A 29 0.138 15.639 -0.338 1.00 0.00 O ATOM 448 CB LYS A 29 1.799 14.791 -3.015 1.00 0.00 C ATOM 449 CG LYS A 29 2.883 15.212 -4.021 1.00 0.00 C ATOM 450 CD LYS A 29 2.647 16.572 -4.691 1.00 0.00 C ATOM 451 CE LYS A 29 1.611 16.451 -5.812 1.00 0.00 C ATOM 452 NZ LYS A 29 1.515 17.696 -6.616 1.00 0.00 N ATOM 0 H LYS A 29 3.539 13.610 -1.563 1.00 0.00 H new ATOM 0 HA LYS A 29 2.238 16.224 -1.495 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.648 13.714 -3.092 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.858 15.266 -3.294 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.844 15.238 -3.508 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.955 14.449 -4.796 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.305 17.294 -3.949 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.585 16.951 -5.096 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.877 15.618 -6.463 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.636 16.221 -5.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 1.082 17.482 -7.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.929 18.391 -6.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.467 18.088 -6.764 1.00 0.00 H new ATOM 466 N ILE A 30 0.935 13.565 -0.027 1.00 0.00 N ATOM 467 CA ILE A 30 -0.017 13.216 1.059 1.00 0.00 C ATOM 468 C ILE A 30 0.120 14.187 2.247 1.00 0.00 C ATOM 469 O ILE A 30 -0.870 14.550 2.888 1.00 0.00 O ATOM 470 CB ILE A 30 0.133 11.754 1.554 1.00 0.00 C ATOM 471 CG1 ILE A 30 -0.262 10.714 0.482 1.00 0.00 C ATOM 472 CG2 ILE A 30 -0.763 11.499 2.776 1.00 0.00 C ATOM 473 CD1 ILE A 30 0.988 10.130 -0.169 1.00 0.00 C ATOM 0 H ILE A 30 1.563 12.803 -0.285 1.00 0.00 H new ATOM 0 HA ILE A 30 -1.013 13.309 0.626 1.00 0.00 H new ATOM 0 HB ILE A 30 1.188 11.637 1.800 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.850 9.917 0.937 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.891 11.182 -0.275 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.642 10.467 3.107 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -0.479 12.174 3.583 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.805 11.674 2.506 1.00 0.00 H new ATOM 0 HD11 ILE A 30 0.698 9.398 -0.923 1.00 0.00 H new ATOM 0 HD12 ILE A 30 1.560 10.929 -0.640 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.601 9.645 0.591 1.00 0.00 H new ATOM 485 N GLN A 31 1.339 14.658 2.523 1.00 0.00 N ATOM 486 CA GLN A 31 1.616 15.630 3.589 1.00 0.00 C ATOM 487 C GLN A 31 0.898 16.982 3.374 1.00 0.00 C ATOM 488 O GLN A 31 0.703 17.743 4.320 1.00 0.00 O ATOM 489 CB GLN A 31 3.138 15.782 3.750 1.00 0.00 C ATOM 490 CG GLN A 31 3.543 16.618 4.972 1.00 0.00 C ATOM 491 CD GLN A 31 5.042 16.563 5.247 1.00 0.00 C ATOM 492 OE1 GLN A 31 5.880 16.911 4.424 1.00 0.00 O ATOM 493 NE2 GLN A 31 5.434 16.134 6.427 1.00 0.00 N ATOM 0 H GLN A 31 2.172 14.373 2.008 1.00 0.00 H new ATOM 0 HA GLN A 31 1.203 15.247 4.522 1.00 0.00 H new ATOM 0 HB2 GLN A 31 3.588 14.792 3.831 1.00 0.00 H new ATOM 0 HB3 GLN A 31 3.546 16.245 2.851 1.00 0.00 H new ATOM 0 HG2 GLN A 31 3.244 17.654 4.815 1.00 0.00 H new ATOM 0 HG3 GLN A 31 3.003 16.260 5.848 1.00 0.00 H new ATOM 0 HE21 GLN A 31 4.744 15.842 7.119 1.00 0.00 H new ATOM 0 HE22 GLN A 31 6.428 16.093 6.650 1.00 0.00 H new ATOM 502 N ASP A 32 0.424 17.259 2.156 1.00 0.00 N ATOM 503 CA ASP A 32 -0.408 18.432 1.838 1.00 0.00 C ATOM 504 C ASP A 32 -1.905 18.222 2.157 1.00 0.00 C ATOM 505 O ASP A 32 -2.651 19.189 2.328 1.00 0.00 O ATOM 506 CB ASP A 32 -0.230 18.760 0.349 1.00 0.00 C ATOM 507 CG ASP A 32 -0.751 20.163 -0.009 1.00 0.00 C ATOM 508 OD1 ASP A 32 -0.173 21.167 0.475 1.00 0.00 O ATOM 509 OD2 ASP A 32 -1.717 20.268 -0.801 1.00 0.00 O ATOM 0 H ASP A 32 0.609 16.667 1.346 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.077 19.258 2.467 1.00 0.00 H new ATOM 0 HB2 ASP A 32 0.826 18.690 0.088 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.756 18.016 -0.250 1.00 0.00 H new ATOM 514 N LYS A 33 -2.346 16.958 2.246 1.00 0.00 N ATOM 515 CA LYS A 33 -3.753 16.526 2.365 1.00 0.00 C ATOM 516 C LYS A 33 -4.133 16.144 3.801 1.00 0.00 C ATOM 517 O LYS A 33 -5.226 16.475 4.259 1.00 0.00 O ATOM 518 CB LYS A 33 -4.046 15.348 1.407 1.00 0.00 C ATOM 519 CG LYS A 33 -3.327 15.381 0.047 1.00 0.00 C ATOM 520 CD LYS A 33 -3.574 16.623 -0.815 1.00 0.00 C ATOM 521 CE LYS A 33 -4.820 16.467 -1.689 1.00 0.00 C ATOM 522 NZ LYS A 33 -5.160 17.732 -2.392 1.00 0.00 N ATOM 0 H LYS A 33 -1.701 16.168 2.237 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.367 17.381 2.084 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.778 14.421 1.913 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.120 15.314 1.225 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -2.255 15.293 0.223 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.629 14.502 -0.523 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.688 17.496 -0.172 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.706 16.805 -1.448 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -4.654 15.677 -2.421 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.662 16.157 -1.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.009 17.588 -2.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.343 18.480 -1.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.366 18.015 -3.002 1.00 0.00 H new ATOM 536 N GLU A 34 -3.232 15.457 4.510 1.00 0.00 N ATOM 537 CA GLU A 34 -3.426 14.945 5.882 1.00 0.00 C ATOM 538 C GLU A 34 -2.245 15.234 6.822 1.00 0.00 C ATOM 539 O GLU A 34 -2.422 15.270 8.042 1.00 0.00 O ATOM 540 CB GLU A 34 -3.637 13.421 5.842 1.00 0.00 C ATOM 541 CG GLU A 34 -4.933 12.968 5.162 1.00 0.00 C ATOM 542 CD GLU A 34 -6.235 13.308 5.919 1.00 0.00 C ATOM 543 OE1 GLU A 34 -6.199 13.785 7.079 1.00 0.00 O ATOM 544 OE2 GLU A 34 -7.326 13.057 5.352 1.00 0.00 O ATOM 0 H GLU A 34 -2.311 15.230 4.135 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.299 15.466 6.275 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -2.793 12.965 5.324 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -3.627 13.040 6.863 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.980 13.421 4.172 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.889 11.889 5.017 1.00 0.00 H new ATOM 551 N GLY A 35 -1.044 15.446 6.273 1.00 0.00 N ATOM 552 CA GLY A 35 0.166 15.774 7.042 1.00 0.00 C ATOM 553 C GLY A 35 1.116 14.596 7.309 1.00 0.00 C ATOM 554 O GLY A 35 2.086 14.756 8.050 1.00 0.00 O ATOM 0 H GLY A 35 -0.881 15.394 5.267 1.00 0.00 H new ATOM 0 HA2 GLY A 35 0.716 16.549 6.508 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.136 16.199 7.999 1.00 0.00 H new ATOM 558 N ILE A 36 0.857 13.421 6.718 1.00 0.00 N ATOM 559 CA ILE A 36 1.624 12.181 6.926 1.00 0.00 C ATOM 560 C ILE A 36 3.100 12.370 6.523 1.00 0.00 C ATOM 561 O ILE A 36 3.378 12.638 5.350 1.00 0.00 O ATOM 562 CB ILE A 36 0.998 10.999 6.157 1.00 0.00 C ATOM 563 CG1 ILE A 36 -0.512 10.804 6.432 1.00 0.00 C ATOM 564 CG2 ILE A 36 1.753 9.698 6.470 1.00 0.00 C ATOM 565 CD1 ILE A 36 -0.924 10.668 7.905 1.00 0.00 C ATOM 0 H ILE A 36 0.085 13.302 6.062 1.00 0.00 H new ATOM 0 HA ILE A 36 1.588 11.947 7.990 1.00 0.00 H new ATOM 0 HB ILE A 36 1.093 11.247 5.100 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -1.050 11.650 6.003 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -0.844 9.912 5.900 1.00 0.00 H new ATOM 0 HG21 ILE A 36 1.300 8.873 5.920 1.00 0.00 H new ATOM 0 HG22 ILE A 36 2.796 9.802 6.173 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.699 9.494 7.539 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.004 10.536 7.970 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -0.426 9.803 8.344 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.635 11.568 8.448 1.00 0.00 H new ATOM 577 N PRO A 37 4.057 12.232 7.458 1.00 0.00 N ATOM 578 CA PRO A 37 5.465 12.542 7.213 1.00 0.00 C ATOM 579 C PRO A 37 6.114 11.544 6.233 1.00 0.00 C ATOM 580 O PRO A 37 6.137 10.345 6.528 1.00 0.00 O ATOM 581 CB PRO A 37 6.138 12.539 8.589 1.00 0.00 C ATOM 582 CG PRO A 37 5.228 11.679 9.452 1.00 0.00 C ATOM 583 CD PRO A 37 3.857 11.738 8.813 1.00 0.00 C ATOM 0 HA PRO A 37 5.580 13.512 6.729 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.145 12.125 8.538 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.228 13.549 8.990 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.592 10.653 9.498 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.196 12.052 10.476 1.00 0.00 H new ATOM 0 HD2 PRO A 37 3.391 10.753 8.803 1.00 0.00 H new ATOM 0 HD3 PRO A 37 3.195 12.398 9.374 1.00 0.00 H new ATOM 591 N PRO A 38 6.679 11.993 5.091 1.00 0.00 N ATOM 592 CA PRO A 38 7.277 11.122 4.069 1.00 0.00 C ATOM 593 C PRO A 38 8.502 10.312 4.534 1.00 0.00 C ATOM 594 O PRO A 38 8.911 9.375 3.849 1.00 0.00 O ATOM 595 CB PRO A 38 7.615 12.037 2.885 1.00 0.00 C ATOM 596 CG PRO A 38 7.746 13.421 3.508 1.00 0.00 C ATOM 597 CD PRO A 38 6.734 13.381 4.647 1.00 0.00 C ATOM 0 HA PRO A 38 6.562 10.343 3.804 1.00 0.00 H new ATOM 0 HB2 PRO A 38 8.540 11.731 2.397 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.832 12.014 2.127 1.00 0.00 H new ATOM 0 HG2 PRO A 38 8.757 13.606 3.872 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.516 14.210 2.791 1.00 0.00 H new ATOM 0 HD2 PRO A 38 7.038 14.039 5.461 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.755 13.722 4.310 1.00 0.00 H new ATOM 605 N ASP A 39 9.060 10.615 5.710 1.00 0.00 N ATOM 606 CA ASP A 39 10.087 9.803 6.372 1.00 0.00 C ATOM 607 C ASP A 39 9.519 8.472 6.896 1.00 0.00 C ATOM 608 O ASP A 39 10.204 7.447 6.885 1.00 0.00 O ATOM 609 CB ASP A 39 10.673 10.608 7.544 1.00 0.00 C ATOM 610 CG ASP A 39 11.713 9.802 8.345 1.00 0.00 C ATOM 611 OD1 ASP A 39 12.906 9.800 7.955 1.00 0.00 O ATOM 612 OD2 ASP A 39 11.340 9.180 9.369 1.00 0.00 O ATOM 0 H ASP A 39 8.805 11.449 6.240 1.00 0.00 H new ATOM 0 HA ASP A 39 10.859 9.565 5.641 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.137 11.517 7.161 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.866 10.918 8.208 1.00 0.00 H new ATOM 617 N GLN A 40 8.265 8.485 7.366 1.00 0.00 N ATOM 618 CA GLN A 40 7.654 7.378 8.091 1.00 0.00 C ATOM 619 C GLN A 40 6.750 6.487 7.236 1.00 0.00 C ATOM 620 O GLN A 40 6.479 5.355 7.633 1.00 0.00 O ATOM 621 CB GLN A 40 6.887 7.978 9.274 1.00 0.00 C ATOM 622 CG GLN A 40 