USER MOD reduce.3.24.130724 H: found=0, std=0, add=939, rem=0, adj=26 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: B 342 MET CE :methyl -174:sc= -0.447 (180deg=-0.0835) USER MOD Set 1.2: B 362 GLN : amide:sc= -2.22 X(o=-2.7,f=-2.7) USER MOD Set 2.1: A 55 THR OG1 : rot 133:sc= 0.722 USER MOD Set 2.2: A 57 SER OG : rot -83:sc= 1.39 USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= 0.22 USER MOD Set 3.2: A 25 ASN : amide:sc= 0.162 X(o=0.38,f=0.065) USER MOD Set 4.1: A 6 LYS NZ :NH3+ 176:sc= 1.03 (180deg=-0.114) USER MOD Set 4.2: B 338 GLN : amide:sc= 1.42 K(o=2.5,f=-3.3) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 164:sc= 0.885 (180deg=0.726) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot -65:sc= 0.89 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 170:sc= 0.948 (180deg=0.865) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.0199 USER MOD Single : A 14 THR OG1 : rot -85:sc= 1.19 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+ -165:sc= 1.86 (180deg=1.51) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 160:sc= 0.917 (180deg=0.633) USER MOD Single : A 31 GLN : amide:sc= -0.0139 X(o=-0.014,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -2.41! C(o=-2.4!,f=-8.8!) USER MOD Single : A 41 GLN : amide:sc= -0.26 K(o=-0.26,f=-3.2!) USER MOD Single : A 48 LYS NZ :NH3+ -161:sc= 0.901 (180deg=0.703) USER MOD Single : A 49 GLN : amide:sc= 0.611 K(o=0.61,f=-2.5!) USER MOD Single : A 59 TYR OH : rot 80:sc= 0.0612 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.865 K(o=0.87,f=-0.026) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 92:sc= 1.27 USER MOD Single : A 66 THR OG1 : rot 48:sc= 0.063 USER MOD Single : A 68 HIS : no HE2:sc= -0.259 K(o=-0.26,f=-1.1) USER MOD Single : B 332 TYR OH : rot 3:sc= 0.108 USER MOD Single : B 334 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 335 GLN : amide:sc= 1.33 K(o=1.3,f=-4.6!) USER MOD Single : B 340 ASN : amide:sc= 1.58 K(o=1.6,f=-4.1!) USER MOD Single : B 350 ASN : amide:sc= 0.926 K(o=0.93,f=-2.2!) USER MOD Single : B 357 SER OG : rot 87:sc= 0.933 USER MOD Single : B 360 SER OG : rot 180:sc= 0.187 USER MOD Single : B 367 SER OG : rot 160:sc= 0.89 USER MOD Single : B 370 ASN :FLIP amide:sc= 0 F(o=-0.88,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.502 14.090 -14.555 1.00 0.00 N ATOM 2 CA MET A 1 -2.282 12.863 -14.244 1.00 0.00 C ATOM 3 C MET A 1 -2.751 12.916 -12.781 1.00 0.00 C ATOM 4 O MET A 1 -2.477 13.895 -12.084 1.00 0.00 O ATOM 5 CB MET A 1 -1.495 11.593 -14.679 1.00 0.00 C ATOM 6 CG MET A 1 -0.915 10.627 -13.626 1.00 0.00 C ATOM 7 SD MET A 1 0.186 9.374 -14.354 1.00 0.00 S ATOM 8 CE MET A 1 0.688 8.446 -12.877 1.00 0.00 C ATOM 0 H1 MET A 1 -0.962 13.945 -15.432 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.152 14.893 -14.678 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.846 14.292 -13.773 1.00 0.00 H new ATOM 0 HA MET A 1 -3.200 12.808 -14.830 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.156 11.010 -15.320 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.664 11.928 -15.300 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.364 11.198 -12.879 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.733 10.128 -13.107 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.366 7.643 -13.165 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.193 9.115 -12.181 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.194 8.022 -12.397 1.00 0.00 H new ATOM 20 N GLN A 2 -3.484 11.915 -12.285 1.00 0.00 N ATOM 21 CA GLN A 2 -3.778 11.782 -10.846 1.00 0.00 C ATOM 22 C GLN A 2 -3.513 10.358 -10.369 1.00 0.00 C ATOM 23 O GLN A 2 -3.477 9.438 -11.181 1.00 0.00 O ATOM 24 CB GLN A 2 -5.217 12.236 -10.525 1.00 0.00 C ATOM 25 CG GLN A 2 -6.284 11.222 -10.964 1.00 0.00 C ATOM 26 CD GLN A 2 -7.685 11.826 -10.942 1.00 0.00 C ATOM 27 OE1 GLN A 2 -8.208 12.294 -11.946 1.00 0.00 O ATOM 28 NE2 GLN A 2 -8.351 11.845 -9.807 1.00 0.00 N ATOM 0 H GLN A 2 -3.890 11.177 -12.860 1.00 0.00 H new ATOM 0 HA GLN A 2 -3.105 12.442 -10.299 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -5.306 12.406 -9.452 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -5.408 13.190 -11.016 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -6.057 10.868 -11.970 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -6.252 10.354 -10.306 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -7.930 11.459 -8.962 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -9.288 12.245 -9.772 1.00 0.00 H new ATOM 37 N ILE A 3 -3.394 10.174 -9.059 1.00 0.00 N ATOM 38 CA ILE A 3 -3.342 8.881 -8.357 1.00 0.00 C ATOM 39 C ILE A 3 -4.035 8.998 -6.989 1.00 0.00 C ATOM 40 O ILE A 3 -4.308 10.101 -6.517 1.00 0.00 O ATOM 41 CB ILE A 3 -1.891 8.353 -8.222 1.00 0.00 C ATOM 42 CG1 ILE A 3 -0.969 9.265 -7.380 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.247 8.122 -9.600 1.00 0.00 C ATOM 44 CD1 ILE A 3 -0.720 8.741 -5.965 1.00 0.00 C ATOM 0 H ILE A 3 -3.327 10.962 -8.415 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.881 8.146 -8.955 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.987 7.406 -7.690 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.013 9.374 -7.892 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.412 10.259 -7.318 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.230 7.752 -9.469 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.831 7.389 -10.156 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.223 9.061 -10.152 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.065 9.430 -5.432 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.669 8.659 -5.435 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.248 7.760 -6.018 1.00 0.00 H new ATOM 56 N PHE A 4 -4.320 7.875 -6.336 1.00 0.00 N ATOM 57 CA PHE A 4 -4.974 7.792 -5.028 1.00 0.00 C ATOM 58 C PHE A 4 -4.124 6.951 -4.065 1.00 0.00 C ATOM 59 O PHE A 4 -3.426 6.031 -4.499 1.00 0.00 O ATOM 60 CB PHE A 4 -6.381 7.182 -5.163 1.00 0.00 C ATOM 61 CG PHE A 4 -7.402 7.924 -6.013 1.00 0.00 C ATOM 62 CD1 PHE A 4 -7.235 8.028 -7.408 1.00 0.00 C ATOM 63 CD2 PHE A 4 -8.579 8.426 -5.423 1.00 0.00 C ATOM 64 CE1 PHE A 4 -8.213 8.652 -8.202 1.00 0.00 C ATOM 65 CE2 PHE A 4 -9.560 9.049 -6.217 1.00 0.00 C ATOM 66 CZ PHE A 4 -9.375 9.165 -7.607 1.00 0.00 C ATOM 0 H PHE A 4 -4.093 6.957 -6.718 1.00 0.00 H new ATOM 0 HA PHE A 4 -5.072 8.801 -4.626 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -6.272 6.178 -5.573 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -6.796 7.074 -4.161 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -6.347 7.624 -7.872 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -8.729 8.332 -4.358 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -8.070 8.736 -9.269 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -10.457 9.439 -5.758 1.00 0.00 H new ATOM 0 HZ PHE A 4 -10.126 9.648 -8.214 1.00 0.00 H new ATOM 76 N VAL A 5 -4.196 7.235 -2.760 1.00 0.00 N ATOM 77 CA VAL A 5 -3.394 6.563 -1.720 1.00 0.00 C ATOM 78 C VAL A 5 -4.242 6.250 -0.486 1.00 0.00 C ATOM 79 O VAL A 5 -4.778 7.159 0.141 1.00 0.00 O ATOM 80 CB VAL A 5 -2.153 7.384 -1.302 1.00 0.00 C ATOM 81 CG1 VAL A 5 -1.020 6.416 -0.958 1.00 0.00 C ATOM 82 CG2 VAL A 5 -1.599 8.339 -2.362 1.00 0.00 C ATOM 0 H VAL A 5 -4.822 7.949 -2.386 1.00 0.00 H new ATOM 0 HA VAL A 5 -3.042 5.631 -2.163 1.00 0.00 H new ATOM 0 HB VAL A 5 -2.493 7.996 -0.466 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -0.136 6.981 -0.661 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -1.330 5.770 -0.137 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -0.785 5.807 -1.831 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -0.731 8.863 -1.962 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -1.305 7.772 -3.245 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -2.366 9.064 -2.635 1.00 0.00 H new ATOM 92 N LYS A 6 -4.396 4.975 -0.127 1.00 0.00 N ATOM 93 CA LYS A 6 -5.334 4.496 0.902 1.00 0.00 C ATOM 94 C LYS A 6 -4.616 3.931 2.136 1.00 0.00 C ATOM 95 O LYS A 6 -3.836 2.985 2.037 1.00 0.00 O ATOM 96 CB LYS A 6 -6.284 3.491 0.231 1.00 0.00 C ATOM 97 CG LYS A 6 -7.695 3.538 0.816 1.00 0.00 C ATOM 98 CD LYS A 6 -7.844 2.890 2.191 1.00 0.00 C ATOM 99 CE LYS A 6 -9.319 2.534 2.401 1.00 0.00 C ATOM 100 NZ LYS A 6 -9.720 1.313 1.653 1.00 0.00 N ATOM 0 H LYS A 6 -3.858 4.221 -0.554 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.916 5.328 1.298 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -6.330 3.698 -0.838 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -5.881 2.484 0.343 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.009 4.579 0.886 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.376 3.045 0.123 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -7.225 1.995 2.258 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.504 3.572 2.970 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.506 2.383 3.464 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.941 3.371 2.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -10.707 1.075 1.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -9.632 1.487 0.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.102 0.522 1.923 1.00 0.00 H new ATOM 114 N THR A 7 -4.839 4.550 3.291 1.00 0.00 N ATOM 115 CA THR A 7 -4.285 4.144 4.604 1.00 0.00 C ATOM 116 C THR A 7 -4.739 2.748 5.060 1.00 0.00 C ATOM 117 O THR A 7 -5.690 2.176 4.521 1.00 0.00 O ATOM 118 CB THR A 7 -4.712 5.130 5.707 1.00 0.00 C ATOM 119 OG1 THR A 7 -6.110 5.094 5.833 1.00 0.00 O ATOM 120 CG2 THR A 7 -4.355 6.584 5.440 1.00 0.00 C ATOM 0 H THR A 7 -5.430 5.379 3.354 1.00 0.00 H new ATOM 0 HA THR A 7 -3.205 4.137 4.459 1.00 0.00 H new ATOM 0 HB THR A 7 -4.174 4.808 6.599 1.00 0.00 H new ATOM 0 HG1 THR A 7 -6.522 5.423 5.007 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.696 7.201 6.271 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.274 6.680 5.336 1.00 0.00 H new ATOM 0 HG23 THR A 7 -4.839 6.915 4.521 1.00 0.00 H new ATOM 128 N LEU A 8 -4.102 2.212 6.111 1.00 0.00 N ATOM 129 CA LEU A 8 -4.567 1.002 6.809 1.00 0.00 C ATOM 130 C LEU A 8 -5.855 1.281 7.611 1.00 0.00 C ATOM 131 O LEU A 8 -6.750 0.438 7.675 1.00 0.00 O ATOM 132 CB LEU A 8 -3.485 0.474 7.767 1.00 0.00 C ATOM 133 CG LEU A 8 -2.125 0.134 7.137 1.00 0.00 C ATOM 134 CD1 LEU A 8 -1.240 -0.473 8.224 1.00 0.00 C ATOM 135 CD2 LEU A 8 -2.233 -0.855 5.974 1.00 0.00 C ATOM 0 H LEU A 8 -3.247 2.606 6.503 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.777 0.251 6.048 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.324 1.219 8.546 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.869 -0.421 8.257 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.704 1.054 6.732 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.267 -0.724 7.803 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.111 0.247 9.032 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.710 -1.376 8.614 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.239 -1.054 5.572 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.675 -1.786 6.328 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.862 -0.430 5.192 1.00 0.00 H new ATOM 147 N THR A 9 -5.942 2.476 8.209 1.00 0.00 N ATOM 148 CA THR A 9 -7.080 2.989 8.993 1.00 0.00 C ATOM 149 C THR A 9 -8.372 3.041 8.166 1.00 0.00 C ATOM 150 O THR A 9 -9.444 2.681 8.655 1.00 0.00 O ATOM 151 CB THR A 9 -6.725 4.383 9.539 1.00 0.00 C ATOM 152 OG1 THR A 9 -5.513 4.305 10.271 1.00 0.00 O ATOM 153 CG2 THR A 9 -7.783 4.960 10.477 1.00 0.00 C ATOM 0 H THR A 9 -5.179 3.151 8.158 1.00 0.00 H new ATOM 0 HA THR A 9 -7.266 2.305 9.821 1.00 0.00 H new ATOM 0 HB THR A 9 -6.648 5.036 8.670 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.283 5.192 10.619 1.00 0.00 H new ATOM 0 HG21 THR A 9 -7.465 5.944 10.823 1.00 0.00 H new ATOM 0 HG22 THR A 9 -8.730 5.051 9.945 1.00 0.00 H new ATOM 0 HG23 THR A 9 -7.910 4.298 11.334 1.00 0.00 H new ATOM 161 N GLY A 10 -8.261 3.453 6.899 1.00 0.00 N ATOM 162 CA GLY A 10 -9.307 3.377 5.872 1.00 0.00 C ATOM 163 C GLY A 10 -9.638 4.686 5.136 1.00 0.00 C ATOM 164 O GLY A 10 -10.564 4.726 4.323 1.00 0.00 O ATOM 0 H GLY A 10 -7.399 3.868 6.544 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -9.006 2.635 5.132 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.220 3.008 6.340 1.00 0.00 H new ATOM 168 N LYS A 11 -8.873 5.748 5.399 1.00 0.00 N ATOM 169 CA LYS A 11 -8.844 7.041 4.699 1.00 0.00 C ATOM 170 C LYS A 11 -8.211 6.898 3.311 1.00 0.00 C ATOM 171 O LYS A 11 -7.168 6.257 3.176 1.00 0.00 O ATOM 172 CB LYS A 11 -8.049 8.013 5.592 1.00 0.00 C ATOM 173 CG LYS A 11 -7.704 9.384 4.992 1.00 0.00 C ATOM 174 CD LYS A 11 -8.919 10.250 4.630 1.00 0.00 C ATOM 175 CE LYS A 11 -8.412 11.681 4.420 1.00 0.00 C ATOM 176 NZ LYS A 11 -9.496 12.653 4.141 1.00 0.00 N ATOM 0 H LYS A 11 -8.203 5.728 6.168 1.00 0.00 H new ATOM 0 HA LYS A 11 -9.852 7.420 4.533 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -8.619 8.177 6.507 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.118 7.525 5.880 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.084 9.931 5.703 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.103 9.232 4.095 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.402 9.877 3.727 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.664 10.219 5.425 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -7.867 12.000 5.309 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.704 11.690 3.