7.848 8.553 10.336 1.00 0.00 C ATOM 623 CD GLN A 40 7.233 9.554 11.305 1.00 0.00 C ATOM 624 OE1 GLN A 40 7.872 10.477 11.793 1.00 0.00 O ATOM 625 NE2 GLN A 40 5.973 9.401 11.622 1.00 0.00 N ATOM 0 H GLN A 40 7.640 9.283 7.248 1.00 0.00 H new ATOM 0 HA GLN A 40 8.446 6.708 8.426 1.00 0.00 H new ATOM 0 HB2 GLN A 40 6.223 8.766 8.917 1.00 0.00 H new ATOM 0 HB3 GLN A 40 6.258 7.212 9.727 1.00 0.00 H new ATOM 0 HG2 GLN A 40 8.263 7.725 10.911 1.00 0.00 H new ATOM 0 HG3 GLN A 40 8.681 9.035 9.824 1.00 0.00 H new ATOM 0 HE21 GLN A 40 5.435 8.634 11.219 1.00 0.00 H new ATOM 0 HE22 GLN A 40 5.528 10.049 12.272 1.00 0.00 H new ATOM 634 N GLN A 41 6.291 6.962 6.078 1.00 0.00 N ATOM 635 CA GLN A 41 5.419 6.191 5.180 1.00 0.00 C ATOM 636 C GLN A 41 6.168 5.506 4.019 1.00 0.00 C ATOM 637 O GLN A 41 7.227 5.963 3.574 1.00 0.00 O ATOM 638 CB GLN A 41 4.250 7.057 4.672 1.00 0.00 C ATOM 639 CG GLN A 41 4.695 8.324 3.930 1.00 0.00 C ATOM 640 CD GLN A 41 3.571 8.959 3.121 1.00 0.00 C ATOM 641 OE1 GLN A 41 2.982 8.344 2.248 1.00 0.00 O ATOM 642 NE2 GLN A 41 3.270 10.223 3.323 1.00 0.00 N ATOM 0 H GLN A 41 6.512 7.896 5.732 1.00 0.00 H new ATOM 0 HA GLN A 41 5.013 5.376 5.779 1.00 0.00 H new ATOM 0 HB2 GLN A 41 3.628 6.457 4.007 1.00 0.00 H new ATOM 0 HB3 GLN A 41 3.627 7.343 5.519 1.00 0.00 H new ATOM 0 HG2 GLN A 41 5.072 9.049 4.652 1.00 0.00 H new ATOM 0 HG3 GLN A 41 5.522 8.078 3.264 1.00 0.00 H new ATOM 0 HE21 GLN A 41 3.753 10.752 4.049 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.554 10.674 2.754 1.00 0.00 H new ATOM 651 N ARG A 42 5.577 4.432 3.484 1.00 0.00 N ATOM 652 CA ARG A 42 5.945 3.721 2.242 1.00 0.00 C ATOM 653 C ARG A 42 4.695 3.561 1.376 1.00 0.00 C ATOM 654 O ARG A 42 3.585 3.585 1.907 1.00 0.00 O ATOM 655 CB ARG A 42 6.571 2.334 2.506 1.00 0.00 C ATOM 656 CG ARG A 42 7.633 2.271 3.614 1.00 0.00 C ATOM 657 CD ARG A 42 7.041 1.730 4.922 1.00 0.00 C ATOM 658 NE ARG A 42 8.048 1.732 5.999 1.00 0.00 N ATOM 659 CZ ARG A 42 8.865 0.747 6.337 1.00 0.00 C ATOM 660 NH1 ARG A 42 8.864 -0.407 5.732 1.00 0.00 N ATOM 661 NH2 ARG A 42 9.726 0.903 7.300 1.00 0.00 N ATOM 0 H ARG A 42 4.770 4.001 3.936 1.00 0.00 H new ATOM 0 HA ARG A 42 6.702 4.318 1.733 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.770 1.639 2.758 1.00 0.00 H new ATOM 0 HB3 ARG A 42 7.021 1.979 1.579 1.00 0.00 H new ATOM 0 HG2 ARG A 42 8.458 1.634 3.295 1.00 0.00 H new ATOM 0 HG3 ARG A 42 8.045 3.266 3.783 1.00 0.00 H new ATOM 0 HD2 ARG A 42 6.186 2.339 5.217 1.00 0.00 H new ATOM 0 HD3 ARG A 42 6.672 0.716 4.766 1.00 0.00 H new ATOM 0 HE ARG A 42 8.124 2.590 6.546 1.00 0.00 H new ATOM 0 HH11 ARG A 42 8.215 -0.580 4.964 1.00 0.00 H new ATOM 0 HH12 ARG A 42 9.512 -1.138 6.026 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.775 1.790 7.801 1.00 0.00 H new ATOM 0 HH22 ARG A 42 10.352 0.138 7.554 1.00 0.00 H new ATOM 675 N LEU A 43 4.868 3.344 0.073 1.00 0.00 N ATOM 676 CA LEU A 43 3.768 3.044 -0.853 1.00 0.00 C ATOM 677 C LEU A 43 3.802 1.564 -1.254 1.00 0.00 C ATOM 678 O LEU A 43 4.873 0.957 -1.311 1.00 0.00 O ATOM 679 CB LEU A 43 3.812 3.995 -2.063 1.00 0.00 C ATOM 680 CG LEU A 43 3.746 5.493 -1.701 1.00 0.00 C ATOM 681 CD1 LEU A 43 3.706 6.328 -2.977 1.00 0.00 C ATOM 682 CD2 LEU A 43 2.515 5.864 -0.871 1.00 0.00 C ATOM 0 H LEU A 43 5.783 3.371 -0.377 1.00 0.00 H new ATOM 0 HA LEU A 43 2.813 3.215 -0.355 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.729 3.809 -2.622 1.00 0.00 H new ATOM 0 HB3 LEU A 43 2.980 3.757 -2.726 1.00 0.00 H new ATOM 0 HG LEU A 43 4.635 5.698 -1.104 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.659 7.386 -2.718 1.00 0.00 H new ATOM 0 HD12 LEU A 43 4.604 6.137 -3.565 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.826 6.058 -3.561 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.532 6.932 -0.652 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.612 5.623 -1.432 1.00 0.00 H new ATOM 0 HD23 LEU A 43 2.523 5.302 0.063 1.00 0.00 H new ATOM 694 N ILE A 44 2.629 0.985 -1.516 1.00 0.00 N ATOM 695 CA ILE A 44 2.414 -0.460 -1.707 1.00 0.00 C ATOM 696 C ILE A 44 1.546 -0.693 -2.961 1.00 0.00 C ATOM 697 O ILE A 44 0.380 -0.287 -2.987 1.00 0.00 O ATOM 698 CB ILE A 44 1.791 -1.075 -0.419 1.00 0.00 C ATOM 699 CG1 ILE A 44 2.528 -0.722 0.896 1.00 0.00 C ATOM 700 CG2 ILE A 44 1.697 -2.609 -0.477 1.00 0.00 C ATOM 701 CD1 ILE A 44 3.927 -1.335 1.035 1.00 0.00 C ATOM 0 H ILE A 44 1.768 1.525 -1.605 1.00 0.00 H new ATOM 0 HA ILE A 44 3.365 -0.966 -1.874 1.00 0.00 H new ATOM 0 HB ILE A 44 0.801 -0.620 -0.400 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.613 0.362 0.968 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.918 -1.051 1.737 1.00 0.00 H new ATOM 0 HG21 ILE A 44 1.255 -2.982 0.447 1.00 0.00 H new ATOM 0 HG22 ILE A 44 1.074 -2.904 -1.321 1.00 0.00 H new ATOM 0 HG23 ILE A 44 2.695 -3.030 -0.598 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.364 -1.032 1.987 1.00 0.00 H new ATOM 0 HD12 ILE A 44 3.853 -2.422 0.999 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.559 -0.987 0.218 1.00 0.00 H new ATOM 713 N PHE A 45 2.113 -1.303 -4.012 1.00 0.00 N ATOM 714 CA PHE A 45 1.404 -1.662 -5.259 1.00 0.00 C ATOM 715 C PHE A 45 1.849 -3.023 -5.818 1.00 0.00 C ATOM 716 O PHE A 45 3.002 -3.425 -5.661 1.00 0.00 O ATOM 717 CB PHE A 45 1.586 -0.558 -6.327 1.00 0.00 C ATOM 718 CG PHE A 45 0.745 -0.694 -7.597 1.00 0.00 C ATOM 719 CD1 PHE A 45 -0.606 -1.107 -7.545 1.00 0.00 C ATOM 720 CD2 PHE A 45 1.292 -0.321 -8.844 1.00 0.00 C ATOM 721 CE1 PHE A 45 -1.387 -1.152 -8.714 1.00 0.00 C ATOM 722 CE2 PHE A 45 0.504 -0.344 -10.007 1.00 0.00 C ATOM 723 CZ PHE A 45 -0.834 -0.764 -9.947 1.00 0.00 C ATOM 0 H PHE A 45 3.098 -1.568 -4.024 1.00 0.00 H new ATOM 0 HA PHE A 45 0.347 -1.747 -5.008 1.00 0.00 H new ATOM 0 HB2 PHE A 45 1.357 0.403 -5.867 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.637 -0.531 -6.615 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.043 -1.391 -6.599 1.00 0.00 H new ATOM 0 HD2 PHE A 45 2.326 -0.015 -8.904 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.413 -1.485 -8.664 1.00 0.00 H new ATOM 0 HE2 PHE A 45 0.930 -0.037 -10.951 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.436 -0.789 -10.844 1.00 0.00 H new ATOM 733 N ALA A 46 0.926 -3.727 -6.480 1.00 0.00 N ATOM 734 CA ALA A 46 1.058 -5.074 -7.050 1.00 0.00 C ATOM 735 C ALA A 46 1.745 -6.094 -6.109 1.00 0.00 C ATOM 736 O ALA A 46 2.525 -6.949 -6.538 1.00 0.00 O ATOM 737 CB ALA A 46 1.683 -4.965 -8.446 1.00 0.00 C ATOM 0 H ALA A 46 -0.004 -3.342 -6.645 1.00 0.00 H new ATOM 0 HA ALA A 46 0.063 -5.505 -7.162 1.00 0.00 H new ATOM 0 HB1 ALA A 46 1.785 -5.961 -8.878 1.00 0.00 H new ATOM 0 HB2 ALA A 46 1.043 -4.356 -9.085 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.666 -4.500 -8.369 1.00 0.00 H new ATOM 743 N GLY A 47 1.455 -5.996 -4.806 1.00 0.00 N ATOM 744 CA GLY A 47 2.011 -6.847 -3.752 1.00 0.00 C ATOM 745 C GLY A 47 3.478 -6.566 -3.381 1.00 0.00 C ATOM 746 O GLY A 47 4.130 -7.432 -2.793 1.00 0.00 O ATOM 0 H GLY A 47 0.804 -5.298 -4.446 1.00 0.00 H new ATOM 0 HA2 GLY A 47 1.400 -6.734 -2.857 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.926 -7.887 -4.066 1.00 0.00 H new ATOM 750 N LYS A 48 4.016 -5.385 -3.723 1.00 0.00 N ATOM 751 CA LYS A 48 5.411 -4.964 -3.490 1.00 0.00 C ATOM 752 C LYS A 48 5.485 -3.599 -2.799 1.00 0.00 C ATOM 753 O LYS A 48 4.625 -2.738 -3.000 1.00 0.00 O ATOM 754 CB LYS A 48 6.171 -4.920 -4.833 1.00 0.00 C ATOM 755 CG LYS A 48 6.352 -6.289 -5.516 1.00 0.00 C ATOM 756 CD LYS A 48 7.318 -7.243 -4.793 1.00 0.00 C ATOM 757 CE LYS A 48 8.772 -6.755 -4.881 1.00 0.00 C ATOM 758 NZ LYS A 48 9.715 -7.725 -4.265 1.00 0.00 N ATOM 0 H LYS A 48 3.468 -4.663 -4.191 1.00 0.00 H new ATOM 0 HA LYS A 48 5.876 -5.693 -2.827 1.00 0.00 H new ATOM 0 HB2 LYS A 48 5.638 -4.257 -5.515 1.00 0.00 H new ATOM 0 HB3 LYS A 48 7.154 -4.481 -4.664 1.00 0.00 H new ATOM 0 HG2 LYS A 48 5.378 -6.772 -5.596 1.00 0.00 H new ATOM 0 HG3 LYS A 48 6.713 -6.129 -6.532 1.00 0.00 H new ATOM 0 HD2 LYS A 48 7.027 -7.331 -3.746 1.00 0.00 H new ATOM 0 HD3 LYS A 48 7.241 -8.239 -5.230 1.00 0.00 H new ATOM 0 HE2 LYS A 48 9.041 -6.599 -5.926 1.00 0.00 H new ATOM 0 HE3 LYS A 48 8.863 -5.791 -4.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 10.687 -7.362 -4.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 9.473 -7.855 -3.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 9.646 -8.638 -4.759 1.00 0.00 H new ATOM 772 N GLN A 49 6.542 -3.394 -2.010 1.00 0.00 N ATOM 773 CA GLN A 49 6.872 -2.114 -1.375 1.00 0.00 C ATOM 774 C GLN A 49 7.718 -1.247 -2.319 1.00 0.00 C ATOM 775 O GLN A 49 8.816 -1.638 -2.721 1.00 0.00 O ATOM 776 CB GLN A 49 7.559 -2.363 -0.023 1.00 0.00 C ATOM 777 CG GLN A 49 7.730 -1.064 0.786 1.00 0.00 C ATOM 778 CD GLN A 49 8.406 -1.302 2.133 1.00 0.00 C ATOM 779 OE1 GLN A 49 7.816 -1.145 3.196 1.00 0.00 O ATOM 780 NE2 GLN A 49 9.671 -1.664 2.152 1.00 0.00 N ATOM 0 H GLN A 49 7.210 -4.132 -1.789 1.00 0.00 H new ATOM 0 HA GLN A 49 5.957 -1.557 -1.176 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.972 -3.076 0.556 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.536 -2.817 -0.191 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.320 -0.354 0.207 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.753 -0.609 0.948 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.176 -1.799 1.276 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.146 -1.810 3.043 1.00 0.00 H new ATOM 789 N LEU A 50 7.178 -0.090 -2.705 1.00 0.00 N ATOM 790 CA LEU A 50 7.762 0.810 -3.701 1.00 0.00 C ATOM 791 C LEU A 50 8.915 1.627 -3.089 1.00 0.00 C ATOM 792 O LEU A 50 8.769 2.200 -2.005 1.00 0.00 O ATOM 793 CB LEU A 50 6.665 1.713 -4.296 1.00 0.00 C ATOM 794 CG LEU A 50 5.359 1.000 -4.720 1.00 0.00 C ATOM 795 CD1 LEU A 50 4.481 1.973 -5.508 1.00 0.00 C ATOM 796 CD2 LEU A 50 5.577 -0.255 -5.566 1.00 0.00 C ATOM 0 H LEU A 50 6.298 0.257 -2.323 1.00 0.00 H new ATOM 0 HA LEU A 50 8.188 0.221 -4.513 1.00 0.00 H new ATOM 0 HB2 LEU A 50 6.416 2.480 -3.563 1.00 0.00 H new ATOM 0 HB3 LEU A 50 7.075 2.225 -5.166 1.00 0.00 H new ATOM 0 HG LEU A 50 4.879 0.678 -3.796 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.561 1.472 -5.807 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.239 2.833 -4.883 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.016 