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -9.113 13.619 4.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.890 12.471 3.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -10.246 12.551 4.854 1.00 0.00 H new ATOM 190 N THR A 12 -8.809 7.545 2.313 1.00 0.00 N ATOM 191 CA THR A 12 -8.356 7.602 0.912 1.00 0.00 C ATOM 192 C THR A 12 -7.941 9.026 0.543 1.00 0.00 C ATOM 193 O THR A 12 -8.761 9.947 0.535 1.00 0.00 O ATOM 194 CB THR A 12 -9.447 7.133 -0.070 1.00 0.00 C ATOM 195 OG1 THR A 12 -10.067 5.942 0.371 1.00 0.00 O ATOM 196 CG2 THR A 12 -8.859 6.858 -1.456 1.00 0.00 C ATOM 0 H THR A 12 -9.669 8.074 2.461 1.00 0.00 H new ATOM 0 HA THR A 12 -7.504 6.928 0.829 1.00 0.00 H new ATOM 0 HB THR A 12 -10.180 7.938 -0.119 1.00 0.00 H new ATOM 0 HG1 THR A 12 -10.755 5.673 -0.273 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.651 6.529 -2.128 1.00 0.00 H new ATOM 0 HG22 THR A 12 -8.407 7.770 -1.847 1.00 0.00 H new ATOM 0 HG23 THR A 12 -8.100 6.080 -1.381 1.00 0.00 H new ATOM 204 N ILE A 13 -6.657 9.208 0.252 1.00 0.00 N ATOM 205 CA ILE A 13 -6.071 10.425 -0.328 1.00 0.00 C ATOM 206 C ILE A 13 -6.201 10.380 -1.862 1.00 0.00 C ATOM 207 O ILE A 13 -6.209 9.301 -2.459 1.00 0.00 O ATOM 208 CB ILE A 13 -4.576 10.562 0.072 1.00 0.00 C ATOM 209 CG1 ILE A 13 -4.257 10.174 1.540 1.00 0.00 C ATOM 210 CG2 ILE A 13 -4.069 11.990 -0.214 1.00 0.00 C ATOM 211 CD1 ILE A 13 -4.889 11.077 2.604 1.00 0.00 C ATOM 0 H ILE A 13 -5.960 8.482 0.419 1.00 0.00 H new ATOM 0 HA ILE A 13 -6.610 11.290 0.059 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.049 9.837 -0.548 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -4.591 9.150 1.710 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -3.175 10.183 1.675 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -3.020 12.068 0.072 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -4.172 12.207 -1.277 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.656 12.706 0.361 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -4.607 10.723 3.596 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -4.536 12.100 2.469 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -5.974 11.051 2.505 1.00 0.00 H new ATOM 223 N THR A 14 -6.212 11.543 -2.508 1.00 0.00 N ATOM 224 CA THR A 14 -6.122 11.725 -3.969 1.00 0.00 C ATOM 225 C THR A 14 -5.100 12.823 -4.269 1.00 0.00 C ATOM 226 O THR A 14 -5.119 13.864 -3.612 1.00 0.00 O ATOM 227 CB THR A 14 -7.477 12.137 -4.567 1.00 0.00 C ATOM 228 OG1 THR A 14 -8.534 11.338 -4.077 1.00 0.00 O ATOM 229 CG2 THR A 14 -7.473 12.000 -6.093 1.00 0.00 C ATOM 0 H THR A 14 -6.287 12.431 -2.011 1.00 0.00 H new ATOM 0 HA THR A 14 -5.820 10.777 -4.415 1.00 0.00 H new ATOM 0 HB THR A 14 -7.630 13.176 -4.274 1.00 0.00 H new ATOM 0 HG1 THR A 14 -8.601 10.520 -4.612 1.00 0.00 H new ATOM 0 HG21 THR A 14 -8.444 12.298 -6.488 1.00 0.00 H new ATOM 0 HG22 THR A 14 -6.698 12.641 -6.514 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.274 10.963 -6.365 1.00 0.00 H new ATOM 237 N LEU A 15 -4.208 12.610 -5.237 1.00 0.00 N ATOM 238 CA LEU A 15 -3.081 13.490 -5.568 1.00 0.00 C ATOM 239 C LEU A 15 -2.975 13.742 -7.081 1.00 0.00 C ATOM 240 O LEU A 15 -3.395 12.915 -7.887 1.00 0.00 O ATOM 241 CB LEU A 15 -1.778 12.832 -5.081 1.00 0.00 C ATOM 242 CG LEU A 15 -1.695 12.490 -3.585 1.00 0.00 C ATOM 243 CD1 LEU A 15 -0.388 11.732 -3.378 1.00 0.00 C ATOM 244 CD2 LEU A 15 -1.735 13.728 -2.689 1.00 0.00 C ATOM 0 H LEU A 15 -4.251 11.787 -5.838 1.00 0.00 H new ATOM 0 HA LEU A 15 -3.245 14.449 -5.077 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.628 11.914 -5.649 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.949 13.497 -5.325 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.562 11.892 -3.304 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.284 11.467 -2.326 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.394 10.825 -3.982 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.449 12.362 -3.678 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.673 13.423 -1.644 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.893 14.378 -2.928 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.668 14.267 -2.855 1.00 0.00 H new ATOM 256 N GLU A 16 -2.334 14.847 -7.469 1.00 0.00 N ATOM 257 CA GLU A 16 -2.140 15.278 -8.862 1.00 0.00 C ATOM 258 C GLU A 16 -0.644 15.261 -9.231 1.00 0.00 C ATOM 259 O GLU A 16 0.100 16.184 -8.890 1.00 0.00 O ATOM 260 CB GLU A 16 -2.795 16.657 -9.050 1.00 0.00 C ATOM 261 CG GLU A 16 -2.809 17.115 -10.514 1.00 0.00 C ATOM 262 CD GLU A 16 -3.482 18.495 -10.651 1.00 0.00 C ATOM 263 OE1 GLU A 16 -2.778 19.533 -10.563 1.00 0.00 O ATOM 264 OE2 GLU A 16 -4.720 18.557 -10.852 1.00 0.00 O ATOM 0 H GLU A 16 -1.919 15.493 -6.798 1.00 0.00 H new ATOM 0 HA GLU A 16 -2.624 14.583 -9.548 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.818 16.622 -8.675 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -2.260 17.393 -8.449 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.789 17.164 -10.894 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.341 16.384 -11.123 1.00 0.00 H new ATOM 271 N VAL A 17 -0.193 14.183 -9.881 1.00 0.00 N ATOM 272 CA VAL A 17 1.211 13.900 -10.251 1.00 0.00 C ATOM 273 C VAL A 17 1.353 13.551 -11.742 1.00 0.00 C ATOM 274 O VAL A 17 0.368 13.470 -12.473 1.00 0.00 O ATOM 275 CB VAL A 17 1.774 12.749 -9.383 1.00 0.00 C ATOM 276 CG1 VAL A 17 1.997 13.176 -7.926 1.00 0.00 C ATOM 277 CG2 VAL A 17 0.883 11.502 -9.427 1.00 0.00 C ATOM 0 H VAL A 17 -0.825 13.441 -10.182 1.00 0.00 H new ATOM 0 HA VAL A 17 1.785 14.808 -10.066 1.00 0.00 H new ATOM 0 HB VAL A 17 2.741 12.497 -9.818 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.393 12.335 -7.357 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.707 14.002 -7.894 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.050 13.495 -7.491 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.319 10.721 -8.803 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.111 11.752 -9.055 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.807 11.145 -10.454 1.00 0.00 H new ATOM 287 N GLU A 18 2.574 13.320 -12.214 1.00 0.00 N ATOM 288 CA GLU A 18 2.894 12.761 -13.533 1.00 0.00 C ATOM 289 C GLU A 18 3.548 11.389 -13.348 1.00 0.00 C ATOM 290 O GLU A 18 4.137 11.116 -12.304 1.00 0.00 O ATOM 291 CB GLU A 18 3.868 13.688 -14.280 1.00 0.00 C ATOM 292 CG GLU A 18 3.208 14.961 -14.825 1.00 0.00 C ATOM 293 CD GLU A 18 2.257 14.664 -16.001 1.00 0.00 C ATOM 294 OE1 GLU A 18 2.724 14.612 -17.165 1.00 0.00 O ATOM 295 OE2 GLU A 18 1.037 14.481 -15.771 1.00 0.00 O ATOM 0 H GLU A 18 3.409 13.525 -11.666 1.00 0.00 H new ATOM 0 HA GLU A 18 1.977 12.666 -14.114 1.00 0.00 H new ATOM 0 HB2 GLU A 18 4.678 13.968 -13.607 1.00 0.00 H new ATOM 0 HB3 GLU A 18 4.317 13.139 -15.108 1.00 0.00 H new ATOM 0 HG2 GLU A 18 2.653 15.452 -14.026 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.980 15.658 -15.151 1.00 0.00 H new ATOM 302 N SER A 19 3.551 10.545 -14.380 1.00 0.00 N ATOM 303 CA SER A 19 4.252 9.248 -14.360 1.00 0.00 C ATOM 304 C SER A 19 5.772 9.362 -14.132 1.00 0.00 C ATOM 305 O SER A 19 6.422 8.369 -13.789 1.00 0.00 O ATOM 306 CB SER A 19 3.952 8.478 -15.651 1.00 0.00 C ATOM 307 OG SER A 19 4.338 9.231 -16.792 1.00 0.00 O ATOM 0 H SER A 19 3.068 10.736 -15.258 1.00 0.00 H new ATOM 0 HA SER A 19 3.869 8.699 -13.500 1.00 0.00 H new ATOM 0 HB2 SER A 19 4.482 7.526 -15.643 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.887 8.250 -15.704 1.00 0.00 H new ATOM 0 HG SER A 19 4.139 8.720 -17.604 1.00 0.00 H new ATOM 313 N SER A 20 6.339 10.569 -14.255 1.00 0.00 N ATOM 314 CA SER A 20 7.752 10.883 -14.007 1.00 0.00 C ATOM 315 C SER A 20 8.040 11.340 -12.569 1.00 0.00 C ATOM 316 O SER A 20 9.211 11.439 -12.196 1.00 0.00 O ATOM 317 CB SER A 20 8.220 11.984 -14.970 1.00 0.00 C ATOM 318 OG SER A 20 8.052 11.588 -16.325 1.00 0.00 O ATOM 0 H SER A 20 5.803 11.388 -14.542 1.00 0.00 H new ATOM 0 HA SER A 20 8.298 9.954 -14.170 1.00 0.00 H new ATOM 0 HB2 SER A 20 7.656 12.898 -14.783 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.269 12.213 -14.783 1.00 0.00 H new ATOM 0 HG SER A 20 8.356 12.308 -16.916 1.00 0.00 H new ATOM 324 N ASP A 21 7.022 11.628 -11.744 1.00 0.00 N ATOM 325 CA ASP A 21 7.241 11.977 -10.332 1.00 0.00 C ATOM 326 C ASP A 21 7.774 10.780 -9.519 1.00 0.00 C ATOM 327 O ASP A 21 7.428 9.623 -9.787 1.00 0.00 O ATOM 328 CB ASP A 21 5.966 12.544 -9.686 1.00 0.00 C ATOM 329 CG ASP A 21 5.735 14.017 -10.049 1.00 0.00 C ATOM 330 OD1 ASP A 21 6.633 14.855 -9.790 1.00 0.00 O ATOM 331 OD2 ASP A 21 4.643 14.346 -10.565 1.00 0.00 O ATOM 0 H ASP A 21 6.043 11.626 -12.029 1.00 0.00 H new ATOM 0 HA ASP A 21 8.004 12.755 -10.317 1.00 0.00 H new ATOM 0 HB2 ASP A 21 5.107 11.954 -10.005 1.00 0.00 H new ATOM 0 HB3 ASP A 21 6.036 12.446 -8.603 1.00 0.00 H new ATOM 336 N THR A 22 8.621 11.054 -8.518 1.00 0.00 N ATOM 337 CA THR A 22 9.235 10.020 -7.667 1.00 0.00 C ATOM 338 C THR A 22 8.349 9.597 -6.496 1.00 0.00 C ATOM 339 O THR A 22 7.458 10.333 -6.073 1.00 0.00 O ATOM 340 CB THR A 22 10.610 10.440 -7.124 1.00 0.00 C ATOM 341 OG1 THR A 22 10.514 11.586 -6.305 1.00 0.00 O ATOM 342 CG2 THR A 22 11.605 10.737 -8.245 1.00 0.00 C ATOM 0 H THR A 22 8.902 12.003 -8.273 1.00 0.00 H new ATOM 0 HA THR A 22 9.360 9.165 -8.331 1.00 0.00 H new ATOM 0 HB THR A 22 10.970 9.594 -6.539 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.404 11.827 -5.974 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.562 11.030 -7.814 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.740 9.845 -8.857 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.223 11.548 -8.865 1.00 0.00 H new ATOM 350 N ILE A 23 8.624 8.428 -5.912 1.00 0.00 N ATOM 351 CA ILE A 23 7.959 7.933 -4.697 1.00 0.00 C ATOM 352 C ILE A 23 8.143 8.916 -3.529 1.00 0.00 C ATOM 353 O ILE A 23 7.180 9.230 -2.830 1.00 0.00 O ATOM 354 CB ILE A 23 8.484 6.516 -4.378 1.00 0.00 C ATOM 355 CG1 ILE A 23 8.067 5.477 -5.446 1.00 0.00 C ATOM 356 CG2 ILE A 23 8.093 6.036 -2.971 1.00 0.00 C ATOM 357 CD1 ILE A 23 6.561 5.238 -5.597 1.00 0.00 C ATOM 0 H ILE A 23 9.328 7.785 -6.275 1.00 0.00 H new ATOM 0 HA ILE A 23 6.884 7.864 -4.862 1.00 0.00 H new ATOM 0 HB ILE A 23 9.571 6.599 -4.401 1.00 0.00 H new ATOM 0 HG12 ILE A 23 8.463 5.797 -6.410 1.00 0.00 H new ATOM 0 HG13 ILE A 23 8.544 4.527 -5.206 1.00 0.00 H new ATOM 0 HG21 ILE A 23 8.490 5.035 -2.805 1.00 0.00 H new ATOM 0 HG22 ILE A 23 8.505 6.718 -2.227 1.00 0.00 H new ATOM 0 HG23 ILE A 23 7.007 6.015 -2.883 1.00 0.00 H new ATOM 0 HD11 ILE A 23 6.387 4.492 -6.372 1.00 0.00 H new ATOM 0 HD12 ILE A 23 6.153 4.881 -4.652 1.00 0.00 H new ATOM 0 HD13 ILE A 23 6.071 6.171 -5.875 1.00 0.00 H new ATOM 369 N ASP A 24 9.348 9.470 -3.363 1.00 0.00 N ATOM 370 CA ASP A 24 9.639 10.554 -2.414 1.00 0.00 C ATOM 371 C ASP A 24 8.729 11.780 -2.609 1.00 0.00 C ATOM 372 O ASP A 24 8.207 12.334 -1.638 1.00 0.00 O ATOM 373 CB ASP A 24 11.102 10.973 -2.583 1.00 0.00 C ATOM 374 CG ASP A 24 11.519 12.036 -1.553 1.00 0.00 C ATOM 375 OD1 ASP A 24 11.720 11.686 -0.366 1.00 0.00 O ATOM 376 OD2 ASP A 24 11.666 13.222 -1.933 1.00 0.00 O ATOM 0 H ASP A 24 10.166 9.173 -3.894 1.00 0.00 H new ATOM 0 HA ASP A 24 9.450 10.175 -1.410 1.00 0.00 H new ATOM 0 HB2 ASP A 24 11.744 10.098 -2.481 1.00 0.00 H new ATOM 0 HB3 ASP A 24 11.253 11.364 -3.589 1.00 0.00 H new ATOM 381 N ASN A 25 8.506 12.186 -3.865 1.00 0.00 N ATOM 382 CA ASN A 25 7.603 13.288 -4.204 1.00 0.00 C ATOM 383 C ASN A 25 6.161 12.933 -3.842 1.00 0.00 C ATOM 384 O ASN A 25 5.504 13.713 -3.162 1.00 0.00 O ATOM 385 CB ASN A 25 7.714 13.679 -5.687 1.00 0.00 C ATOM 386 CG ASN A 25 8.746 14.772 -5.905 1.00 0.00 C ATOM 387 OD1 ASN A 25 8.435 15.902 -6.255 1.00 0.00 O ATOM 388 ND2 ASN A 25 10.000 14.483 -5.663 1.00 0.00 N ATOM 0 H ASN A 25 8.950 11.756 -4.677 1.00 0.00 H new ATOM 0 HA ASN A 25 7.905 14.154 -3.616 1.00 0.00 H new ATOM 0 HB2 ASN A 25 7.983 12.802 -6.275 1.00 0.00 H new ATOM 0 HB3 ASN A 25 6.743 14.018 -6.047 1.00 0.00 H new ATOM 0 HD21 ASN A 25 10.718 15.200 -5.766 1.00 0.00 H new ATOM 0 HD22 ASN A 25 10.259 13.541 -5.371 1.00 0.00 H new ATOM 395 N VAL A 26 5.674 11.758 -4.256 1.00 0.00 N ATOM 396 CA VAL A 26 4.308 11.296 -3.969 1.00 0.00 C ATOM 397 C VAL A 26 4.013 11.356 -2.476 1.00 0.00 C ATOM 398 O VAL A 26 3.063 12.034 -2.096 1.00 0.00 O ATOM 399 CB VAL A 26 4.042 9.884 -4.505 1.00 0.00 C ATOM 400 CG1 VAL A 26 2.626 9.420 -4.145 1.00 0.00 C ATOM 401 CG2 VAL A 26 4.171 9.835 -6.031 1.00 0.00 C ATOM 0 H VAL A 26 6.220 11.094 -4.805 1.00 0.00 H new ATOM 0 HA VAL A 26 3.635 11.976 -4.491 1.00 0.00 H new ATOM 0 HB VAL A 26 4.784 9.231 -4.046 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.462 8.416 -4.536 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.511 9.411 -3.061 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.897 10.103 -4.581 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.977 8.821 -6.380 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.449 10.518 -6.479 1.00 0.00 H new ATOM 0 HG23 VAL A 26 5.179 10.132 -6.321 1.00 0.00 H new ATOM 411 N LYS A 27 4.843 10.731 -1.625 1.00 0.00 N ATOM 412 CA LYS A 27 4.739 10.820 -0.154 1.00 0.00 C ATOM 413 C LYS A 27 4.586 12.264 0.334 1.00 0.00 C ATOM 414 O LYS A 27 3.703 12.578 1.131 1.00 0.00 O ATOM 415 CB LYS A 27 5.986 10.194 0.475 1.00 0.00 C ATOM 416 CG LYS A 27 6.065 8.682 0.264 1.00 0.00 C ATOM 417 CD LYS A 27 7.441 8.206 0.727 1.00 0.00 C ATOM 418 CE LYS A 27 7.498 6.690 0.608 1.00 0.00 C ATOM 419 NZ LYS A 27 8.672 6.155 1.341 1.00 0.00 N ATOM 0 H LYS A 27 5.614 10.143 -1.940 1.00 0.00 H new ATOM 0 HA LYS A 27 3.843 10.280 0.150 1.00 0.00 H new ATOM 0 HB2 LYS A 27 6.874 10.662 0.051 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.993 10.407 1.544 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.279 8.178 0.827 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.912 8.436 -0.787 1.00 0.00 H new ATOM 0 HD2 LYS A 27 8.223 8.662 0.120 1.00 0.00 H new ATOM 0 HD3 LYS A 27 7.619 8.511 1.758 1.00 0.00 H new ATOM 0 HE2 LYS A 27 6.583 6.253 1.007 1.00 0.00 H new ATOM 0 HE3 LYS A 27 7.556 6.404 -0.