2.309 -6.396 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.612 -0.694 -5.821 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.108 0.010 -6.480 1.00 0.00 H new ATOM 0 HD23 LEU A 50 6.166 -0.977 -5.001 1.00 0.00 H new ATOM 808 N GLU A 51 10.070 1.661 -3.754 1.00 0.00 N ATOM 809 CA GLU A 51 11.292 2.290 -3.225 1.00 0.00 C ATOM 810 C GLU A 51 11.327 3.796 -3.540 1.00 0.00 C ATOM 811 O GLU A 51 10.937 4.241 -4.617 1.00 0.00 O ATOM 812 CB GLU A 51 12.510 1.542 -3.779 1.00 0.00 C ATOM 813 CG GLU A 51 13.876 2.067 -3.321 1.00 0.00 C ATOM 814 CD GLU A 51 15.013 1.207 -3.907 1.00 0.00 C ATOM 815 OE1 GLU A 51 15.120 1.109 -5.155 1.00 0.00 O ATOM 816 OE2 GLU A 51 15.806 0.622 -3.129 1.00 0.00 O ATOM 0 H GLU A 51 10.190 1.252 -4.681 1.00 0.00 H new ATOM 0 HA GLU A 51 11.307 2.215 -2.138 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.430 0.493 -3.494 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.473 1.580 -4.868 1.00 0.00 H new ATOM 0 HG2 GLU A 51 13.997 3.103 -3.636 1.00 0.00 H new ATOM 0 HG3 GLU A 51 13.929 2.057 -2.232 1.00 0.00 H new ATOM 823 N ASP A 52 11.825 4.597 -2.600 1.00 0.00 N ATOM 824 CA ASP A 52 11.745 6.069 -2.611 1.00 0.00 C ATOM 825 C ASP A 52 12.409 6.761 -3.814 1.00 0.00 C ATOM 826 O ASP A 52 11.893 7.770 -4.305 1.00 0.00 O ATOM 827 CB ASP A 52 12.280 6.624 -1.285 1.00 0.00 C ATOM 828 CG ASP A 52 13.801 6.460 -1.117 1.00 0.00 C ATOM 829 OD1 ASP A 52 14.253 5.339 -0.784 1.00 0.00 O ATOM 830 OD2 ASP A 52 14.546 7.451 -1.308 1.00 0.00 O ATOM 0 H ASP A 52 12.312 4.235 -1.780 1.00 0.00 H new ATOM 0 HA ASP A 52 10.687 6.306 -2.725 1.00 0.00 H new ATOM 0 HB2 ASP A 52 12.027 7.682 -1.215 1.00 0.00 H new ATOM 0 HB3 ASP A 52 11.775 6.121 -0.460 1.00 0.00 H new ATOM 835 N GLY A 53 13.510 6.201 -4.325 1.00 0.00 N ATOM 836 CA GLY A 53 14.241 6.720 -5.486 1.00 0.00 C ATOM 837 C GLY A 53 13.631 6.346 -6.846 1.00 0.00 C ATOM 838 O GLY A 53 14.130 6.795 -7.882 1.00 0.00 O ATOM 0 H GLY A 53 13.927 5.356 -3.935 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.291 7.806 -5.411 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.266 6.351 -5.448 1.00 0.00 H new ATOM 842 N ARG A 54 12.572 5.524 -6.863 1.00 0.00 N ATOM 843 CA ARG A 54 11.832 5.124 -8.076 1.00 0.00 C ATOM 844 C ARG A 54 10.834 6.207 -8.478 1.00 0.00 C ATOM 845 O ARG A 54 10.576 7.136 -7.713 1.00 0.00 O ATOM 846 CB ARG A 54 11.081 3.802 -7.823 1.00 0.00 C ATOM 847 CG ARG A 54 11.974 2.666 -7.310 1.00 0.00 C ATOM 848 CD ARG A 54 12.864 2.067 -8.396 1.00 0.00 C ATOM 849 NE ARG A 54 13.993 1.337 -7.794 1.00 0.00 N ATOM 850 CZ ARG A 54 15.001 0.749 -8.402 1.00 0.00 C ATOM 851 NH1 ARG A 54 15.082 0.653 -9.701 1.00 0.00 N ATOM 852 NH2 ARG A 54 15.958 0.257 -7.678 1.00 0.00 N ATOM 0 H ARG A 54 12.194 5.106 -6.013 1.00 0.00 H new ATOM 0 HA ARG A 54 12.549 4.987 -8.886 1.00 0.00 H new ATOM 0 HB2 ARG A 54 10.286 3.981 -7.099 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.603 3.484 -8.750 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.601 3.042 -6.501 1.00 0.00 H new ATOM 0 HG3 ARG A 54 11.347 1.881 -6.889 1.00 0.00 H new ATOM 0 HD2 ARG A 54 12.280 1.393 -9.022 1.00 0.00 H new ATOM 0 HD3 ARG A 54 13.240 2.859 -9.044 1.00 0.00 H new ATOM 0 HE ARG A 54 13.993 1.280 -6.776 1.00 0.00 H new ATOM 0 HH11 ARG A 54 14.345 1.043 -10.288 1.00 0.00 H new ATOM 0 HH12 ARG A 54 15.883 0.188 -10.129 1.00 0.00 H new ATOM 0 HH21 ARG A 54 15.918 0.331 -6.661 1.00 0.00 H new ATOM 0 HH22 ARG A 54 16.751 -0.204 -8.125 1.00 0.00 H new ATOM 866 N THR A 55 10.222 6.056 -9.646 1.00 0.00 N ATOM 867 CA THR A 55 9.111 6.882 -10.142 1.00 0.00 C ATOM 868 C THR A 55 7.785 6.117 -10.172 1.00 0.00 C ATOM 869 O THR A 55 7.709 4.942 -9.807 1.00 0.00 O ATOM 870 CB THR A 55 9.404 7.422 -11.556 1.00 0.00 C ATOM 871 OG1 THR A 55 9.483 6.351 -12.468 1.00 0.00 O ATOM 872 CG2 THR A 55 10.691 8.234 -11.666 1.00 0.00 C ATOM 0 H THR A 55 10.492 5.327 -10.306 1.00 0.00 H new ATOM 0 HA THR A 55 9.018 7.712 -9.442 1.00 0.00 H new ATOM 0 HB THR A 55 8.578 8.095 -11.786 1.00 0.00 H new ATOM 0 HG1 THR A 55 10.224 5.761 -12.216 1.00 0.00 H new ATOM 0 HG21 THR A 55 10.819 8.575 -12.693 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.635 9.096 -11.002 1.00 0.00 H new ATOM 0 HG23 THR A 55 11.539 7.612 -11.382 1.00 0.00 H new ATOM 880 N LEU A 56 6.718 6.785 -10.609 1.00 0.00 N ATOM 881 CA LEU A 56 5.441 6.144 -10.925 1.00 0.00 C ATOM 882 C LEU A 56 5.637 5.184 -12.124 1.00 0.00 C ATOM 883 O LEU A 56 5.230 4.019 -12.077 1.00 0.00 O ATOM 884 CB LEU A 56 4.396 7.247 -11.206 1.00 0.00 C ATOM 885 CG LEU A 56 3.874 8.064 -10.005 1.00 0.00 C ATOM 886 CD1 LEU A 56 3.509 7.221 -8.781 1.00 0.00 C ATOM 887 CD2 LEU A 56 4.855 9.131 -9.540 1.00 0.00 C ATOM 0 H LEU A 56 6.715 7.794 -10.755 1.00 0.00 H new ATOM 0 HA LEU A 56 5.077 5.544 -10.091 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.829 7.944 -11.923 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.539 6.781 -11.692 1.00 0.00 H new ATOM 0 HG LEU A 56 2.970 8.525 -10.403 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.152 7.873 -7.984 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.726 6.512 -9.048 1.00 0.00 H new ATOM 0 HD13 LEU A 56 4.389 6.677 -8.438 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.431 9.671 -8.694 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.790 8.659 -9.238 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.048 9.828 -10.355 1.00 0.00 H new ATOM 899 N SER A 57 6.324 5.639 -13.178 1.00 0.00 N ATOM 900 CA SER A 57 6.642 4.856 -14.382 1.00 0.00 C ATOM 901 C SER A 57 7.454 3.577 -14.119 1.00 0.00 C ATOM 902 O SER A 57 7.260 2.576 -14.810 1.00 0.00 O ATOM 903 CB SER A 57 7.349 5.741 -15.420 1.00 0.00 C ATOM 904 OG SER A 57 8.715 5.994 -15.135 1.00 0.00 O ATOM 0 H SER A 57 6.686 6.592 -13.220 1.00 0.00 H new ATOM 0 HA SER A 57 5.684 4.513 -14.772 1.00 0.00 H new ATOM 0 HB2 SER A 57 7.276 5.264 -16.397 1.00 0.00 H new ATOM 0 HB3 SER A 57 6.822 6.692 -15.489 1.00 0.00 H new ATOM 0 HG SER A 57 8.834 6.098 -14.168 1.00 0.00 H new ATOM 910 N ASP A 58 8.300 3.558 -13.081 1.00 0.00 N ATOM 911 CA ASP A 58 9.088 2.391 -12.648 1.00 0.00 C ATOM 912 C ASP A 58 8.231 1.176 -12.244 1.00 0.00 C ATOM 913 O ASP A 58 8.692 0.039 -12.372 1.00 0.00 O ATOM 914 CB ASP A 58 9.982 2.783 -11.465 1.00 0.00 C ATOM 915 CG ASP A 58 11.318 3.390 -11.906 1.00 0.00 C ATOM 916 OD1 ASP A 58 12.207 2.634 -12.365 1.00 0.00 O ATOM 917 OD2 ASP A 58 11.489 4.621 -11.745 1.00 0.00 O ATOM 0 H ASP A 58 8.462 4.380 -12.499 1.00 0.00 H new ATOM 0 HA ASP A 58 9.681 2.089 -13.511 1.00 0.00 H new ATOM 0 HB2 ASP A 58 9.452 3.499 -10.837 1.00 0.00 H new ATOM 0 HB3 ASP A 58 10.173 1.902 -10.852 1.00 0.00 H new ATOM 922 N TYR A 59 6.984 1.396 -11.811 1.00 0.00 N ATOM 923 CA TYR A 59 6.017 0.341 -11.475 1.00 0.00 C ATOM 924 C TYR A 59 4.823 0.312 -12.446 1.00 0.00 C ATOM 925 O TYR A 59 3.792 -0.303 -12.167 1.00 0.00 O ATOM 926 CB TYR A 59 5.617 0.474 -10.000 1.00 0.00 C ATOM 927 CG TYR A 59 6.788 0.310 -9.049 1.00 0.00 C ATOM 928 CD1 TYR A 59 7.333 -0.969 -8.813 1.00 0.00 C ATOM 929 CD2 TYR A 59 7.331 1.433 -8.398 1.00 0.00 C ATOM 930 CE1 TYR A 59 8.404 -1.126 -7.912 1.00 0.00 C ATOM 931 CE2 TYR A 59 8.409 1.282 -7.507 1.00 0.00 C ATOM 932 CZ TYR A 59 8.941 -0.001 -7.250 1.00 0.00 C ATOM 933 OH TYR A 59 9.947 -0.149 -6.345 1.00 0.00 O ATOM 0 H TYR A 59 6.609 2.336 -11.681 1.00 0.00 H new ATOM 0 HA TYR A 59 6.487 -0.634 -11.602 1.00 0.00 H new ATOM 0 HB2 TYR A 59 5.161 1.451 -9.840 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.859 -0.274 -9.766 1.00 0.00 H new ATOM 0 HD1 TYR A 59 6.928 -1.830 -9.324 1.00 0.00 H new ATOM 0 HD2 TYR A 59 6.919 2.414 -8.583 1.00 0.00 H new ATOM 0 HE1 TYR A 59 8.815 -2.108 -7.728 1.00 0.00 H new ATOM 0 HE2 TYR A 59 8.830 2.148 -7.019 1.00 0.00 H new ATOM 0 HH TYR A 59 10.800 -0.245 -6.817 1.00 0.00 H new ATOM 943 N ASN A 60 4.969 0.977 -13.600 1.00 0.00 N ATOM 944 CA ASN A 60 3.971 1.144 -14.660 1.00 0.00 C ATOM 945 C ASN A 60 2.639 1.738 -14.150 1.00 0.00 C ATOM 946 O ASN A 60 1.568 1.460 -14.697 1.00 0.00 O ATOM 947 CB ASN A 60 3.845 -0.178 -15.448 1.00 0.00 C ATOM 948 CG ASN A 60 3.102 -0.015 -16.767 1.00 0.00 C ATOM 949 OD1 ASN A 60 3.341 0.907 -17.537 1.00 0.00 O ATOM 950 ND2 ASN A 60 2.192 -0.908 -17.088 1.00 0.00 N ATOM 0 H ASN A 60 5.847 1.443 -13.831 1.00 0.00 H new ATOM 0 HA ASN A 60 4.312 1.903 -15.364 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.841 -0.574 -15.645 1.00 0.00 H new ATOM 0 HB3 ASN A 60 3.326 -0.913 -14.833 1.00 0.00 H new ATOM 0 HD21 ASN A 60 1.691 -0.830 -17.973 1.00 0.00 H new ATOM 0 HD22 ASN A 60 1.987 -1.679 -16.452 1.00 0.00 H new ATOM 957 N ILE A 61 2.708 2.570 -13.103 1.00 0.00 N ATOM 958 CA ILE A 61 1.574 3.308 -12.534 1.00 0.00 C ATOM 959 C ILE A 61 0.902 4.133 -13.648 1.00 0.00 C ATOM 960 O ILE A 61 1.571 4.888 -14.360 1.00 0.00 O ATOM 961 CB ILE A 61 2.054 4.239 -11.402 1.00 0.00 C ATOM 962 CG1 ILE A 61 2.669 3.480 -10.205 1.00 0.00 C ATOM 963 CG2 ILE A 61 0.925 5.199 -10.968 1.00 0.00 C ATOM 964 CD1 ILE A 61 1.663 2.949 -9.191 1.00 0.00 C ATOM 0 H ILE A 61 3.583 2.754 -12.613 1.00 0.00 H new ATOM 0 HA ILE A 61 0.856 2.602 -12.116 1.00 0.00 H new ATOM 0 HB ILE A 61 2.869 4.838 -11.809 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.253 2.643 -10.587 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.363 4.145 -9.691 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.285 5.847 -10.169 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.619 5.808 -11.818 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.073 4.621 -10.610 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.192 2.432 -8.390 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.094 3.780 -8.773 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.982 2.254 -9.683 1.00 0.00 H new ATOM 976 N GLN A 62 -0.417 4.004 -13.785 1.00 0.00 N ATOM 977 CA GLN A 62 -1.238 4.783 -14.720 1.00 0.00 C ATOM 978 C GLN A 62 -1.969 5.925 -13.995 1.00 0.00 C ATOM 979 O GLN A 62 -2.007 5.971 -12.761 1.00 0.00 O ATOM 980 CB GLN A 62 -2.249 3.850 -15.418 1.00 0.00 C ATOM 981 CG GLN A 62 -1.611 2.670 -16.170 1.00 0.00 C ATOM 982 CD GLN A 62 -0.615 3.113 -17.241 1.00 0.00 C ATOM 983 OE1 GLN A 62 -0.950 3.807 -18.193 1.00 0.00 O ATOM 984 NE2 GLN A 62 0.638 2.733 -17.131 1.00 