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 8.845 5.172 1.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 9.509 6.733 1.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 8.485 6.184 2.364 1.00 0.00 H new ATOM 433 N SER A 28 5.430 13.150 -0.188 1.00 0.00 N ATOM 434 CA SER A 28 5.449 14.587 0.113 1.00 0.00 C ATOM 435 C SER A 28 4.182 15.329 -0.355 1.00 0.00 C ATOM 436 O SER A 28 3.857 16.391 0.182 1.00 0.00 O ATOM 437 CB SER A 28 6.712 15.211 -0.503 1.00 0.00 C ATOM 438 OG SER A 28 6.979 16.484 0.065 1.00 0.00 O ATOM 0 H SER A 28 6.149 12.881 -0.859 1.00 0.00 H new ATOM 0 HA SER A 28 5.465 14.696 1.197 1.00 0.00 H new ATOM 0 HB2 SER A 28 7.564 14.551 -0.341 1.00 0.00 H new ATOM 0 HB3 SER A 28 6.585 15.309 -1.581 1.00 0.00 H new ATOM 0 HG SER A 28 7.788 16.860 -0.341 1.00 0.00 H new ATOM 444 N LYS A 29 3.399 14.768 -1.292 1.00 0.00 N ATOM 445 CA LYS A 29 2.133 15.353 -1.759 1.00 0.00 C ATOM 446 C LYS A 29 0.982 15.017 -0.809 1.00 0.00 C ATOM 447 O LYS A 29 0.132 15.873 -0.591 1.00 0.00 O ATOM 448 CB LYS A 29 1.819 14.916 -3.200 1.00 0.00 C ATOM 449 CG LYS A 29 2.884 15.314 -4.232 1.00 0.00 C ATOM 450 CD LYS A 29 2.608 16.641 -4.955 1.00 0.00 C ATOM 451 CE LYS A 29 1.519 16.469 -6.020 1.00 0.00 C ATOM 452 NZ LYS A 29 1.359 17.686 -6.855 1.00 0.00 N ATOM 0 H LYS A 29 3.631 13.887 -1.750 1.00 0.00 H new ATOM 0 HA LYS A 29 2.248 16.437 -1.761 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.699 13.833 -3.220 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.864 15.348 -3.497 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.849 15.382 -3.731 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.966 14.521 -4.975 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.299 17.396 -4.232 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.524 17.003 -5.422 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.768 15.621 -6.659 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.571 16.235 -5.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.885 17.436 -7.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.786 18.386 -6.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.295 18.090 -7.063 1.00 0.00 H new ATOM 466 N ILE A 30 0.981 13.842 -0.160 1.00 0.00 N ATOM 467 CA ILE A 30 0.028 13.533 0.932 1.00 0.00 C ATOM 468 C ILE A 30 0.120 14.576 2.062 1.00 0.00 C ATOM 469 O ILE A 30 -0.898 14.973 2.639 1.00 0.00 O ATOM 470 CB ILE A 30 0.198 12.101 1.503 1.00 0.00 C ATOM 471 CG1 ILE A 30 -0.155 11.001 0.477 1.00 0.00 C ATOM 472 CG2 ILE A 30 -0.735 11.905 2.705 1.00 0.00 C ATOM 473 CD1 ILE A 30 1.108 10.408 -0.136 1.00 0.00 C ATOM 0 H ILE A 30 1.630 13.084 -0.370 1.00 0.00 H new ATOM 0 HA ILE A 30 -0.965 13.579 0.486 1.00 0.00 H new ATOM 0 HB ILE A 30 1.248 12.008 1.779 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.732 10.215 0.964 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.785 11.419 -0.309 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.611 10.897 3.101 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -0.489 12.632 3.479 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.769 12.046 2.390 1.00 0.00 H new ATOM 0 HD11 ILE A 30 0.835 9.636 -0.855 1.00 0.00 H new ATOM 0 HD12 ILE A 30 1.670 11.193 -0.642 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.723 9.971 0.650 1.00 0.00 H new ATOM 485 N GLN A 31 1.328 15.064 2.358 1.00 0.00 N ATOM 486 CA GLN A 31 1.560 16.102 3.374 1.00 0.00 C ATOM 487 C GLN A 31 0.835 17.428 3.055 1.00 0.00 C ATOM 488 O GLN A 31 0.576 18.227 3.953 1.00 0.00 O ATOM 489 CB GLN A 31 3.072 16.301 3.580 1.00 0.00 C ATOM 490 CG GLN A 31 3.407 17.158 4.809 1.00 0.00 C ATOM 491 CD GLN A 31 4.904 17.197 5.103 1.00 0.00 C ATOM 492 OE1 GLN A 31 5.726 17.610 4.296 1.00 0.00 O ATOM 493 NE2 GLN A 31 5.310 16.788 6.284 1.00 0.00 N ATOM 0 H GLN A 31 2.182 14.749 1.897 1.00 0.00 H new ATOM 0 HA GLN A 31 1.124 15.756 4.311 1.00 0.00 H new ATOM 0 HB2 GLN A 31 3.549 15.327 3.683 1.00 0.00 H new ATOM 0 HB3 GLN A 31 3.495 16.770 2.692 1.00 0.00 H new ATOM 0 HG2 GLN A 31 3.045 18.174 4.650 1.00 0.00 H new ATOM 0 HG3 GLN A 31 2.879 16.764 5.678 1.00 0.00 H new ATOM 0 HE21 GLN A 31 4.633 16.442 6.964 1.00 0.00 H new ATOM 0 HE22 GLN A 31 6.302 16.817 6.520 1.00 0.00 H new ATOM 502 N ASP A 32 0.434 17.644 1.799 1.00 0.00 N ATOM 503 CA ASP A 32 -0.369 18.804 1.382 1.00 0.00 C ATOM 504 C ASP A 32 -1.875 18.628 1.668 1.00 0.00 C ATOM 505 O ASP A 32 -2.607 19.613 1.795 1.00 0.00 O ATOM 506 CB ASP A 32 -0.143 19.045 -0.117 1.00 0.00 C ATOM 507 CG ASP A 32 -0.621 20.438 -0.560 1.00 0.00 C ATOM 508 OD1 ASP A 32 -0.016 21.451 -0.130 1.00 0.00 O ATOM 509 OD2 ASP A 32 -1.582 20.527 -1.361 1.00 0.00 O ATOM 0 H ASP A 32 0.659 17.012 1.031 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.043 19.664 1.967 1.00 0.00 H new ATOM 0 HB2 ASP A 32 0.917 18.937 -0.345 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.671 18.282 -0.690 1.00 0.00 H new ATOM 514 N LYS A 33 -2.341 17.374 1.775 1.00 0.00 N ATOM 515 CA LYS A 33 -3.756 16.988 1.915 1.00 0.00 C ATOM 516 C LYS A 33 -4.160 16.807 3.380 1.00 0.00 C ATOM 517 O LYS A 33 -5.174 17.352 3.812 1.00 0.00 O ATOM 518 CB LYS A 33 -4.061 15.701 1.113 1.00 0.00 C ATOM 519 CG LYS A 33 -3.365 15.561 -0.251 1.00 0.00 C ATOM 520 CD LYS A 33 -3.575 16.716 -1.235 1.00 0.00 C ATOM 521 CE LYS A 33 -4.926 16.609 -1.946 1.00 0.00 C ATOM 522 NZ LYS A 33 -5.335 17.899 -2.561 1.00 0.00 N ATOM 0 H LYS A 33 -1.717 16.567 1.766 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.349 17.806 1.506 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.785 14.843 1.726 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.138 15.645 0.954 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -2.295 15.446 -0.080 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.713 14.642 -0.721 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.518 17.665 -0.701 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.773 16.717 -1.973 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -4.870 15.841 -2.718 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.687 16.290 -1.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.255 17.783 -3.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.414 18.626 -1.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.623 18.192 -3.260 1.00 0.00 H new ATOM 536 N GLU A 34 -3.372 16.037 4.137 1.00 0.00 N ATOM 537 CA GLU A 34 -3.672 15.628 5.523 1.00 0.00 C ATOM 538 C GLU A 34 -2.483 15.789 6.487 1.00 0.00 C ATOM 539 O GLU A 34 -2.671 15.780 7.705 1.00 0.00 O ATOM 540 CB GLU A 34 -4.157 14.168 5.542 1.00 0.00 C ATOM 541 CG GLU A 34 -5.432 13.911 4.723 1.00 0.00 C ATOM 542 CD GLU A 34 -6.694 14.653 5.217 1.00 0.00 C ATOM 543 OE1 GLU A 34 -6.773 15.055 6.402 1.00 0.00 O ATOM 544 OE2 GLU A 34 -7.663 14.768 4.425 1.00 0.00 O ATOM 0 H GLU A 34 -2.483 15.668 3.799 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.454 16.299 5.879 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -3.361 13.529 5.162 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.338 13.872 6.575 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.244 14.198 3.688 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -5.636 12.840 4.725 1.00 0.00 H new ATOM 551 N GLY A 35 -1.266 15.974 5.961 1.00 0.00 N ATOM 552 CA GLY A 35 -0.080 16.354 6.750 1.00 0.00 C ATOM 553 C GLY A 35 0.887 15.214 7.094 1.00 0.00 C ATOM 554 O GLY A 35 1.819 15.415 7.874 1.00 0.00 O ATOM 0 H GLY A 35 -1.071 15.864 4.966 1.00 0.00 H new ATOM 0 HA2 GLY A 35 0.470 17.118 6.200 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.417 16.812 7.680 1.00 0.00 H new ATOM 558 N ILE A 36 0.685 14.023 6.522 1.00 0.00 N ATOM 559 CA ILE A 36 1.476 12.809 6.785 1.00 0.00 C ATOM 560 C ILE A 36 2.952 13.007 6.385 1.00 0.00 C ATOM 561 O ILE A 36 3.229 13.301 5.219 1.00 0.00 O ATOM 562 CB ILE A 36 0.872 11.597 6.046 1.00 0.00 C ATOM 563 CG1 ILE A 36 -0.643 11.395 6.295 1.00 0.00 C ATOM 564 CG2 ILE A 36 1.644 10.323 6.422 1.00 0.00 C ATOM 565 CD1 ILE A 36 -1.075 11.304 7.766 1.00 0.00 C ATOM 0 H ILE A 36 -0.058 13.869 5.840 1.00 0.00 H new ATOM 0 HA ILE A 36 1.443 12.614 7.857 1.00 0.00 H new ATOM 0 HB ILE A 36 0.974 11.806 4.981 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -1.181 12.220 5.829 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -0.956 10.483 5.787 1.00 0.00 H new ATOM 0 HG21 ILE A 36 1.214 9.469 5.898 1.00 0.00 H new ATOM 0 HG22 ILE A 36 2.690 10.434 6.138 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.576 10.160 7.498 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.154 11.163 7.820 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -0.575 10.460 8.241 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.803 12.224 8.283 1.00 0.00 H new ATOM 577 N PRO A 37 3.915 12.847 7.312 1.00 0.00 N ATOM 578 CA PRO A 37 5.317 13.170 7.063 1.00 0.00 C ATOM 579 C PRO A 37 5.997 12.132 6.153 1.00 0.00 C ATOM 580 O PRO A 37 6.002 10.946 6.500 1.00 0.00 O ATOM 581 CB PRO A 37 5.970 13.210 8.443 1.00 0.00 C ATOM 582 CG PRO A 37 5.115 12.255 9.277 1.00 0.00 C ATOM 583 CD PRO A 37 3.730 12.369 8.676 1.00 0.00 C ATOM 0 HA PRO A 37 5.416 14.119 6.536 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.010 12.886 8.403 1.00 0.00 H new ATOM 0 HB3 PRO A 37 5.966 14.218 8.859 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.490 11.233 9.220 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.116 12.537 10.330 1.00 0.00 H new ATOM 0 HD2 PRO A 37 3.222 11.405 8.685 1.00 0.00 H new ATOM 0 HD3 PRO A 37 3.113 13.060 9.250 1.00 0.00 H new ATOM 591 N PRO A 38 6.624 12.537 5.029 1.00 0.00 N ATOM 592 CA PRO A 38 7.240 11.618 4.066 1.00 0.00 C ATOM 593 C PRO A 38 8.427 10.790 4.598 1.00 0.00 C ATOM 594 O PRO A 38 8.901 9.902 3.889 1.00 0.00 O ATOM 595 CB PRO A 38 7.620 12.478 2.854 1.00 0.00 C ATOM 596 CG PRO A 38 7.755 13.888 3.414 1.00 0.00 C ATOM 597 CD PRO A 38 6.727 13.910 4.541 1.00 0.00 C ATOM 0 HA PRO A 38 6.523 10.838 3.812 1.00 0.00 H new ATOM 0 HB2 PRO A 38 8.553 12.139 2.404 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.856 12.430 2.078 1.00 0.00 H new ATOM 0 HG2 PRO A 38 8.762 14.081 3.783 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.542 14.644 2.659 1.00 0.00 H new ATOM 0 HD2 PRO A 38 7.039 14.584 5.339 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.763 14.268 4.181 1.00 0.00 H new ATOM 605 N ASP A 39 8.896 11.018 5.834 1.00 0.00 N ATOM 606 CA ASP A 39 9.960 10.225 6.461 1.00 0.00 C ATOM 607 C ASP A 39 9.415 9.007 7.237 1.00 0.00 C ATOM 608 O ASP A 39 10.131 8.017 7.406 1.00 0.00 O ATOM 609 CB ASP A 39 10.791 11.141 7.371 1.00 0.00 C ATOM 610 CG ASP A 39 12.088 10.466 7.851 1.00 0.00 C ATOM 611 OD1 ASP A 39 12.973 10.182 7.006 1.00 0.00 O ATOM 612 OD2 ASP A 39 12.253 10.256 9.078 1.00 0.00 O ATOM 0 H ASP A 39 8.543 11.766 6.431 1.00 0.00 H new ATOM 0 HA ASP A 39 10.593 9.815 5.674 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.038 12.056 6.833 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.193 11.430 8.235 1.00 0.00 H new ATOM 617 N GLN A 40 8.147 9.039 7.681 1.00 0.00 N ATOM 618 CA GLN A 40 7.518 7.916 8.390 1.00 0.00 C ATOM 619 C GLN A 40 6.803 6.934 7.451 1.00 0.00 C ATOM 620 O GLN A 40 6.722 5.742 7.750 1.00 0.00 O ATOM 621 CB GLN A 40 6.489 8.450 9.395 1.00 0.00 C ATOM 622 CG GLN A 40 7.035 9.013 10.717 1.00 0.00 C ATOM 623 CD GLN A 40 8.226 9.953 10.636 1.00 0.00 C ATOM 624 OE1 GLN A 40 9.306 9.687 11.146 1.00 0.00 O ATOM 625 NE2 GLN A 40 8.024 11.100 10.037 1.00 0.00 N ATOM 0 H GLN A 40 7.532 9.843 7.558 1.00 0.00 H new ATOM 0 HA GLN A 40 8.324 7.378 8.889 1.00 0.00 H new ATOM 0 HB2 GLN A 40 5.912 9.234 8.905 1.00 0.00 H new ATOM 0 HB3 GLN A 40 5.795 7.643 9.631 1.00 0.00 H new ATOM 0 HG2 GLN A 40 6.224 9.539 11.220 1.00 0.00 H new ATOM 0 HG3 GLN A 40 7.312 8.172 11.353 1.00 0.00 H new ATOM 0 HE21 GLN A 40 7.117 11.304 9.618 1.00 0.00 H new ATOM 0 HE22 GLN A 40 8.774 11.790 9.990 1.00 0.00 H new ATOM 634 N GLN A 41 6.215 7.437 6.364 1.00 0.00 N ATOM 635 CA GLN A 41 5.388 6.641 5.450 1.00 0.00 C ATOM 636 C GLN A 41 6.194 5.876 4.381 1.00 0.00 C ATOM 637 O GLN A 41 7.249 6.305 3.904 1.00 0.00 O ATOM 638 CB GLN A 41 4.277 7.500 4.812 1.00 0.00 C ATOM 639 CG GLN A 41 4.792 8.709 4.020 1.00 0.00 C ATOM 640 CD GLN A 41 3.695 9.387 3.205 1.00 0.00 C ATOM 641 OE1 GLN A 41 3.044 8.775 2.375 1.00 0.00 O ATOM 642 NE2 GLN A 41 3.477 10.677 3.355 1.00 0.00 N ATOM 0 H GLN A 41 6.299 8.416 6.090 1.00 0.00 H new ATOM 0 HA GLN A 41 4.922 5.873 6.067 1.00 0.00 H new ATOM 0 HB2 GLN A 41 3.683 6.871 4.148 1.00 0.00 H new ATOM 0 HB3 GLN A 41 3.610 7.853 5.598 1.00 0.00 H new ATOM 0 HG2 GLN A 41 5.227 9.432 4.710 1.00 0.00 H new ATOM 0 HG3 GLN A 41 5.590 8.387 3.351 