0.00 N ATOM 0 H GLN A 62 -0.961 3.338 -13.236 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.585 5.231 -15.469 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -2.939 3.458 -14.671 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.840 4.436 -16.121 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -1.103 2.023 -15.455 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -2.397 2.076 -16.636 1.00 0.00 H new ATOM 0 HE21 GLN A 62 0.928 2.155 -16.342 1.00 0.00 H new ATOM 0 HE22 GLN A 62 1.320 3.016 -17.834 1.00 0.00 H new ATOM 993 N LYS A 63 -2.590 6.838 -14.755 1.00 0.00 N ATOM 994 CA LYS A 63 -3.482 7.853 -14.173 1.00 0.00 C ATOM 995 C LYS A 63 -4.675 7.212 -13.449 1.00 0.00 C ATOM 996 O LYS A 63 -5.141 6.129 -13.807 1.00 0.00 O ATOM 997 CB LYS A 63 -3.891 8.923 -15.210 1.00 0.00 C ATOM 998 CG LYS A 63 -5.186 8.665 -16.006 1.00 0.00 C ATOM 999 CD LYS A 63 -5.193 7.419 -16.893 1.00 0.00 C ATOM 1000 CE LYS A 63 -4.319 7.651 -18.127 1.00 0.00 C ATOM 1001 NZ LYS A 63 -4.352 6.494 -19.059 1.00 0.00 N ATOM 0 H LYS A 63 -2.493 6.895 -15.769 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.921 8.387 -13.406 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.996 9.876 -14.691 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -3.073 9.036 -15.921 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.013 8.589 -15.300 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -5.382 9.534 -16.634 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -4.824 6.561 -16.332 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.213 7.185 -17.198 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -4.658 8.546 -18.648 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -3.291 7.835 -17.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -3.747 6.693 -19.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -4.004 5.645 -18.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -5.328 6.334 -19.379 1.00 0.00 H new ATOM 1015 N GLU A 64 -5.175 7.906 -12.436 1.00 0.00 N ATOM 1016 CA GLU A 64 -6.255 7.501 -11.526 1.00 0.00 C ATOM 1017 C GLU A 64 -6.036 6.144 -10.818 1.00 0.00 C ATOM 1018 O GLU A 64 -6.989 5.548 -10.309 1.00 0.00 O ATOM 1019 CB GLU A 64 -7.633 7.588 -12.217 1.00 0.00 C ATOM 1020 CG GLU A 64 -7.936 8.931 -12.894 1.00 0.00 C ATOM 1021 CD GLU A 64 -9.328 8.908 -13.554 1.00 0.00 C ATOM 1022 OE1 GLU A 64 -10.336 9.213 -12.869 1.00 0.00 O ATOM 1023 OE2 GLU A 64 -9.428 8.588 -14.763 1.00 0.00 O ATOM 0 H GLU A 64 -4.816 8.833 -12.206 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.234 8.228 -10.714 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -7.698 6.798 -12.966 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -8.407 7.389 -11.476 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.891 9.733 -12.157 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.176 9.145 -13.645 1.00 0.00 H new ATOM 1030 N SER A 65 -4.794 5.643 -10.762 1.00 0.00 N ATOM 1031 CA SER A 65 -4.467 4.385 -10.075 1.00 0.00 C ATOM 1032 C SER A 65 -4.710 4.491 -8.562 1.00 0.00 C ATOM 1033 O SER A 65 -4.586 5.571 -7.982 1.00 0.00 O ATOM 1034 CB SER A 65 -3.021 3.977 -10.362 1.00 0.00 C ATOM 1035 OG SER A 65 -2.788 2.668 -9.874 1.00 0.00 O ATOM 0 H SER A 65 -3.988 6.098 -11.191 1.00 0.00 H new ATOM 0 HA SER A 65 -5.130 3.612 -10.463 1.00 0.00 H new ATOM 0 HB2 SER A 65 -2.828 4.015 -11.434 1.00 0.00 H new ATOM 0 HB3 SER A 65 -2.334 4.679 -9.889 1.00 0.00 H new ATOM 0 HG SER A 65 -1.861 2.409 -10.061 1.00 0.00 H new ATOM 1041 N THR A 66 -5.044 3.374 -7.916 1.00 0.00 N ATOM 1042 CA THR A 66 -5.515 3.286 -6.521 1.00 0.00 C ATOM 1043 C THR A 66 -4.540 2.488 -5.654 1.00 0.00 C ATOM 1044 O THR A 66 -4.643 1.265 -5.526 1.00 0.00 O ATOM 1045 CB THR A 66 -6.947 2.717 -6.440 1.00 0.00 C ATOM 1046 OG1 THR A 66 -7.084 1.529 -7.200 1.00 0.00 O ATOM 1047 CG2 THR A 66 -7.984 3.709 -6.971 1.00 0.00 C ATOM 0 H THR A 66 -4.994 2.460 -8.366 1.00 0.00 H new ATOM 0 HA THR A 66 -5.550 4.300 -6.123 1.00 0.00 H new ATOM 0 HB THR A 66 -7.121 2.515 -5.383 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.337 0.926 -7.002 1.00 0.00 H new ATOM 0 HG21 THR A 66 -8.979 3.270 -6.896 1.00 0.00 H new ATOM 0 HG22 THR A 66 -7.946 4.625 -6.382 1.00 0.00 H new ATOM 0 HG23 THR A 66 -7.766 3.939 -8.014 1.00 0.00 H new ATOM 1055 N LEU A 67 -3.555 3.185 -5.083 1.00 0.00 N ATOM 1056 CA LEU A 67 -2.468 2.608 -4.286 1.00 0.00 C ATOM 1057 C LEU A 67 -2.793 2.619 -2.783 1.00 0.00 C ATOM 1058 O LEU A 67 -3.776 3.224 -2.353 1.00 0.00 O ATOM 1059 CB LEU A 67 -1.156 3.369 -4.594 1.00 0.00 C ATOM 1060 CG LEU A 67 -0.667 3.372 -6.062 1.00 0.00 C ATOM 1061 CD1 LEU A 67 -0.987 2.070 -6.790 1.00 0.00 C ATOM 1062 CD2 LEU A 67 -1.211 4.531 -6.899 1.00 0.00 C ATOM 0 H LEU A 67 -3.489 4.200 -5.165 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.345 1.561 -4.562 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.284 4.405 -4.279 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.366 2.943 -3.976 1.00 0.00 H new ATOM 0 HG LEU A 67 0.412 3.492 -5.969 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.622 2.127 -7.815 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.503 1.238 -6.278 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.066 1.913 -6.797 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.821 4.461 -7.915 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.300 4.482 -6.924 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.900 5.477 -6.456 1.00 0.00 H new ATOM 1074 N HIS A 68 -1.948 1.989 -1.966 1.00 0.00 N ATOM 1075 CA HIS A 68 -1.993 2.073 -0.500 1.00 0.00 C ATOM 1076 C HIS A 68 -0.719 2.719 0.062 1.00 0.00 C ATOM 1077 O HIS A 68 0.359 2.573 -0.522 1.00 0.00 O ATOM 1078 CB HIS A 68 -2.170 0.667 0.100 1.00 0.00 C ATOM 1079 CG HIS A 68 -3.603 0.201 0.181 1.00 0.00 C ATOM 1080 ND1 HIS A 68 -4.399 -0.201 -0.870 1.00 0.00 N ATOM 1081 CD2 HIS A 68 -4.344 0.094 1.328 1.00 0.00 C ATOM 1082 CE1 HIS A 68 -5.597 -0.544 -0.366 1.00 0.00 C ATOM 1083 NE2 HIS A 68 -5.610 -0.383 0.969 1.00 0.00 N ATOM 0 H HIS A 68 -1.196 1.392 -2.310 1.00 0.00 H new ATOM 0 HA HIS A 68 -2.842 2.699 -0.225 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -1.602 -0.045 -0.499 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -1.740 0.655 1.101 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -4.128 -0.233 -1.853 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -4.012 0.334 2.327 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -6.432 -0.899 -0.951 1.00 0.00 H new ATOM 1091 N LEU A 69 -0.835 3.390 1.215 1.00 0.00 N ATOM 1092 CA LEU A 69 0.297 3.864 2.008 1.00 0.00 C ATOM 1093 C LEU A 69 0.321 3.128 3.355 1.00 0.00 C ATOM 1094 O LEU A 69 -0.725 2.808 3.928 1.00 0.00 O ATOM 1095 CB LEU A 69 0.301 5.395 2.178 1.00 0.00 C ATOM 1096 CG LEU A 69 -0.808 5.976 3.084 1.00 0.00 C ATOM 1097 CD1 LEU A 69 -0.252 7.132 3.904 1.00 0.00 C ATOM 1098 CD2 LEU A 69 -2.006 6.460 2.267 1.00 0.00 C ATOM 0 H LEU A 69 -1.739 3.621 1.628 1.00 0.00 H new ATOM 0 HA LEU A 69 1.215 3.633 1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 69 1.268 5.694 2.583 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.214 5.851 1.192 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.148 5.180 3.746 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.038 7.538 4.541 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.570 6.775 4.525 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.111 7.912 3.234 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.765 6.862 2.938 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.684 7.239 1.575 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.424 5.625 1.704 1.00 0.00 H new ATOM 1110 N VAL A 70 1.520 2.857 3.860 1.00 0.00 N ATOM 1111 CA VAL A 70 1.757 2.182 5.137 1.00 0.00 C ATOM 1112 C VAL A 70 2.790 2.936 5.954 1.00 0.00 C ATOM 1113 O VAL A 70 3.762 3.444 5.405 1.00 0.00 O ATOM 1114 CB VAL A 70 2.174 0.727 4.914 1.00 0.00 C ATOM 1115 CG1 VAL A 70 1.056 -0.038 4.201 1.00 0.00 C ATOM 1116 CG2 VAL A 70 3.479 0.566 4.135 1.00 0.00 C ATOM 0 H VAL A 70 2.383 3.108 3.378 1.00 0.00 H new ATOM 0 HA VAL A 70 0.825 2.174 5.702 1.00 0.00 H new ATOM 0 HB VAL A 70 2.352 0.313 5.907 1.00 0.00 H new ATOM 0 HG11 VAL A 70 1.364 -1.072 4.047 1.00 0.00 H new ATOM 0 HG12 VAL A 70 0.153 -0.015 4.811 1.00 0.00 H new ATOM 0 HG13 VAL A 70 0.854 0.428 3.236 1.00 0.00 H new ATOM 0 HG21 VAL A 70 3.705 -0.494 4.019 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.375 1.024 3.152 1.00 0.00 H new ATOM 0 HG23 VAL A 70 4.289 1.053 4.678 1.00 0.00 H new ATOM 1126 N LEU A 71 2.587 3.010 7.266 1.00 0.00 N ATOM 1127 CA LEU A 71 3.464 3.727 8.195 1.00 0.00 C ATOM 1128 C LEU A 71 4.412 2.769 8.939 1.00 0.00 C ATOM 1129 O LEU A 71 4.075 1.608 9.186 1.00 0.00 O ATOM 1130 CB LEU A 71 2.582 4.544 9.163 1.00 0.00 C ATOM 1131 CG LEU A 71 2.158 5.951 8.686 1.00 0.00 C ATOM 1132 CD1 LEU A 71 3.352 6.908 8.613 1.00 0.00 C ATOM 1133 CD2 LEU A 71 1.429 5.953 7.343 1.00 0.00 C ATOM 0 H LEU A 71 1.793 2.565 7.726 1.00 0.00 H new ATOM 0 HA LEU A 71 4.111 4.406 7.639 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.680 3.968 9.372 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.118 4.650 10.106 1.00 0.00 H new ATOM 0 HG LEU A 71 1.453 6.299 9.441 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.013 7.887 8.274 1.00 0.00 H new ATOM 0 HD12 LEU A 71 3.804 7.002 9.601 1.00 0.00 H new ATOM 0 HD13 LEU A 71 4.090 6.516 7.913 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.163 6.976 7.075 1.00 0.00 H new ATOM 0 HD22 LEU A 71 2.079 5.534 6.575 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.523 5.351 7.420 1.00 0.00 H new ATOM 1145 N ARG A 72 5.594 3.269 9.326 1.00 0.00 N ATOM 1146 CA ARG A 72 6.644 2.531 10.061 1.00 0.00 C ATOM 1147 C ARG A 72 6.429 2.426 11.575 1.00 0.00 C ATOM 1148 O ARG A 72 7.117 1.645 12.232 1.00 0.00 O ATOM 1149 CB ARG A 72 8.031 3.116 9.729 1.00 0.00 C ATOM 1150 CG ARG A 72 8.372 4.495 10.332 1.00 0.00 C ATOM 1151 CD ARG A 72 9.753 4.916 9.797 1.00 0.00 C ATOM 1152 NE ARG A 72 10.268 6.200 10.312 1.00 0.00 N ATOM 1153 CZ ARG A 72 10.809 6.470 11.485 1.00 0.00 C ATOM 1154 NH1 ARG A 72 10.860 5.601 12.455 1.00 0.00 N ATOM 1155 NH2 ARG A 72 11.316 7.647 11.691 1.00 0.00 N ATOM 0 H ARG A 72 5.860 4.234 9.131 1.00 0.00 H new ATOM 0 HA ARG A 72 