1.00 0.00 H new ATOM 0 HE21 GLN A 41 4.010 11.208 4.044 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.775 11.145 2.783 1.00 0.00 H new ATOM 651 N ARG A 42 5.609 4.761 3.947 1.00 0.00 N ATOM 652 CA ARG A 42 5.960 3.890 2.813 1.00 0.00 C ATOM 653 C ARG A 42 4.744 3.757 1.889 1.00 0.00 C ATOM 654 O ARG A 42 3.617 3.957 2.339 1.00 0.00 O ATOM 655 CB ARG A 42 6.382 2.507 3.346 1.00 0.00 C ATOM 656 CG ARG A 42 7.838 2.456 3.826 1.00 0.00 C ATOM 657 CD ARG A 42 8.115 1.083 4.457 1.00 0.00 C ATOM 658 NE ARG A 42 9.557 0.783 4.523 1.00 0.00 N ATOM 659 CZ ARG A 42 10.441 1.180 5.420 1.00 0.00 C ATOM 660 NH1 ARG A 42 10.121 1.955 6.419 1.00 0.00 N ATOM 661 NH2 ARG A 42 11.681 0.794 5.326 1.00 0.00 N ATOM 0 H ARG A 42 4.786 4.402 4.431 1.00 0.00 H new ATOM 0 HA ARG A 42 6.789 4.320 2.251 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.726 2.228 4.170 1.00 0.00 H new ATOM 0 HB3 ARG A 42 6.240 1.765 2.561 1.00 0.00 H new ATOM 0 HG2 ARG A 42 8.515 2.628 2.990 1.00 0.00 H new ATOM 0 HG3 ARG A 42 8.022 3.247 4.553 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.693 1.055 5.462 1.00 0.00 H new ATOM 0 HD3 ARG A 42 7.611 0.310 3.877 1.00 0.00 H new ATOM 0 HE ARG A 42 9.920 0.190 3.777 1.00 0.00 H new ATOM 0 HH11 ARG A 42 9.159 2.276 6.528 1.00 0.00 H new ATOM 0 HH12 ARG A 42 10.833 2.240 7.092 1.00 0.00 H new ATOM 0 HH21 ARG A 42 11.969 0.185 4.560 1.00 0.00 H new ATOM 0 HH22 ARG A 42 12.364 1.100 6.019 1.00 0.00 H new ATOM 675 N LEU A 43 4.963 3.381 0.629 1.00 0.00 N ATOM 676 CA LEU A 43 3.915 3.133 -0.374 1.00 0.00 C ATOM 677 C LEU A 43 3.983 1.682 -0.882 1.00 0.00 C ATOM 678 O LEU A 43 5.052 1.067 -0.868 1.00 0.00 O ATOM 679 CB LEU A 43 4.015 4.156 -1.528 1.00 0.00 C ATOM 680 CG LEU A 43 3.883 5.640 -1.130 1.00 0.00 C ATOM 681 CD1 LEU A 43 3.918 6.522 -2.379 1.00 0.00 C ATOM 682 CD2 LEU A 43 2.573 5.953 -0.410 1.00 0.00 C ATOM 0 H LEU A 43 5.903 3.235 0.262 1.00 0.00 H new ATOM 0 HA LEU A 43 2.940 3.266 0.095 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.974 4.018 -2.027 1.00 0.00 H new ATOM 0 HB3 LEU A 43 3.240 3.926 -2.259 1.00 0.00 H new ATOM 0 HG LEU A 43 4.717 5.841 -0.458 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.824 7.568 -2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 43 4.863 6.374 -2.902 1.00 0.00 H new ATOM 0 HD13 LEU A 43 3.092 6.253 -3.038 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.541 7.013 -0.157 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.733 5.710 -1.061 1.00 0.00 H new ATOM 0 HD23 LEU A 43 2.508 5.360 0.502 1.00 0.00 H new ATOM 694 N ILE A 44 2.850 1.129 -1.325 1.00 0.00 N ATOM 695 CA ILE A 44 2.727 -0.257 -1.814 1.00 0.00 C ATOM 696 C ILE A 44 1.886 -0.333 -3.105 1.00 0.00 C ATOM 697 O ILE A 44 0.830 0.302 -3.198 1.00 0.00 O ATOM 698 CB ILE A 44 2.073 -1.144 -0.712 1.00 0.00 C ATOM 699 CG1 ILE A 44 2.700 -1.121 0.697 1.00 0.00 C ATOM 700 CG2 ILE A 44 1.912 -2.602 -1.190 1.00 0.00 C ATOM 701 CD1 ILE A 44 4.080 -1.754 0.864 1.00 0.00 C ATOM 0 H ILE A 44 1.968 1.641 -1.356 1.00 0.00 H new ATOM 0 HA ILE A 44 3.728 -0.622 -2.043 1.00 0.00 H new ATOM 0 HB ILE A 44 1.106 -0.660 -0.573 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.765 -0.082 1.019 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.014 -1.624 1.379 1.00 0.00 H new ATOM 0 HG21 ILE A 44 1.453 -3.196 -0.399 1.00 0.00 H new ATOM 0 HG22 ILE A 44 1.278 -2.626 -2.076 1.00 0.00 H new ATOM 0 HG23 ILE A 44 2.891 -3.016 -1.432 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.397 -1.666 1.903 1.00 0.00 H new ATOM 0 HD12 ILE A 44 4.033 -2.807 0.586 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.796 -1.241 0.222 1.00 0.00 H new ATOM 713 N PHE A 45 2.322 -1.145 -4.080 1.00 0.00 N ATOM 714 CA PHE A 45 1.565 -1.525 -5.285 1.00 0.00 C ATOM 715 C PHE A 45 1.979 -2.916 -5.807 1.00 0.00 C ATOM 716 O PHE A 45 3.127 -3.326 -5.640 1.00 0.00 O ATOM 717 CB PHE A 45 1.745 -0.471 -6.394 1.00 0.00 C ATOM 718 CG PHE A 45 0.880 -0.660 -7.639 1.00 0.00 C ATOM 719 CD1 PHE A 45 -0.469 -1.074 -7.548 1.00 0.00 C ATOM 720 CD2 PHE A 45 1.407 -0.336 -8.903 1.00 0.00 C ATOM 721 CE1 PHE A 45 -1.270 -1.155 -8.701 1.00 0.00 C ATOM 722 CE2 PHE A 45 0.596 -0.381 -10.050 1.00 0.00 C ATOM 723 CZ PHE A 45 -0.742 -0.799 -9.953 1.00 0.00 C ATOM 0 H PHE A 45 3.248 -1.572 -4.051 1.00 0.00 H new ATOM 0 HA PHE A 45 0.513 -1.572 -5.004 1.00 0.00 H new ATOM 0 HB2 PHE A 45 1.532 0.512 -5.973 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.791 -0.467 -6.699 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.887 -1.330 -6.586 1.00 0.00 H new ATOM 0 HD2 PHE A 45 2.445 -0.050 -8.993 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.293 -1.492 -8.624 1.00 0.00 H new ATOM 0 HE2 PHE A 45 1.002 -0.094 -11.008 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.361 -0.846 -10.837 1.00 0.00 H new ATOM 733 N ALA A 46 1.052 -3.639 -6.446 1.00 0.00 N ATOM 734 CA ALA A 46 1.207 -4.985 -7.016 1.00 0.00 C ATOM 735 C ALA A 46 1.892 -6.009 -6.074 1.00 0.00 C ATOM 736 O ALA A 46 2.624 -6.901 -6.511 1.00 0.00 O ATOM 737 CB ALA A 46 1.862 -4.857 -8.399 1.00 0.00 C ATOM 0 H ALA A 46 0.110 -3.276 -6.589 1.00 0.00 H new ATOM 0 HA ALA A 46 0.217 -5.425 -7.139 1.00 0.00 H new ATOM 0 HB1 ALA A 46 1.985 -5.848 -8.837 1.00 0.00 H new ATOM 0 HB2 ALA A 46 1.229 -4.250 -9.046 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.838 -4.382 -8.297 1.00 0.00 H new ATOM 743 N GLY A 47 1.660 -5.871 -4.764 1.00 0.00 N ATOM 744 CA GLY A 47 2.236 -6.697 -3.701 1.00 0.00 C ATOM 745 C GLY A 47 3.733 -6.472 -3.434 1.00 0.00 C ATOM 746 O GLY A 47 4.373 -7.311 -2.797 1.00 0.00 O ATOM 0 H GLY A 47 1.038 -5.148 -4.401 1.00 0.00 H new ATOM 0 HA2 GLY A 47 1.687 -6.508 -2.779 1.00 0.00 H new ATOM 0 HA3 GLY A 47 2.082 -7.746 -3.955 1.00 0.00 H new ATOM 750 N LYS A 48 4.303 -5.353 -3.905 1.00 0.00 N ATOM 751 CA LYS A 48 5.692 -4.915 -3.709 1.00 0.00 C ATOM 752 C LYS A 48 5.743 -3.624 -2.883 1.00 0.00 C ATOM 753 O LYS A 48 4.892 -2.750 -3.038 1.00 0.00 O ATOM 754 CB LYS A 48 6.320 -4.728 -5.107 1.00 0.00 C ATOM 755 CG LYS A 48 7.787 -4.272 -5.119 1.00 0.00 C ATOM 756 CD LYS A 48 8.734 -5.304 -4.490 1.00 0.00 C ATOM 757 CE LYS A 48 10.200 -4.851 -4.574 1.00 0.00 C ATOM 758 NZ LYS A 48 10.550 -3.834 -3.543 1.00 0.00 N ATOM 0 H LYS A 48 3.773 -4.688 -4.468 1.00 0.00 H new ATOM 0 HA LYS A 48 6.258 -5.660 -3.149 1.00 0.00 H new ATOM 0 HB2 LYS A 48 6.247 -5.672 -5.648 1.00 0.00 H new ATOM 0 HB3 LYS A 48 5.727 -3.998 -5.658 1.00 0.00 H new ATOM 0 HG2 LYS A 48 8.095 -4.081 -6.147 1.00 0.00 H new ATOM 0 HG3 LYS A 48 7.874 -3.329 -4.580 1.00 0.00 H new ATOM 0 HD2 LYS A 48 8.460 -5.461 -3.447 1.00 0.00 H new ATOM 0 HD3 LYS A 48 8.619 -6.262 -4.998 1.00 0.00 H new ATOM 0 HE2 LYS A 48 10.851 -5.718 -4.458 1.00 0.00 H new ATOM 0 HE3 LYS A 48 10.392 -4.439 -5.