6.581 1.501 9.711 1.00 0.00 H new ATOM 0 HB2 ARG A 72 8.787 2.405 10.061 1.00 0.00 H new ATOM 0 HB3 ARG A 72 8.117 3.190 8.645 1.00 0.00 H new ATOM 0 HG2 ARG A 72 7.616 5.230 10.056 1.00 0.00 H new ATOM 0 HG3 ARG A 72 8.384 4.443 11.421 1.00 0.00 H new ATOM 0 HD2 ARG A 72 10.471 4.133 10.039 1.00 0.00 H new ATOM 0 HD3 ARG A 72 9.700 4.975 8.710 1.00 0.00 H new ATOM 0 HE ARG A 72 10.195 6.990 9.671 1.00 0.00 H new ATOM 0 HH11 ARG A 72 10.472 4.667 12.324 1.00 0.00 H new ATOM 0 HH12 ARG A 72 11.288 5.855 13.345 1.00 0.00 H new ATOM 0 HH21 ARG A 72 11.293 8.349 10.951 1.00 0.00 H new ATOM 0 HH22 ARG A 72 11.737 7.870 12.593 1.00 0.00 H new ATOM 1366 N PRO B 328 -11.178 -16.902 10.357 1.00 0.00 N ATOM 1367 CA PRO B 328 -10.342 -15.782 9.901 1.00 0.00 C ATOM 1368 C PRO B 328 -10.705 -15.245 8.510 1.00 0.00 C ATOM 1369 O PRO B 328 -10.509 -14.061 8.241 1.00 0.00 O ATOM 1370 CB PRO B 328 -8.902 -16.301 9.953 1.00 0.00 C ATOM 1371 CG PRO B 328 -9.052 -17.815 9.825 1.00 0.00 C ATOM 1372 CD PRO B 328 -10.352 -18.081 10.577 1.00 0.00 C ATOM 0 HA PRO B 328 -10.497 -14.918 10.548 1.00 0.00 H new ATOM 0 HB2 PRO B 328 -8.300 -15.889 9.143 1.00 0.00 H new ATOM 0 HB3 PRO B 328 -8.412 -16.026 10.887 1.00 0.00 H new ATOM 0 HG2 PRO B 328 -9.114 -18.130 8.783 1.00 0.00 H new ATOM 0 HG3 PRO B 328 -8.210 -18.346 10.269 1.00 0.00 H new ATOM 0 HD2 PRO B 328 -10.844 -18.980 10.205 1.00 0.00 H new ATOM 0 HD3 PRO B 328 -10.166 -18.237 11.640 1.00 0.00 H new ATOM 1380 N GLU B 329 -11.287 -16.086 7.652 1.00 0.00 N ATOM 1381 CA GLU B 329 -11.774 -15.737 6.306 1.00 0.00 C ATOM 1382 C GLU B 329 -12.838 -14.619 6.272 1.00 0.00 C ATOM 1383 O GLU B 329 -13.028 -13.986 5.231 1.00 0.00 O ATOM 1384 CB GLU B 329 -12.294 -17.003 5.603 1.00 0.00 C ATOM 1385 CG GLU B 329 -13.545 -17.614 6.257 1.00 0.00 C ATOM 1386 CD GLU B 329 -13.982 -18.889 5.510 1.00 0.00 C ATOM 1387 OE1 GLU B 329 -14.755 -18.789 4.527 1.00 0.00 O ATOM 1388 OE2 GLU B 329 -13.556 -20.004 5.900 1.00 0.00 O ATOM 0 H GLU B 329 -11.440 -17.068 7.880 1.00 0.00 H new ATOM 0 HA GLU B 329 -10.918 -15.325 5.772 1.00 0.00 H new ATOM 0 HB2 GLU B 329 -12.521 -16.762 4.564 1.00 0.00 H new ATOM 0 HB3 GLU B 329 -11.501 -17.751 5.591 1.00 0.00 H new ATOM 0 HG2 GLU B 329 -13.337 -17.851 7.300 1.00 0.00 H new ATOM 0 HG3 GLU B 329 -14.357 -16.887 6.251 1.00 0.00 H new ATOM 1395 N GLU B 330 -13.509 -14.344 7.397 1.00 0.00 N ATOM 1396 CA GLU B 330 -14.431 -13.206 7.558 1.00 0.00 C ATOM 1397 C GLU B 330 -14.236 -12.410 8.864 1.00 0.00 C ATOM 1398 O GLU B 330 -14.530 -11.213 8.895 1.00 0.00 O ATOM 1399 CB GLU B 330 -15.889 -13.653 7.362 1.00 0.00 C ATOM 1400 CG GLU B 330 -16.383 -14.672 8.394 1.00 0.00 C ATOM 1401 CD GLU B 330 -17.852 -15.045 8.118 1.00 0.00 C ATOM 1402 OE1 GLU B 330 -18.762 -14.315 8.583 1.00 0.00 O ATOM 1403 OE2 GLU B 330 -18.116 -16.054 7.418 1.00 0.00 O ATOM 0 H GLU B 330 -13.427 -14.915 8.238 1.00 0.00 H new ATOM 0 HA GLU B 330 -14.177 -12.499 6.768 1.00 0.00 H new ATOM 0 HB2 GLU B 330 -16.534 -12.775 7.399 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -15.994 -14.083 6.366 1.00 0.00 H new ATOM 0 HG2 GLU B 330 -15.761 -15.566 8.358 1.00 0.00 H new ATOM 0 HG3 GLU B 330 -16.288 -14.258 9.398 1.00 0.00 H new ATOM 1410 N ARG B 331 -13.652 -13.006 9.915 1.00 0.00 N ATOM 1411 CA ARG B 331 -13.237 -12.303 11.147 1.00 0.00 C ATOM 1412 C ARG B 331 -12.192 -11.203 10.885 1.00 0.00 C ATOM 1413 O ARG B 331 -12.132 -10.231 11.638 1.00 0.00 O ATOM 1414 CB ARG B 331 -12.742 -13.350 12.166 1.00 0.00 C ATOM 1415 CG ARG B 331 -12.391 -12.851 13.579 1.00 0.00 C ATOM 1416 CD ARG B 331 -13.603 -12.399 14.408 1.00 0.00 C ATOM 1417 NE ARG B 331 -14.080 -11.056 14.024 1.00 0.00 N ATOM 1418 CZ ARG B 331 -15.324 -10.647 13.845 1.00 0.00 C ATOM 1419 NH1 ARG B 331 -16.346 -11.454 13.877 1.00 0.00 N ATOM 1420 NH2 ARG B 331 -15.567 -9.389 13.614 1.00 0.00 N ATOM 0 H ARG B 331 -13.450 -14.006 9.937 1.00 0.00 H new ATOM 0 HA ARG B 331 -14.098 -11.776 11.558 1.00 0.00 H new ATOM 0 HB2 ARG B 331 -13.510 -14.117 12.261 1.00 0.00 H new ATOM 0 HB3 ARG B 331 -11.858 -13.833 11.750 1.00 0.00 H new ATOM 0 HG2 ARG B 331 -11.875 -13.647 14.115 1.00 0.00 H new ATOM 0 HG3 ARG B 331 -11.692 -12.019 13.495 1.00 0.00 H new ATOM 0 HD2 ARG B 331 -14.413 -13.118 14.284 1.00 0.00 H new ATOM 0 HD3 ARG B 331 -13.337 -12.398 15.465 1.00 0.00 H new ATOM 0 HE ARG B 331 -13.356 -10.353 13.878 1.00 0.00 H new ATOM 0 HH11 ARG B 331 -16.204 -12.450 14.046 1.00 0.00 H new ATOM 0 HH12 ARG B 331 -17.288 -11.090 13.733 1.00 0.00 H new ATOM 0 HH21 ARG B 331 -14.798 -8.720 13.571 1.00 0.00 H new ATOM 0 HH22 ARG B 331 -16.527 -9.072 13.476 1.00 0.00 H new ATOM 1434 N TYR B 332 -11.435 -11.319 9.790 1.00 0.00 N ATOM 1435 CA TYR B 332 -10.448 -10.344 9.302 1.00 0.00 C ATOM 1436 C TYR B 332 -10.819 -9.737 7.929 1.00 0.00 C ATOM 1437 O TYR B 332 -9.937 -9.298 7.192 1.00 0.00 O ATOM 1438 CB TYR B 332 -9.051 -10.992 9.260 1.00 0.00 C ATOM 1439 CG TYR B 332 -8.533 -11.668 10.522 1.00 0.00 C ATOM 1440 CD1 TYR B 332 -8.765 -11.112 11.797 1.00 0.00 C ATOM 1441 CD2 TYR B 332 -7.745 -12.831 10.403 1.00 0.00 C ATOM 1442 CE1 TYR B 332 -8.230 -11.728 12.945 1.00 0.00 C ATOM 1443 CE2 TYR B 332 -7.200 -13.445 11.548 1.00 0.00 C ATOM 1444 CZ TYR B 332 -7.446 -12.895 12.825 1.00 0.00 C ATOM 1445 OH TYR B 332 -6.929 -13.478 13.941 1.00 0.00 O ATOM 0 H TYR B 332 -11.496 -12.139 9.186 1.00 0.00 H new ATOM 0 HA TYR B 332 -10.443 -9.511 10.005 1.00 0.00 H new ATOM 0 HB2 TYR B 332 -9.052 -11.734 8.461 1.00 0.00 H new ATOM 0 HB3 TYR B 332 -8.335 -10.221 8.978 1.00 0.00 H new ATOM 0 HD1 TYR B 332 -9.354 -10.212 11.893 1.00 0.00 H new ATOM 0 HD2 TYR B 332 -7.558 -13.254 9.427 1.00 0.00 H new ATOM 0 HE1 TYR B 332 -8.420 -11.306 13.921 1.00 0.00 H new ATOM 0 HE2 TYR B 332 -6.595 -14.334 11.449 1.00 0.00 H new ATOM 0 HH TYR B 332 -6.415 -14.273 13.687 1.00 0.00 H new ATOM 1455 N GLU B 333 -12.105 -9.720 7.546 1.00 0.00 N ATOM 1456 CA GLU B 333 -12.593 -9.275 6.224 1.00 0.00 C ATOM 1457 C GLU B 333 -11.987 -7.941 5.741 1.00 0.00 C ATOM 1458 O GLU B 333 -11.508 -7.854 4.611 1.00 0.00 O ATOM 1459 CB GLU B 333 -14.130 -9.208 6.247 1.00 0.00 C ATOM 1460 CG GLU B 333 -14.725 -8.698 4.928 1.00 0.00 C ATOM 1461 CD GLU B 333 -16.258 -8.851 4.913 1.00 0.00 C ATOM 1462 OE1 GLU B 333 -16.968 -7.958 5.438 1.00 0.00 O ATOM 1463 OE2 GLU B 333 -16.767 -9.861 4.368 1.00 0.00 O ATOM 0 H GLU B 333 -12.859 -10.024 8.163 1.00 0.00 H new ATOM 0 HA GLU B 333 -12.257 -10.015 5.497 1.00 0.00 H new ATOM 0 HB2 GLU B 333 -14.529 -10.200 6.460 1.00 0.00 H new ATOM 0 HB3 GLU B 333 -14.448 -8.555 7.060 1.00 0.00 H new ATOM 0 HG2 GLU B 333 -14.460 -7.650 4.787 1.00 0.00 H new ATOM 0 HG3 GLU B 333 -14.293 -9.251 4.093 1.00 0.00 H new ATOM 1470 N HIS B 334 -11.973 -6.915 6.595 1.00 0.00 N ATOM 1471 CA HIS B 334 -11.340 -5.617 6.325 1.00 0.00 C ATOM 1472 C HIS B 334 -9.860 -5.753 5.940 1.00 0.00 C ATOM 1473 O HIS B 334 -9.432 -5.253 4.901 1.00 0.00 O ATOM 1474 CB HIS B 334 -11.472 -4.726 7.569 1.00 0.00 C ATOM 1475 CG HIS B 334 -12.851 -4.146 7.759 1.00 0.00 C ATOM 1476 ND1 HIS B 334 -13.393 -3.095 7.050 1.00 0.00 N ATOM 1477 CD2 HIS B 334 -13.784 -4.556 8.674 1.00 0.00 C ATOM 1478 CE1 HIS B 334 -14.633 -2.875 7.525 1.00 0.00 C ATOM 1479 NE2 HIS B 334 -14.912 -3.741 8.516 1.00 0.00 N ATOM 0 H HIS B 334 -12.411 -6.962 7.515 1.00 0.00 H new ATOM 0 HA HIS B 334 -11.852 -5.168 5.474 1.00 0.00 H new ATOM 0 HB2 HIS B 334 -11.209 -5.309 8.452 1.00 0.00 H new ATOM 0 HB3 HIS B 334 -10.752 -3.911 7.499 1.00 0.00 H new ATOM 0 HD2 HIS B 334 -13.671 -5.360 9.386 1.00 0.00 H new ATOM 0 HE1 HIS B 334 -15.307 -2.113 7.163 1.00 0.00 H new ATOM 0 HE2 HIS B 334 -15.779 -3.794 9.050 1.00 0.00 H new ATOM 1487 N GLN B 335 -9.069 -6.430 6.771 1.00 0.00 N ATOM 1488 CA GLN B 335 -7.637 -6.639 6.555 1.00 0.00 C ATOM 1489 C GLN B 335 -7.361 -7.451 5.281 1.00 0.00 C ATOM 1490 O GLN B 335 -6.504 -7.071 4.481 1.00 0.00 O ATOM 1491 CB GLN B 335 -7.036 -7.340 7.779 1.00 0.00 C ATOM 1492 CG GLN B 335 -7.143 -6.519 9.075 1.00 0.00 C ATOM 1493 CD GLN B 335 -8.282 -6.993 9.980 1.00 0.00 C ATOM 1494 OE1 GLN B 335 -9.451 -6.986 9.618 1.00 0.00 O ATOM 1495 NE2 GLN B 335 -7.988 -7.418 11.189 1.00 0.00 N ATOM 0 H GLN B 335 -9.412 -6.858 7.631 1.00 0.00 H new ATOM 0 HA GLN B 335 -7.167 -5.665 6.421 1.00 0.00 H new ATOM 0 HB2 GLN B 335 -7.539 -8.296 7.922 1.00 0.00 H new ATOM 0 HB3 GLN B 335 -5.986 -7.558 7.583 1.00 0.00 H new ATOM 0 HG2 GLN B 335 -6.201 -6.582 9.620 1.00 0.00 H new ATOM 0 HG3 GLN B 335 -7.296 -5.469 8.824 1.00 0.00 H new ATOM 0 HE21 GLN B 335 -7.018 -7.429 11.504 1.00 0.00 H new ATOM 0 HE22 GLN B 335 -8.730 -7.736 11.812 1.00 0.00 H new ATOM 1504 N LEU B 336 -8.124 -8.525 5.053 1.00 0.00 N ATOM 1505 CA LEU B 336 -8.097 -9.311 3.815 1.00 0.00 C ATOM 1506 C LEU B 336 -8.368 -8.428 2.587 1.00 0.00 C ATOM 1507 O LEU B 336 -7.610 -8.484 1.620 1.00 0.00 O ATOM 1508 CB LEU B 336 -9.104 -10.474 3.910 1.00 0.00 C ATOM 1509 CG LEU B 336 -8.726 -11.569 4.926 1.00 0.00 C ATOM 1510 CD1 LEU B 336 -9.891 -12.539 5.109 1.00 0.00 C ATOM 1511 CD2 LEU B 336 -7.517 -12.380 4.463 1.00 0.00 C ATOM 0 H LEU B 336 -8.791 -8.880 5.738 1.00 0.00 H new ATOM 0 HA LEU B 336 -7.099 -9.730 3.690 1.00 0.00 H new ATOM 0 HB2 LEU B 336 -10.081 -10.071 4.177 1.00 0.00 H new ATOM 0 HB3 LEU B 336 -9.206 -10.930 2.925 1.00 0.00 H new ATOM 0 HG LEU B 336 -8.485 -11.063 5.861 1.00 0.00 H new ATOM 0 HD11 LEU B 336 -9.614 -13.309 5.829 1.00 0.00 H new ATOM 0 HD12 LEU B 336 -10.762 -11.996 5.476 1.00 0.00 H new ATOM 0 HD13 LEU B 336 -10.130 -13.005 4.153 1.00 0.00 H new ATOM 0 HD21 LEU B 336 -7.283 -13.141 5.207 1.00 0.00 H new ATOM 0 HD22 LEU B 336 -7.744 -12.860 3.511 1.00 0.00 H new ATOM 0 HD23 LEU B 336 -6.660 -11.718 4.340 1.00 0.00 H new ATOM 1523 N ARG B 337 -9.395 -7.569 2.637 1.00 0.00 N ATOM 1524 CA ARG B 337 -9.751 -6.619 1.571 1.00 0.00 C ATOM 1525 C ARG B 337 -8.637 -5.605 1.283 1.00 0.00 C ATOM 1526 O ARG B 337 -8.321 -5.386 0.112 1.00 0.00 O ATOM 1527 CB ARG B 337 -11.091 -5.956 1.940 1.00 0.00 C ATOM 1528 CG ARG B 337 -11.599 -4.972 0.880 1.00 0.00 C ATOM 1529 CD ARG B 337 -13.009 -4.484 1.237 1.00 0.00 C ATOM 1530 NE ARG B 337 -13.538 -3.560 0.215 1.00 0.00 N ATOM 1531 CZ ARG B 337 -14.177 -3.866 -0.902 1.00 0.00 C ATOM 1532 NH1 ARG B 337 -14.427 -5.098 -1.248 1.00 0.00 N ATOM 1533 NH2 ARG B 337 -14.583 -2.926 -1.707 1.00 0.00 N ATOM 0 H ARG B 337 -10.019 -7.513 3.442 1.00 0.00 H new ATOM 0 HA ARG B 337 -9.870 -7.159 0.632 1.00 0.00 H new ATOM 0 HB2 ARG B 337 -11.841 -6.732 2.093 1.00 0.00 H new ATOM 0 HB3 ARG B 337 -10.978 -5.430 2.888 1.00 0.00 H new ATOM 0 HG2 ARG B 337 -10.920 -4.122 0.808 1.00 0.00 H new ATOM 0 HG3 ARG B 337 -11.611 -5.454 -0.097 1.00 0.00 H new ATOM 0 HD2 ARG B 337 -13.677 -5.340 1.336 1.00 0.00 H new ATOM 0 HD3 ARG B 337 -12.987 -3.983 2.205 1.00 0.00 H new ATOM 0 HE ARG B 337 -13.393 -2.566 0.391 1.00 0.00 H new ATOM 0 HH11 ARG B 337 -14.127 -5.867 -0.649 1.00 0.00 H new ATOM 0 HH12 ARG B 337 -14.923 -5.293 -2.118 1.00 0.00 H new ATOM 0 HH21 ARG B 337 -14.409 -1.948 -1.478 1.00 0.00 H new ATOM 0 HH22 ARG B 337 -15.075 -3.168 -2.567 1.00 0.00 H new ATOM 1547 N GLN B 338 -8.012 -5.025 2.316 1.00 0.00 N ATOM 1548 CA GLN B 338 -6.840 -4.142 2.171 1.00 0.00 C ATOM 1549 C GLN B 338 -5.708 -4.866 1.418 1.00 0.00 C ATOM 1550 O GLN B 338 -5.227 -4.363 0.404 1.00 0.00 O ATOM 1551 CB GLN B 338 -6.343 -3.614 3.536 1.00 0.00 C ATOM 1552 CG GLN B 338 -7.362 -2.741 4.294 1.00 0.00 C ATOM 1553 CD GLN B 338 -7.297 -1.259 3.932 1.00 0.00 C ATOM 1554 OE1 GLN B 338 -8.136 -0.725 3.218 1.00 0.00 O ATOM 1555 NE2 GLN B 338 -6.328 -0.533 4.452 1.00 0.00 N ATOM 0 H GLN B 338 -8.305 -5.154 3.284 1.00 0.00 H new ATOM 0 HA GLN B 338 -7.151 -3.277 1.585 1.00 0.00 H new ATOM 0 HB2 GLN B 338 -6.074 -4.464 4.164 1.00 0.00 H new ATOM 0 HB3 GLN B 338 -5.434 -3.034 3.378 1.00 0.00 H new ATOM 0 HG2 GLN B 338 -8.366 -3.111 4.089 1.00 0.00 H new ATOM 0 HG3 GLN B 338 -7.194 -2.851 5.365 1.00 0.00 H new ATOM 0 HE21 GLN B 338 -5.626 -0.971 5.048 1.00 0.00 H new ATOM 0 HE22 GLN B 338 -6.280 0.467 4.259 1.00 0.00 H new ATOM 1564 N LEU B 339 -5.336 -6.074 1.865 1.00 0.00 N ATOM 1565 CA LEU B 339 -4.337 -6.933 1.215 1.00 0.00 C ATOM 1566 C LEU B 339 -4.685 -7.236 -0.256 1.00 0.00 C ATOM 1567 O LEU B 339 -3.872 -6.999 -1.149 1.00 0.00 O ATOM 1568 CB LEU B 339 -4.140 -8.226 2.033 1.00 0.00 C ATOM 1569 CG LEU B 339 -3.465 -8.033 3.403 1.00 0.00 C ATOM 1570 CD1 LEU B 339 -3.529 -9.349 4.178 1.00 0.00 C ATOM 1571 CD2 LEU B 339 -1.997 -7.620 3.277 1.00 0.00 C ATOM 0 H LEU B 339 -5.731 -6.490 2.708 1.00 0.00 H new ATOM 0 HA LEU B 339 -3.394 -6.387 1.193 1.00 0.00 H new ATOM 0 HB2 LEU B 339 -5.113 -8.692 2.187 1.00 0.00 H new ATOM 0 HB3 LEU B 339 -3.542 -8.922 1.445 1.00 0.00 H new ATOM 0 HG LEU B 339 -3.998 -7.236 3.921 1.00 0.00 H new ATOM 0 HD11 LEU B 339 -3.053 -9.222 5.150 1.00 0.00 H new ATOM 0 HD12 LEU B 339 -4.570 -9.638 4.319 1.00 0.00 H new ATOM 0 HD13 LEU B 339 -3.009 -10.127 3.618 1.00 0.00 H new ATOM 0 HD21 LEU B 339 -1.567 -7.497 4.271 1.00 0.00 H new ATOM 0 HD22 LEU B 339 -1.447 -8.391 2.737 1.00 0.00 H new ATOM 0 HD23 LEU B 339 -1.930 -6.678 2.733 1.00 0.00 H new ATOM 1583 N ASN B 340 -5.893 -7.729 -0.537 1.00 0.00 N ATOM 1584 CA ASN B 340 -6.344 -8.016 -1.905 1.00 0.00 C ATOM 1585 C ASN B 340 -6.149 -6.816 -2.848 1.00 0.00 C ATOM 1586 O ASN B 340 -5.572 -6.966 -3.924 1.00 0.00 O ATOM 1587 CB ASN B 340 -7.825 -8.409 -1.926 1.00 0.00 C ATOM 1588 CG ASN B 340 -8.238 -9.634 -1.132 1.00 0.00 C ATOM 1589 OD1 ASN B 340 -9.349 -9.705 -0.626 1.00 0.00 O ATOM 1590 ND2 ASN B 340 -7.424 -10.659 -1.045 1.00 0.00 N ATOM 0 H ASN B 340 -6.589 -7.942 0.177 1.00 0.00 H new ATOM 0 HA ASN B 340 -5.730 -8.845 -2.257 1.00 0.00 H new ATOM 0 HB2 ASN B 340 -8.403 -7.561 -1.560 1.00 0.00 H new ATOM 0 HB3 ASN B 340 -8.116 -8.568 -2.964 1.00 0.00 H new ATOM 0 HD21 ASN B 340 -7.720 -11.505 -0.559 1.00 0.00 H new ATOM 0 HD22 ASN B 340 -6.495 -10.610 -1.464 1.00 0.00 H new ATOM 1597 N ASP B 341 -6.613 -5.628 -2.449 1.00 0.00 N ATOM 1598 CA ASP B 341 -6.582 -4.417 -3.279 1.00 0.00 C ATOM 1599 C ASP B 341 -5.157 -3.913 -3.590 1.00 0.00 C ATOM 1600 O ASP B 341 -4.935 -3.294 -4.632 1.00 0.00 O ATOM 1601 CB ASP B 341 -7.423 -3.332 -2.599 1.00 0.00 C ATOM 1602 CG ASP B 341 -7.737 -2.168 -3.555 1.00 0.00 C ATOM 1603 OD1 ASP B 341 -8.475 -2.384 -4.547 1.00 0.00 O ATOM 1604 OD2 ASP B 341 -7.281 -1.029 -3.298 1.00 0.00 O ATOM 0 H ASP B 341 -7.026 -5.477 -1.529 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.007 -4.670 -4.250 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -8.355 -3.767 -2.238 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -6.890 -2.952 -1.727 1.00 0.00 H new ATOM 1609 N MET B 342 -4.171 -4.232 -2.741 1.00 0.00 N ATOM 1610 CA MET B 342 -2.742 -4.008 -3.020 1.00 0.00 C ATOM 1611 C MET B 342 -2.188 -4.937 -4.110 1.00 0.00 C ATOM 1612 O MET B 342 -1.139 -4.634 -4.678 1.00 0.00 O ATOM 1613 CB MET B 342 -1.895 -4.294 -1.775 1.00 0.00 C ATOM 1614 CG MET B 342 -2.181 -3.416 -0.561 1.00 0.00 C ATOM 1615 SD MET B 342 -1.728 -4.300 0.946 1.00 0.00 S ATOM 1616 CE MET B 342 -1.900 -2.991 2.166 1.00 0.00 C ATOM 0 H MET B 342 -4.343 -4.658 -1.830 1.00 0.00 H new ATOM 0 HA MET B 342 -2.680 -2.968 -3.342 1.00 0.00 H new ATOM 0 HB2 MET B 342 -2.043 -5.335 -1.489 1.00 0.00 H new ATOM 0 HB3 MET B 342 -0.844 -4.183 -2.041 1.00 0.00 H new ATOM 0 HG2 MET B 342 -1.618 -2.485 -0.632 1.00 0.00 H new ATOM 0 HG3 MET B 342 -3.237 -3.148 -0.534 1.00 0.00 H new ATOM 0 HE1 MET B 342 -1.847 -3.418 3.168 1.00 0.00 H new ATOM 0 HE2 MET B 342 -1.097 -2.266 2.037 1.00 0.00 H new ATOM 0 HE3 MET B 342 -2.861 -2.495 2.034 1.00 0.00 H new ATOM 1626 N GLY B 343 -2.838 -6.077 -4.367 1.00 0.00 N ATOM 1627 CA GLY B 343 -2.351 -7.153 -5.237 1.00 0.00 C ATOM 1628 C GLY B 343 -2.284 -8.549 -4.592 1.00 0.00 C ATOM 1629 O GLY B 343 -1.789 -9.469 -5.248 1.00 0.00 O ATOM 0 H GLY B 343 -3.750 -6.283 -3.960 1.00 0.00 H new ATOM 0 HA2 GLY B 343 -2.997 -7.208 -6.114 1.00 0.00 H new ATOM 0 HA3 GLY B 343 -1.355 -6.887 -5.591 1.00 0.00 H new ATOM 1633 N PHE B 344 -2.720 -8.750 -3.336 1.00 0.00 N ATOM 1634 CA PHE B 344 -2.522 -10.024 -2.622 1.00 0.00 C ATOM 1635 C PHE B 344 -3.782 -10.898 -2.702 1.00 0.00 C ATOM 1636 O PHE B 344 -4.603 -10.927 -1.783 1.00 0.00 O ATOM 1637 CB PHE B 344 -2.068 -9.806 -1.172 1.00 0.00 C ATOM 1638 CG PHE B 344 -0.753 -9.074 -0.983 1.00 0.00 C ATOM 1639 CD1 PHE B 344 0.462 -9.702 -1.320 1.00 0.00 C ATOM 1640 CD2 PHE B 344 -0.733 -7.790 -0.407 1.00 0.00 C ATOM 1641 CE1 PHE B 344 1.684 -9.049 -1.073 1.00 0.00 C ATOM 1642 CE2 PHE B 344 0.483 -7.133 -0.168 1.00 0.00 C ATOM 1643 CZ PHE B 344 1.695 -7.769 -0.491 1.00 0.00 C ATOM 0 H PHE B 344 -3.214 -8.043 -2.792 1.00 0.00 H new ATOM 0 HA PHE B 344 -1.715 -10.560 -3.122 1.00 0.00 H new ATOM 0 HB2 PHE B 344 -2.847 -9.251 -0.649 1.00 0.00 H new ATOM 0 HB3 PHE B 344 -1.991 -10.779 -0.688 1.00 0.00 H new ATOM 0 HD1 PHE B 344 0.456 -10.685 -1.768 1.00 0.00 H new ATOM 0 HD2 PHE B 344 -1.663 -7.306 -0.147 1.00 0.00 H new ATOM 0 HE1 PHE B 344 2.615 -9.532 -1.331 1.00 0.00 H new ATOM 0 HE2 PHE B 344 0.489 -6.142 0.262 1.00 0.00 H new ATOM 0 HZ PHE B 344 2.634 -7.274 -0.292 1.00 0.00 H new ATOM 1653 N PHE B 345 -3.961 -11.601 -3.821 1.00 0.00 N ATOM 1654 CA PHE B 345 -5.147 -12.433 -4.079 1.00 0.00 C ATOM 1655 C PHE B 345 -5.063 -13.857 -3.485 1.00 0.00 C ATOM 1656 O PHE B 345 -6.051 -14.593 -3.495 1.00 0.00 O ATOM 1657 CB PHE B 345 -5.408 -12.460 -5.592 1.00 0.00 C ATOM 1658 CG PHE B 345 -5.613 -11.076 -6.186 1.00 0.00 C ATOM 1659 CD1 PHE B 345 -6.792 -10.358 -5.902 1.00 0.00 C ATOM 1660 CD2 PHE B 345 -4.614 -10.485 -6.984 1.00 0.00 C ATOM 1661 CE1 PHE B 345 -6.969 -9.058 -6.410 1.00 0.00 C ATOM 1662 CE2 PHE B 345 -4.792 -9.186 -7.494 1.00 0.00 C ATOM 1663 CZ PHE B 345 -5.968 -8.471 -7.206 1.00 0.00 C ATOM 0 H PHE B 345 -3.283 -11.612 -4.583 1.00 0.00 H new ATOM 0 HA PHE B 345 -5.990 -11.977 -3.560 1.00 0.00 H new ATOM 0 HB2 PHE B 345 -4.568 -12.942 -6.091 1.00 0.00 H new ATOM 0 HB3 PHE B 345 -6.290 -13.069 -5.792 1.00 0.00 H new ATOM 0 HD1 PHE B 345 -7.562 -10.807 -5.292 1.00 0.00 H new ATOM 0 HD2 PHE B 345 -3.709 -11.031 -7.205 1.00 0.00 H new ATOM 0 HE1 PHE B 345 -7.873 -8.510 -6.189 1.00 0.00 H new ATOM 0 HE2 PHE B 345 -4.025 -8.737 -8.107 1.00 0.00 H new ATOM 0 HZ PHE B 345 -6.103 -7.473 -7.595 1.00 0.00 H new ATOM 1673 N ASP B 346 -3.909 -14.255 -2.941 1.00 0.00 N ATOM 1674 CA ASP B 346 -3.687 -15.528 -2.241 1.00 0.00 C ATOM 1675 C ASP B 346 -4.329 -15.513 -0.834 1.00 0.00 C ATOM 1676 O ASP B 346 -3.655 -15.308 0.178 1.00 0.00 O ATOM 1677 CB ASP B 346 -2.181 -15.834 -2.153 1.00 0.00 C ATOM 1678 CG ASP B 346 -1.540 -16.274 -3.481 1.00 0.00 C ATOM 1679 OD1 ASP B 346 -1.511 -15.479 -4.451 1.00 0.00 O ATOM 1680 OD2 ASP B 346 -1.011 -17.412 -3.538 1.00 0.00 O ATOM 0 H ASP B 346 -3.069 -13.677 -2.977 1.00 0.00 H new ATOM 0 HA ASP B 346 -4.169 -16.320 -2.815 1.00 0.00 H new ATOM 0 HB2 ASP B 346 -1.663 -14.946 -1.791 1.00 0.00 H new ATOM 0 HB3 ASP B 346 -2.025 -16.618 -1.412 1.00 0.00 H new ATOM 1685 N PHE B 347 -5.641 -15.750 -0.752 1.00 0.00 N ATOM 1686 CA PHE B 347 -6.404 -15.745 0.506 1.00 0.00 C ATOM 1687 C PHE B 347 -5.830 -16.683 1.582 1.00 0.00 C ATOM 1688 O PHE B 347 -5.750 -16.295 2.745 1.00 0.00 O ATOM 1689 CB PHE B 347 -7.877 -16.077 0.234 1.00 0.00 C ATOM 1690 CG PHE B 347 -8.662 -14.923 -0.359 1.00 0.00 C ATOM 1691 CD1 PHE B 347 -9.213 -13.946 0.492 1.00 0.00 C ATOM 1692 CD2 PHE B 347 -8.845 -14.821 -1.751 1.00 0.00 C ATOM 1693 CE1 PHE B 347 -9.948 -12.876 -0.046 1.00 0.00 C ATOM 1694 CE2 PHE B 347 -9.576 -13.746 -2.290 1.00 0.00 C ATOM 1695 CZ PHE B 347 -10.131 -12.776 -1.436 1.00 0.00 C ATOM 0 H PHE B 347 -6.215 -15.954 -1.570 1.00 0.00 H new ATOM 0 HA PHE B 347 -6.321 -14.736 0.911 1.00 0.00 H new ATOM 0 HB2 PHE B 347 -7.929 -16.928 -0.446 1.00 0.00 H new ATOM 0 HB3 PHE B 347 -8.349 -16.385 1.167 1.00 0.00 H new ATOM 0 HD1 PHE B 347 -9.071 -14.019 1.560 1.00 0.00 H new ATOM 0 HD2 PHE B 347 -8.424 -15.569 -2.406 1.00 0.00 H new ATOM 0 HE1 PHE B 347 -10.373 -12.130 0.609 1.00 0.00 H new ATOM 0 HE2 PHE B 347 -9.711 -13.666 -3.359 1.00 0.00 H new ATOM 0 HZ PHE B 347 -10.698 -11.954 -1.848 1.00 0.00 H new ATOM 1705 N ASP B 348 -5.385 -17.888 1.211 1.00 0.00 N ATOM 1706 CA ASP B 348 -4.754 -18.843 2.136 1.00 0.00 C ATOM 1707 C ASP B 348 -3.479 -18.275 2.792 1.00 0.00 C ATOM 1708 O ASP B 348 -3.297 -18.388 4.008 1.00 0.00 O ATOM 1709 CB ASP B 348 -4.457 -20.147 1.384 1.00 0.00 C ATOM 1710 CG ASP B 348 -3.875 -21.226 2.314 1.00 0.00 C ATOM 1711 OD1 ASP B 348 -4.645 -21.824 3.103 1.00 0.00 O ATOM 1712 OD2 ASP B 348 -2.650 -21.489 2.246 1.00 0.00 O ATOM 0 H ASP B 348 -5.452 -18.233 0.254 1.00 0.00 H new ATOM 0 HA ASP B 348 -5.450 -19.040 2.952 1.00 0.00 H new ATOM 0 HB2 ASP B 348 -5.374 -20.519 0.926 1.00 0.00 H new ATOM 0 HB3 ASP B 348 -3.754 -19.948 0.575 1.00 0.00 H new ATOM 1717 N ARG B 349 -2.625 -17.605 2.005 1.00 0.00 N ATOM 1718 CA ARG B 349 -1.427 -16.903 2.496 1.00 0.00 C ATOM 1719 C ARG B 349 -1.801 -15.716 3.374 1.00 0.00 C ATOM 1720 O ARG B 349 -1.225 -15.561 4.445 1.00 0.00 O ATOM 1721 CB ARG B 349 -0.536 -16.418 1.343 1.00 0.00 C ATOM 1722 CG ARG B 349 0.018 -17.557 0.483 1.00 0.00 C ATOM 1723 CD ARG B 349 0.953 -16.974 -0.586 1.00 0.00 C ATOM 1724 NE ARG B 349 1.136 -17.901 -1.713 1.00 0.00 N ATOM 1725 CZ ARG B 349 2.127 -18.742 -1.935 1.00 0.00 C ATOM 1726 NH1 ARG B 349 3.130 -18.897 -1.118 1.00 0.00 N ATOM 1727 NH2 ARG B 349 2.119 -19.464 -3.020 1.00 0.00 N ATOM 0 H ARG B 349 -2.747 -17.534 0.995 1.00 0.00 H new ATOM 0 HA ARG B 349 -0.867 -17.626 3.089 1.00 0.00 H new ATOM 0 HB2 ARG B 349 -1.110 -15.741 0.710 1.00 0.00 H new ATOM 0 HB3 ARG B 349 0.295 -15.844 1.753 1.00 0.00 H new ATOM 0 HG2 ARG B 349 0.558 -18.270 1.106 1.00 0.00 H new ATOM 0 HG3 ARG B 349 -0.799 -18.102 0.010 1.00 0.00 H new ATOM 0 HD2 ARG B 349 0.544 -16.032 -0.952 1.00 0.00 H new ATOM 0 HD3 ARG B 349 1.921 -16.749 -0.139 1.00 0.00 H new ATOM 0 HE ARG B 349 0.398 -17.892 -2.417 1.00 0.00 H new ATOM 0 HH11 ARG B 349 3.175 -18.353 -0.257 1.00 0.00 H new ATOM 0 HH12 ARG B 349 3.870 -19.563 -1.340 1.00 0.00 H new ATOM 0 HH21 ARG B 349 1.352 -19.375 -3.686 1.00 0.00 H new ATOM 0 HH22 ARG B 349 2.880 -20.118 -3.203 1.00 0.00 H new ATOM 1741 N ASN B 350 -2.773 -14.904 2.955 1.00 0.00 N ATOM 1742 CA ASN B 350 -3.239 -13.742 3.716 1.00 0.00 C ATOM 1743 C ASN B 350 -3.765 -14.158 5.097 1.00 0.00 C ATOM 1744 O ASN B 350 -3.392 -13.563 6.104 1.00 0.00 O ATOM 1745 CB ASN B 350 -4.326 -12.983 2.939 1.00 0.00 C ATOM 1746 CG ASN B 350 -3.892 -12.389 1.613 1.00 0.00 C ATOM 1747 OD1 ASN B 350 -2.727 -12.327 1.254 1.00 0.00 O ATOM 1748 ND2 ASN B 350 -4.844 -11.891 0.860 1.00 0.00 N ATOM 0 H ASN B 350 -3.264 -15.035 2.070 1.00 0.00 H new ATOM 0 HA ASN B 350 -2.387 -13.078 3.862 1.00 0.00 H new ATOM 0 HB2 ASN B 350 -5.158 -13.663 2.757 1.00 0.00 H new ATOM 0 HB3 ASN B 350 -4.704 -12.179 3.570 1.00 0.00 H new ATOM 0 HD21 ASN B 350 -4.612 -11.450 -0.030 1.00 0.00 H new ATOM 0 HD22 ASN B 350 -5.816 -11.945 1.164 1.00 0.00 H new ATOM 1755 N VAL B 351 -4.584 -15.213 5.158 1.00 0.00 N ATOM 1756 CA VAL B 351 -5.055 -15.827 6.410 1.00 0.00 C ATOM 1757 C VAL B 351 -3.881 -16.299 7.266 1.00 0.00 C ATOM 1758 O VAL B 351 -3.797 -15.916 8.433 1.00 0.00 O ATOM 1759 CB VAL B 351 -6.055 -16.965 6.116 1.00 0.00 C ATOM 1760 CG1 VAL B 351 -6.303 -17.877 7.325 1.00 0.00 C ATOM 1761 CG2 VAL B 351 -7.406 -16.370 5.703 1.00 0.00 C ATOM 0 H VAL B 351 -4.947 -15.675 4.324 1.00 0.00 H new ATOM 0 HA VAL B 351 -5.585 -15.070 6.988 1.00 0.00 H new ATOM 0 HB VAL B 351 -5.611 -17.562 5.319 1.00 0.00 H new ATOM 0 HG11 VAL B 351 -7.015 -18.656 7.053 1.00 0.00 H new ATOM 0 HG12 VAL B 351 -5.364 -18.335 7.634 1.00 0.00 H new ATOM 0 HG13 VAL B 351 -6.707 -17.288 8.148 1.00 0.00 H new ATOM 0 HG21 VAL B 351 -8.110 -17.176 5.496 1.00 0.00 H new ATOM 0 HG22 VAL B 351 -7.792 -15.749 6.511 1.00 0.00 H new ATOM 0 HG23 VAL B 351 -7.277 -15.762 4.808 1.00 0.00 H new ATOM 1771 N ALA B 352 -2.954 -17.093 6.716 1.00 0.00 N ATOM 1772 CA ALA B 352 -1.816 -17.609 7.477 1.00 0.00 C ATOM 1773 C ALA B 352 -0.903 -16.485 8.011 1.00 0.00 C ATOM 1774 O ALA B 352 -0.374 -16.586 9.122 1.00 0.00 O ATOM 1775 CB ALA B 352 -1.061 -18.596 6.580 1.00 0.00 C ATOM 0 H ALA B 352 -2.973 -17.392 5.741 1.00 0.00 H new ATOM 0 HA ALA B 352 -2.176 -18.122 8.369 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -0.205 -18.998 7.122 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -1.726 -19.411 6.296 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -0.714 -18.081 5.684 1.00 0.00 H new ATOM 1781 N ALA B 353 -0.754 -15.403 7.243 1.00 0.00 N ATOM 1782 CA ALA B 353 -0.003 -14.197 7.576 1.00 0.00 C ATOM 1783 C ALA B 353 -0.684 -13.371 8.681 1.00 0.00 C ATOM 1784 O ALA B 353 -0.030 -12.971 9.641 1.00 0.00 O ATOM 1785 CB ALA B 353 0.175 -13.379 6.292 1.00 0.00 C ATOM 0 H ALA B 353 -1.181 -15.345 6.318 1.00 0.00 H new ATOM 0 HA ALA B 353 0.970 -14.479 7.978 1.00 0.00 H new ATOM 0 HB1 ALA B 353 0.735 -12.470 6.514 1.00 0.00 H new ATOM 0 HB2 ALA B 353 0.720 -13.970 5.557 1.00 0.00 H new ATOM 0 HB3 ALA B 353 -0.803 -13.114 5.891 1.00 0.00 H new ATOM 1791 N LEU B 354 -1.998 -13.136 8.587 1.00 0.00 N ATOM 1792 CA LEU B 354 -2.779 -12.432 9.610 1.00 0.00 C ATOM 1793 C LEU B 354 -2.797 -13.204 10.935 1.00 0.00 C ATOM 1794 O LEU B 354 -2.633 -12.593 11.992 1.00 0.00 O ATOM 1795 CB LEU B 354 -4.202 -12.154 9.087 1.00 0.00 C ATOM 1796 CG LEU B 354 -4.250 -11.050 8.010 1.00 0.00 C ATOM 1797 CD1 LEU B 354 -5.595 -11.078 7.288 1.00 0.00 C ATOM 1798 CD2 LEU B 354 -4.073 -9.652 8.609 1.00 0.00 C ATOM 0 H LEU B 354 -2.556 -13.434 7.787 1.00 0.00 H new ATOM 0 HA LEU B 354 -2.299 -11.475 9.816 1.00 0.00 H new ATOM 0 HB2 LEU B 354 -4.616 -13.074 8.674 1.00 0.00 H new ATOM 0 HB3 LEU B 354 -4.839 -11.865 9.923 1.00 0.00 H new ATOM 0 HG LEU B 354 -3.429 -11.250 7.321 1.00 0.00 H new ATOM 0 HD11 LEU B 354 -5.618 -10.295 6.530 1.00 0.00 H new ATOM 0 HD12 LEU B 354 -5.732 -12.048 6.811 1.00 0.00 H new ATOM 0 HD13 LEU B 354 -6.397 -10.911 8.007 1.00 0.00 H new ATOM 0 HD21 LEU B 354 -4.114 -8.908 7.814 1.00 0.00 H new ATOM 0 HD22 LEU B 354 -4.870 -9.460 9.327 1.00 0.00 H new ATOM 0 HD23 LEU B 354 -3.109 -9.592 9.113 1.00 0.00 H new ATOM 1810 N ARG B 355 -2.910 -14.538 10.894 1.00 0.00 N ATOM 1811 CA ARG B 355 -2.847 -15.413 12.080 1.00 0.00 C ATOM 1812 C ARG B 355 -1.535 -15.268 12.863 1.00 0.00 C ATOM 1813 O ARG B 355 -1.583 -15.042 14.073 1.00 0.00 O ATOM 1814 CB ARG B 355 -3.117 -16.875 11.684 1.00 0.00 C ATOM 1815 CG ARG B 355 -4.610 -17.116 11.393 1.00 0.00 C ATOM 1816 CD ARG B 355 -4.880 -18.529 10.858 1.00 0.00 C ATOM 1817 NE ARG B 355 -4.668 -19.566 11.889 1.00 0.00 N ATOM 1818 CZ ARG B 355 -4.937 -20.857 11.790 1.00 0.00 C ATOM 1819 NH1 ARG B 355 -5.430 -21.382 10.704 1.00 0.00 N ATOM 1820 NH2 ARG B 355 -4.713 -21.656 12.795 1.00 0.00 N ATOM 0 H ARG B 355 -3.050 -15.051 10.024 1.00 0.00 H new ATOM 0 HA ARG B 355 -3.634 -15.088 12.761 1.00 0.00 H new ATOM 0 HB2 ARG B 355 -2.528 -17.129 10.803 1.00 0.00 H new ATOM 0 HB3 ARG B 355 -2.791 -17.536 12.487 1.00 0.00 H new ATOM 0 HG2 ARG B 355 -5.185 -16.960 12.306 1.00 0.00 H new ATOM 0 HG3 ARG B 355 -4.959 -16.382 10.666 1.00 0.00 H new ATOM 0 HD2 ARG B 355 -5.905 -18.587 10.492 1.00 0.00 H new ATOM 0 HD3 ARG B 355 -4.226 -18.725 10.008 1.00 0.00 H new ATOM 0 HE ARG B 355 -4.271 -19.252 12.774 1.00 0.00 H new ATOM 0 HH11 ARG B 355 -5.621 -20.793 9.894 1.00 0.00 H new ATOM 0 HH12 ARG B 355 -5.625 -22.382 10.664 1.00 0.00 H new ATOM 0 HH21 ARG B 355 -4.328 -21.287 13.664 1.00 0.00 H new ATOM 0 HH22 ARG B 355 -4.923 -22.651 12.712 1.00 0.00 H new ATOM 1834 N ARG B 356 -0.372 -15.361 12.200 1.00 0.00 N ATOM 1835 CA ARG B 356 0.954 -15.185 12.842 1.00 0.00 C ATOM 1836 C ARG B 356 1.262 -13.735 13.230 1.00 0.00 C ATOM 1837 O ARG B 356 1.895 -13.492 14.257 1.00 0.00 O ATOM 1838 CB ARG B 356 2.064 -15.808 11.983 1.00 0.00 C ATOM 1839 CG ARG B 356 2.312 -15.135 10.623 1.00 0.00 C ATOM 1840 CD ARG B 356 3.169 -16.009 9.703 1.00 0.00 C ATOM 1841 NE ARG B 356 2.448 -17.232 9.299 1.00 0.00 N ATOM 1842 CZ ARG B 356 2.954 -18.319 8.751 1.00 0.00 C ATOM 1843 NH1 ARG B 356 4.197 -18.397 8.382 1.00 0.00 N ATOM 1844 NH2 ARG B 356 2.207 -19.369 8.561 1.00 0.00 N ATOM 0 H ARG B 356 -0.317 -15.561 11.201 1.00 0.00 H new ATOM 0 HA ARG B 356 0.915 -15.725 13.788 1.00 0.00 H new ATOM 0 HB2 ARG B 356 2.993 -15.788 12.552 1.00 0.00 H new ATOM 0 HB3 ARG B 356 1.819 -16.856 11.810 1.00 0.00 H new ATOM 0 HG2 ARG B 356 1.357 -14.927 10.141 1.00 0.00 H new ATOM 0 HG3 ARG B 356 2.806 -14.176 10.777 1.00 0.00 H new ATOM 0 HD2 ARG B 356 3.450 -15.441 8.816 1.00 0.00 H new ATOM 0 HD3 ARG B 356 4.093 -16.281 10.213 1.00 0.00 H new ATOM 0 HE ARG B 356 1.441 -17.237 9.463 1.00 0.00 H new ATOM 0 HH11 ARG B 356 4.819 -17.599 8.513 1.00 0.00 H new ATOM 0 HH12 ARG B 356 4.551 -19.256 7.961 1.00 0.00 H new ATOM 0 HH21 ARG B 356 1.225 -19.353 8.837 1.00 0.00 H new ATOM 0 HH22 ARG B 356 2.604 -20.207 8.137 1.00 0.00 H new ATOM 1858 N SER B 357 0.769 -12.780 12.441 1.00 0.00 N ATOM 1859 CA SER B 357 0.808 -11.337 12.724 1.00 0.00 C ATOM 1860 C SER B 357 0.047 -10.953 14.008 1.00 0.00 C ATOM 1861 O SER B 357 0.516 -10.120 14.788 1.00 0.00 O ATOM 1862 CB SER B 357 0.228 -10.572 11.528 1.00 0.00 C ATOM 1863 OG SER B 357 0.201 -9.180 11.771 1.00 0.00 O ATOM 0 H SER B 357 0.314 -12.993 11.553 1.00 0.00 H new ATOM 0 HA SER B 357 1.851 -11.066 12.886 1.00 0.00 H new ATOM 0 HB2 SER B 357 0.825 -10.776 10.639 1.00 0.00 H new ATOM 0 HB3 SER B 357 -0.782 -10.927 11.322 1.00 0.00 H new ATOM 0 HG SER B 357 -0.338 -8.738 11.082 1.00 0.00 H new ATOM 1869 N GLY B 358 -1.120 -11.568 14.241 1.00 0.00 N ATOM 1870 CA GLY B 358 -2.059 -11.232 15.321 1.00 0.00 C ATOM 1871 C GLY B 358 -3.266 -10.394 14.864 1.00 0.00 C ATOM 1872 O GLY B 358 -3.929 -9.767 15.693 1.00 0.00 O ATOM 0 H GLY B 358 -1.449 -12.341 13.662 1.00 0.00 H new ATOM 0 HA2 GLY B 358 -2.421 -12.155 15.774 1.00 0.00 H new ATOM 0 HA3 GLY B 358 -1.523 -10.685 16.097 1.00 0.00 H new ATOM 1876 N GLY B 359 -3.540 -10.355 13.554 1.00 0.00 N ATOM 1877 CA GLY B 359 -4.656 -9.639 12.920 1.00 0.00 C ATOM 1878 C GLY B 359 -4.287 -8.283 12.301 1.00 0.00 C ATOM 1879 O GLY B 359 -5.160 -7.620 11.739 1.00 0.00 O ATOM 0 H GLY B 359 -2.961 -10.846 12.873 1.00 0.00 H new ATOM 0 HA2 GLY B 359 -5.080 -10.274 12.142 1.00 0.00 H new ATOM 0 HA3 GLY B 359 -5.437 -9.482 13.664 1.00 0.00 H new ATOM 1883 N SER B 360 -3.023 -7.859 12.392 1.00 0.00 N ATOM 1884 CA SER B 360 -2.513 -6.583 11.861 1.00 0.00 C ATOM 1885 C SER B 360 -2.102 -6.690 10.385 1.00 0.00 C ATOM 1886 O SER B 360 -1.301 -7.554 10.015 1.00 0.00 O ATOM 1887 CB SER B 360 -1.312 -6.117 12.694 1.00 0.00 C ATOM 1888 OG SER B 360 -1.718 -5.828 14.024 1.00 0.00 O ATOM 0 H SER B 360 -2.299 -8.411 12.852 1.00 0.00 H new ATOM 0 HA SER B 360 -3.323 -5.856 11.927 1.00 0.00 H new ATOM 0 HB2 SER B 360 -0.543 -6.890 12.701 1.00 0.00 H new ATOM 0 HB3 SER B 360 -0.868 -5.230 12.241 1.00 0.00 H new ATOM 0 HG SER B 360 -0.943 -5.533 14.546 1.00 0.00 H new ATOM 1894 N VAL B 361 -2.613 -5.782 9.542 1.00 0.00 N ATOM 1895 CA VAL B 361 -2.371 -5.732 8.082 1.00 0.00 C ATOM 1896 C VAL B 361 -0.876 -5.691 7.751 1.00 0.00 C ATOM 1897 O VAL B 361 -0.385 -6.565 7.048 1.00 0.00 O ATOM 1898 CB VAL B 361 -3.070 -4.526 7.419 1.00 0.00 C ATOM 1899 CG1 VAL B 361 -2.921 -4.539 5.889 1.00 0.00 C ATOM 1900 CG2 VAL B 361 -4.566 -4.451 7.725 1.00 0.00 C ATOM 0 H VAL B 361 -3.228 -5.034 9.863 1.00 0.00 H new ATOM 0 HA VAL B 361 -2.798 -6.650 7.678 1.00 0.00 H new ATOM 0 HB VAL B 361 -2.568 -3.658 7.847 1.00 0.00 H new ATOM 0 HG11 VAL B 361 -3.429 -3.672 5.467 1.00 0.00 H new ATOM 0 HG12 VAL B 361 -1.864 -4.504 5.626 1.00 0.00 H new ATOM 0 HG13 VAL B 361 -3.365 -5.450 5.488 1.00 0.00 H new ATOM 0 HG21 VAL B 361 -4.996 -3.581 7.229 1.00 0.00 H new ATOM 0 HG22 VAL B 361 -5.057 -5.354 7.363 1.00 0.00 H new ATOM 0 HG23 VAL B 361 -4.713 -4.364 8.802 1.00 0.00 H new ATOM 1910 N GLN B 362 -0.144 -4.688 8.245 1.00 0.00 N ATOM 1911 CA GLN B 362 1.282 -4.476 7.935 1.00 0.00 C ATOM 1912 C GLN B 362 2.196 -5.627 8.390 1.00 0.00 C ATOM 1913 O GLN B 362 3.186 -5.923 7.722 1.00 0.00 O ATOM 1914 CB GLN B 362 1.747 -3.135 8.532 1.00 0.00 C ATOM 1915 CG GLN B 362 1.913 -2.067 7.445 1.00 0.00 C ATOM 1916 CD GLN B 362 3.181 -2.247 6.604 1.00 0.00 C ATOM 1917 OE1 GLN B 362 3.074 -2.619 5.341 1.00 0.00 O flip ATOM 1918 NE2 GLN B 362 4.287 -2.007 7.070 1.00 0.00 N flip ATOM 0 H GLN B 362 -0.526 -3.988 8.881 1.00 0.00 H new ATOM 0 HA GLN B 362 1.368 -4.451 6.849 1.00 0.00 H new ATOM 0 HB2 GLN B 362 1.023 -2.794 9.272 1.00 0.00 H new ATOM 0 HB3 GLN B 362 2.694 -3.276 9.054 1.00 0.00 H new ATOM 0 HG2 GLN B 362 1.044 -2.090 6.788 1.00 0.00 H new ATOM 0 HG3 GLN B 362 1.933 -1.083 7.913 1.00 0.00 H new ATOM 0 HE21 GLN B 362 4.378 -1.719 8.044 1.00 0.00 H new ATOM 0 HE22 GLN B 362 5.117 -2.095 6.484 1.00 0.00 H new ATOM 1927 N GLY B 363 1.849 -6.316 9.480 1.00 0.00 N ATOM 1928 CA GLY B 363 2.552 -7.524 9.936 1.00 0.00 C ATOM 1929 C GLY B 363 2.330 -8.726 9.008 1.00 0.00 C ATOM 1930 O GLY B 363 3.266 -9.477 8.719 1.00 0.00 O ATOM 0 H GLY B 363 1.066 -6.051 10.078 1.00 0.00 H new ATOM 0 HA2 GLY B 363 3.620 -7.314 10.003 1.00 0.00 H new ATOM 0 HA3 GLY B 363 2.214 -7.779 10.940 1.00 0.00 H new ATOM 1934 N ALA B 364 1.112 -8.881 8.477 1.00 0.00 N ATOM 1935 CA ALA B 364 0.822 -9.847 7.419 1.00 0.00 C ATOM 1936 C ALA B 364 1.523 -9.478 6.096 1.00 0.00 C ATOM 1937 O ALA B 364 2.087 -10.344 5.427 1.00 0.00 O ATOM 1938 CB ALA B 364 -0.697 -9.958 7.251 1.00 0.00 C ATOM 0 H ALA B 364 0.300 -8.338 8.771 1.00 0.00 H new ATOM 0 HA ALA B 364 1.220 -10.820 7.706 1.00 0.00 H new ATOM 0 HB1 ALA B 364 -0.924 -10.677 6.464 1.00 0.00 H new ATOM 0 HB2 ALA B 364 -1.143 -10.293 8.188 1.00 0.00 H new ATOM 0 HB3 ALA B 364 -1.105 -8.984 6.982 1.00 0.00 H new ATOM 1944 N LEU B 365 1.545 -8.189 5.743 1.00 0.00 N ATOM 1945 CA LEU B 365 2.247 -7.628 4.589 1.00 0.00 C ATOM 1946 C LEU B 365 3.752 -7.935 4.627 1.00 0.00 C ATOM 1947 O LEU B 365 4.308 -8.408 3.640 1.00 0.00 O ATOM 1948 CB LEU B 365 1.962 -6.113 4.532 1.00 0.00 C ATOM 1949 CG LEU B 365 1.562 -5.621 3.138 1.00 0.00 C ATOM 1950 CD1 LEU B 365 1.125 -4.163 3.202 1.00 0.00 C ATOM 1951 CD2 LEU B 365 2.714 -5.690 2.147 1.00 0.00 C ATOM 0 H LEU B 365 1.050 -7.477 6.280 1.00 0.00 H new ATOM 0 HA LEU B 365 1.877 -8.096 3.677 1.00 0.00 H new ATOM 0 HB2 LEU B 365 1.165 -5.874 5.236 1.00 0.00 H new ATOM 0 HB3 LEU B 365 2.849 -5.571 4.859 1.00 0.00 H new ATOM 0 HG LEU B 365 0.754 -6.273 2.806 1.00 0.00 H new ATOM 0 HD11 LEU B 365 0.843 -3.824 2.205 1.00 0.00 H new ATOM 0 HD12 LEU B 365 0.271 -4.068 3.873 1.00 0.00 H new ATOM 0 HD13 LEU B 365 1.948 -3.552 3.574 1.00 0.00 H new ATOM 0 HD21 LEU B 365 2.379 -5.330 1.174 1.00 0.00 H new ATOM 0 HD22 LEU B 365 3.536 -5.068 2.501 1.00 0.00 H new ATOM 0 HD23 LEU B 365 3.054 -6.722 2.055 1.00 0.00 H new ATOM 1963 N ASP B 366 4.409 -7.737 5.773 1.00 0.00 N ATOM 1964 CA ASP B 366 5.808 -8.122 5.994 1.00 0.00 C ATOM 1965 C ASP B 366 6.052 -9.628 5.767 1.00 0.00 C ATOM 1966 O ASP B 366 7.022 -9.999 5.104 1.00 0.00 O ATOM 1967 CB ASP B 366 6.236 -7.693 7.404 1.00 0.00 C ATOM 1968 CG ASP B 366 7.724 -7.984 7.662 1.00 0.00 C ATOM 1969 OD1 ASP B 366 8.586 -7.237 7.140 1.00 0.00 O ATOM 1970 OD2 ASP B 366 8.036 -8.947 8.402 1.00 0.00 O ATOM 0 H ASP B 366 3.978 -7.298 6.587 1.00 0.00 H new ATOM 0 HA ASP B 366 6.421 -7.605 5.256 1.00 0.00 H new ATOM 0 HB2 ASP B 366 6.046 -6.627 7.533 1.00 0.00 H new ATOM 0 HB3 ASP B 366 5.630 -8.217 8.143 1.00 0.00 H new ATOM 1975 N SER B 367 5.153 -10.497 6.246 1.00 0.00 N ATOM 1976 CA SER B 367 5.202 -11.953 6.001 1.00 0.00 C ATOM 1977 C SER B 367 5.073 -12.296 4.511 1.00 0.00 C ATOM 1978 O SER B 367 5.850 -13.099 3.992 1.00 0.00 O ATOM 1979 CB SER B 367 4.112 -12.686 6.799 1.00 0.00 C ATOM 1980 OG SER B 367 4.271 -12.504 8.197 1.00 0.00 O ATOM 0 H SER B 367 4.361 -10.211 6.821 1.00 0.00 H new ATOM 0 HA SER B 367 6.181 -12.291 6.340 1.00 0.00 H new ATOM 0 HB2 SER B 367 3.131 -12.321 6.494 1.00 0.00 H new ATOM 0 HB3 SER B 367 4.144 -13.750 6.565 1.00 0.00 H new ATOM 0 HG SER B 367 3.987 -11.599 8.443 1.00 0.00 H new ATOM 1986 N LEU B 368 4.125 -11.668 3.806 1.00 0.00 N ATOM 1987 CA LEU B 368 3.911 -11.812 2.360 1.00 0.00 C ATOM 1988 C LEU B 368 5.128 -11.336 1.540 1.00 0.00 C ATOM 1989 O LEU B 368 5.570 -12.048 0.637 1.00 0.00 O ATOM 1990 CB LEU B 368 2.631 -11.049 1.962 1.00 0.00 C ATOM 1991 CG LEU B 368 1.331 -11.728 2.441 1.00 0.00 C ATOM 1992 CD1 LEU B 368 0.184 -10.721 2.503 1.00 0.00 C ATOM 1993 CD2 LEU B 368 0.913 -12.859 1.497 1.00 0.00 C ATOM 0 H LEU B 368 3.463 -11.024 4.240 1.00 0.00 H new ATOM 0 HA LEU B 368 3.788 -12.871 2.131 1.00 0.00 H new ATOM 0 HB2 LEU B 368 2.677 -10.041 2.373 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.600 -10.950 0.877 1.00 0.00 H new ATOM 0 HG LEU B 368 1.534 -12.132 3.433 1.00 0.00 H new ATOM 0 HD11 LEU B 368 -0.722 -11.222 2.843 1.00 0.00 H new ATOM 0 HD12 LEU B 368 0.439 -9.921 3.198 1.00 0.00 H new ATOM 0 HD13 LEU B 368 0.015 -10.300 1.512 1.00 0.00 H new ATOM 0 HD21 LEU B 368 -0.006 -13.317 1.862 1.00 0.00 H new ATOM 0 HD22 LEU B 368 0.745 -12.456 0.498 1.00 0.00 H new ATOM 0 HD23 LEU B 368 1.702 -13.610 1.458 1.00 0.00 H new ATOM 2005 N LEU B 369 5.701 -10.172 1.870 1.00 0.00 N ATOM 2006 CA LEU B 369 6.917 -9.622 1.248 1.00 0.00 C ATOM 2007 C LEU B 369 8.147 -10.519 1.471 1.00 0.00 C ATOM 2008 O LEU B 369 8.907 -10.771 0.533 1.00 0.00 O ATOM 2009 CB LEU B 369 7.189 -8.205 1.793 1.00 0.00 C ATOM 2010 CG LEU B 369 6.235 -7.113 1.274 1.00 0.00 C ATOM 2011 CD1 LEU B 369 6.443 -5.828 2.081 1.00 0.00 C ATOM 2012 CD2 LEU B 369 6.478 -6.772 -0.198 1.00 0.00 C ATOM 0 H LEU B 369 5.322 -9.567 2.599 1.00 0.00 H new ATOM 0 HA LEU B 369 6.742 -9.578 0.173 1.00 0.00 H new ATOM 0 HB2 LEU B 369 7.128 -8.233 2.881 1.00 0.00 H new ATOM 0 HB3 LEU B 369 8.211 -7.924 1.538 1.00 0.00 H new ATOM 0 HG LEU B 369 5.223 -7.504 1.382 1.00 0.00 H new ATOM 0 HD11 LEU B 369 5.768 -5.055 1.714 1.00 0.00 H new ATOM 0 HD12 LEU B 369 6.235 -6.022 3.133 1.00 0.00 H new ATOM 0 HD13 LEU B 369 7.474 -5.492 1.971 1.00 0.00 H new ATOM 0 HD21 LEU B 369 5.779 -5.997 -0.512 1.00 0.00 H new ATOM 0 HD22 LEU B 369 7.499 -6.412 -0.324 1.00 0.00 H new ATOM 0 HD23 LEU B 369 6.329 -7.663 -0.807 1.00 0.00 H new ATOM 2024 N ASN B 370 8.343 -11.016 2.697 1.00 0.00 N ATOM 2025 CA ASN B 370 9.434 -11.931 3.056 1.00 0.00 C ATOM 2026 C ASN B 370 9.275 -13.349 2.456 1.00 0.00 C ATOM 2027 O ASN B 370 10.246 -14.105 2.393 1.00 0.00 O ATOM 2028 CB ASN B 370 9.529 -11.977 4.592 1.00 0.00 C ATOM 2029 CG ASN B 370 10.769 -12.712 5.080 1.00 0.00 C ATOM 2030 OD1 ASN B 370 11.898 -12.319 4.815 1.00 0.00 O ATOM 2031 ND2 ASN B 370 10.614 -13.785 5.824 1.00 0.00 N ATOM 0 H ASN B 370 7.735 -10.789 3.484 1.00 0.00 H new ATOM 0 HA ASN B 370 10.360 -11.550 2.624 1.00 0.00 H new ATOM 0 HB2 ASN B 370 9.537 -10.959 4.982 1.00 0.00 H new ATOM 0 HB3 ASN B 370 8.641 -12.465 4.993 1.00 0.00 H new ATOM 0 HD21 ASN B 370 11.431 -14.284 6.176 1.00 0.00 H new ATOM 0 HD22 ASN B 370 9.677 -14.119 6.049 1.00 0.00 H new ATOM 2038 N GLY B 371 8.067 -13.718 2.011 1.00 0.00 N ATOM 2039 CA GLY B 371 7.743 -15.053 1.495 1.00 0.00 C ATOM 2040 C GLY B 371 7.571 -16.112 2.594 1.00 0.00 C ATOM 2041 O GLY B 371 7.776 -17.303 2.353 1.00 0.00 O ATOM 0 H GLY B 371 7.270 -13.082 2.000 1.00 0.00 H new ATOM 0 HA2 GLY B 371 6.824 -14.995 0.911 1.00 0.00 H new ATOM 0 HA3 GLY B 371 8.533 -15.372 0.815 1.00 0.00 H new ATOM 2045 N ASP B 372 7.229 -15.681 3.811 1.00 0.00 N ATOM 2046 CA ASP B 372 7.050 -16.524 5.004 1.00 0.00 C ATOM 2047 C ASP B 372 5.811 -17.448 4.932 1.00 0.00 C ATOM 2048 O ASP B 372 5.734 -18.445 5.659 1.00 0.00 O ATOM 2049 CB ASP B 372 6.967 -15.595 6.224 1.00 0.00 C ATOM 2050 CG ASP B 372 7.082 -16.357 7.552 1.00 0.00 C ATOM 2051 OD1 ASP B 372 8.177 -16.895 7.847 1.00 0.00 O ATOM 2052 OD2 ASP B 372 6.089 -16.393 8.317 1.00 0.00 O ATOM 0 H ASP B 372 7.061 -14.694 4.004 1.00 0.00 H new ATOM 0 HA ASP B 372 7.903 -17.199 5.077 1.00 0.00 H new ATOM 0 HB2 ASP B 372 7.762 -14.852 6.165 1.00 0.00 H new ATOM 0 HB3 ASP B 372 6.022 -15.053 6.200 1.00 0.00 H new ATOM 2057 N VAL B 373 4.868 -17.142 4.030 1.00 0.00 N ATOM 2058 CA VAL B 373 3.608 -17.863 3.748 1.00 0.00 C ATOM 2059 C VAL B 373 3.547 -18.438 2.330 1.00 0.00 C ATOM 2060 O VAL B 373 3.278 -19.653 2.207 1.00 0.00 O ATOM 2061 CB VAL B 373 2.374 -16.989 4.034 1.00 0.00 C ATOM 2062 CG1 VAL B 373 2.071 -16.975 5.534 1.00 0.00 C ATOM 2063 CG2 VAL B 373 2.505 -15.537 3.551 1.00 0.00 C ATOM 2064 OXT VAL B 373 3.758 -17.696 1.345 1.00 0.00 O ATOM 0 H VAL B 373 4.969 -16.323 3.431 1.00 0.00 H new ATOM 0 HA VAL B 373 3.595 -18.711 4.433 1.00 0.00 H new ATOM 0 HB VAL B 373 1.561 -17.445 3.468 1.00 0.00 H new ATOM 0 HG11 VAL B 373 1.196 -16.353 5.723 1.00 0.00 H new ATOM 0 HG12 VAL B 373 1.874 -17.991 5.875 1.00 0.00 H new ATOM 0 HG13 VAL B 373 2.927 -16.570 6.074 1.00 0.00 H new ATOM 0 HG21 VAL B 373 1.593 -14.990 3.791 1.00 0.00 H new ATOM 0 HG22 VAL B 373 3.353 -15.064 4.046 1.00 0.00 H new ATOM 0 HG23 VAL B 373 2.662 -15.525 2.472 1.00 0.00 H new