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 11.416 -3.334 -3.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 9.771 -3.152 -3.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 10.708 -4.306 -2.630 1.00 0.00 H new ATOM 772 N GLN A 49 6.755 -3.491 -2.022 1.00 0.00 N ATOM 773 CA GLN A 49 7.069 -2.256 -1.292 1.00 0.00 C ATOM 774 C GLN A 49 7.854 -1.275 -2.183 1.00 0.00 C ATOM 775 O GLN A 49 8.871 -1.652 -2.772 1.00 0.00 O ATOM 776 CB GLN A 49 7.821 -2.619 0.001 1.00 0.00 C ATOM 777 CG GLN A 49 7.899 -1.448 0.997 1.00 0.00 C ATOM 778 CD GLN A 49 8.759 -1.780 2.215 1.00 0.00 C ATOM 779 OE1 GLN A 49 9.823 -1.216 2.436 1.00 0.00 O ATOM 780 NE2 GLN A 49 8.328 -2.680 3.073 1.00 0.00 N ATOM 0 H GLN A 49 7.395 -4.256 -1.807 1.00 0.00 H new ATOM 0 HA GLN A 49 6.149 -1.740 -1.016 1.00 0.00 H new ATOM 0 HB2 GLN A 49 7.325 -3.464 0.479 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.831 -2.943 -0.251 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.309 -0.572 0.494 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.893 -1.186 1.326 1.00 0.00 H new ATOM 0 HE21 GLN A 49 7.444 -3.161 2.907 1.00 0.00 H new ATOM 0 HE22 GLN A 49 8.878 -2.897 3.904 1.00 0.00 H new ATOM 789 N LEU A 50 7.361 -0.041 -2.318 1.00 0.00 N ATOM 790 CA LEU A 50 7.873 0.976 -3.246 1.00 0.00 C ATOM 791 C LEU A 50 9.060 1.742 -2.641 1.00 0.00 C ATOM 792 O LEU A 50 8.984 2.255 -1.522 1.00 0.00 O ATOM 793 CB LEU A 50 6.728 1.928 -3.649 1.00 0.00 C ATOM 794 CG LEU A 50 5.759 1.410 -4.736 1.00 0.00 C ATOM 795 CD1 LEU A 50 5.487 -0.088 -4.730 1.00 0.00 C ATOM 796 CD2 LEU A 50 4.420 2.143 -4.681 1.00 0.00 C ATOM 0 H LEU A 50 6.569 0.290 -1.767 1.00 0.00 H new ATOM 0 HA LEU A 50 8.246 0.480 -4.142 1.00 0.00 H new ATOM 0 HB2 LEU A 50 6.148 2.163 -2.757 1.00 0.00 H new ATOM 0 HB3 LEU A 50 7.167 2.863 -3.999 1.00 0.00 H new ATOM 0 HG LEU A 50 6.293 1.621 -5.663 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.795 -0.335 -5.535 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.422 -0.628 -4.877 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.049 -0.374 -3.774 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.761 1.756 -5.458 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.960 1.988 -3.705 1.00 0.00 H new ATOM 0 HD23 LEU A 50 4.582 3.209 -4.841 1.00 0.00 H new ATOM 808 N GLU A 51 10.162 1.813 -3.387 1.00 0.00 N ATOM 809 CA GLU A 51 11.416 2.460 -2.966 1.00 0.00 C ATOM 810 C GLU A 51 11.439 3.955 -3.343 1.00 0.00 C ATOM 811 O GLU A 51 10.973 4.363 -4.403 1.00 0.00 O ATOM 812 CB GLU A 51 12.586 1.674 -3.575 1.00 0.00 C ATOM 813 CG GLU A 51 13.990 2.209 -3.266 1.00 0.00 C ATOM 814 CD GLU A 51 15.077 1.260 -3.814 1.00 0.00 C ATOM 815 OE1 GLU A 51 15.025 0.886 -5.013 1.00 0.00 O ATOM 816 OE2 GLU A 51 15.998 0.882 -3.049 1.00 0.00 O ATOM 0 H GLU A 51 10.214 1.414 -4.324 1.00 0.00 H new ATOM 0 HA GLU A 51 11.504 2.439 -1.880 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.527 0.643 -3.225 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.458 1.651 -4.657 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.111 3.199 -3.706 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.111 2.322 -2.189 1.00 0.00 H new ATOM 823 N ASP A 52 12.016 4.785 -2.475 1.00 0.00 N ATOM 824 CA ASP A 52 11.955 6.260 -2.521 1.00 0.00 C ATOM 825 C ASP A 52 12.505 6.906 -3.802 1.00 0.00 C ATOM 826 O ASP A 52 11.925 7.872 -4.305 1.00 0.00 O ATOM 827 CB ASP A 52 12.686 6.838 -1.302 1.00 0.00 C ATOM 828 CG ASP A 52 11.948 6.509 -0.001 1.00 0.00 C ATOM 829 OD1 ASP A 52 10.988 7.236 0.341 1.00 0.00 O ATOM 830 OD2 ASP A 52 12.295 5.506 0.666 1.00 0.00 O ATOM 0 H ASP A 52 12.563 4.442 -1.685 1.00 0.00 H new ATOM 0 HA ASP A 52 10.893 6.504 -2.511 1.00 0.00 H new ATOM 0 HB2 ASP A 52 13.699 6.437 -1.259 1.00 0.00 H new ATOM 0 HB3 ASP A 52 12.775 7.919 -1.408 1.00 0.00 H new ATOM 835 N GLY A 53 13.608 6.376 -4.339 1.00 0.00 N ATOM 836 CA GLY A 53 14.281 6.905 -5.532 1.00 0.00 C ATOM 837 C GLY A 53 13.628 6.516 -6.866 1.00 0.00 C ATOM 838 O GLY A 53 14.086 6.960 -7.923 1.00 0.00 O ATOM 0 H GLY A 53 14.068 5.552 -3.951 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.312 7.992 -5.462 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.314 6.556 -5.534 1.00 0.00 H new ATOM 842 N ARG A 54 12.581 5.678 -6.842 1.00 0.00 N ATOM 843 CA ARG A 54 11.837 5.217 -8.026 1.00 0.00 C ATOM 844 C ARG A 54 10.830 6.257 -8.493 1.00 0.00 C ATOM 845 O ARG A 54 10.465 7.158 -7.741 1.00 0.00 O ATOM 846 CB ARG A 54 11.049 3.942 -7.683 1.00 0.00 C ATOM 847 CG ARG A 54 11.898 2.828 -7.077 1.00 0.00 C ATOM 848 CD ARG A 54 12.915 2.265 -8.055 1.00 0.00 C ATOM 849 NE ARG A 54 13.603 1.119 -7.451 1.00 0.00 N ATOM 850 CZ ARG A 54 13.419 -0.164 -7.677 1.00 0.00 C ATOM 851 NH1 ARG A 54 12.640 -0.631 -8.614 1.00 0.00 N ATOM 852 NH2 ARG A 54 14.047 -1.001 -6.906 1.00 0.00 N ATOM 0 H ARG A 54 12.217 5.290 -5.972 1.00 0.00 H new ATOM 0 HA ARG A 54 12.568 5.034 -8.813 1.00 0.00 H new ATOM 0 HB2 ARG A 54 10.252 4.197 -6.985 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.572 3.568 -8.589 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.418 3.211 -6.199 1.00 0.00 H new ATOM 0 HG3 ARG A 54 11.245 2.024 -6.736 1.00 0.00 H new ATOM 0 HD2 ARG A 54 12.417 1.959 -8.975 1.00 0.00 H new ATOM 0 HD3 ARG A 54 13.638 3.034 -8.325 1.00 0.00 H new ATOM 0 HE ARG A 54 14.321 1.347 -6.763 1.00 0.00 H new ATOM 0 HH11 ARG A 54 12.132 0.011 -9.222 1.00 0.00 H new ATOM 0 HH12 ARG A 54 12.540 -1.638 -8.739 1.00 0.00 H new ATOM 0 HH21 ARG A 54 14.653 -0.654 -6.162 1.00 0.00 H new ATOM 0 HH22 ARG A 54 13.934 -2.005 -7.045 1.00 0.00 H new ATOM 866 N THR A 55 10.322 6.069 -9.705 1.00 0.00 N ATOM 867 CA THR A 55 9.183 6.809 -10.260 1.00 0.00 C ATOM 868 C THR A 55 7.902 5.979 -10.198 1.00 0.00 C ATOM 869 O THR A 55 7.908 4.784 -9.897 1.00 0.00 O ATOM 870 CB THR A 55 9.421 7.227 -11.719 1.00 0.00 C ATOM 871 OG1 THR A 55 9.696 6.083 -12.495 1.00 0.00 O ATOM 872 CG2 THR A 55 10.584 8.204 -11.873 1.00 0.00 C ATOM 0 H THR A 55 10.699 5.377 -10.353 1.00 0.00 H new ATOM 0 HA THR A 55 9.076 7.704 -9.647 1.00 0.00 H new ATOM 0 HB THR A 55 8.514 7.729 -12.056 1.00 0.00 H new ATOM 0 HG1 THR A 55 9.164 6.110 -13.318 1.00 0.00 H new ATOM 0 HG21 THR A 55 10.704 8.463 -12.925 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.379 9.107 -11.298 1.00 0.00 H new ATOM 0 HG23 THR A 55 11.500 7.740 -11.507 1.00 0.00 H new ATOM 880 N LEU A 56 6.782 6.617 -10.521 1.00 0.00 N ATOM 881 CA LEU A 56 5.483 5.981 -10.744 1.00 0.00 C ATOM 882 C LEU A 56 5.550 5.029 -11.955 1.00 0.00 C ATOM 883 O LEU A 56 5.160 3.862 -11.865 1.00 0.00 O ATOM 884 CB LEU A 56 4.474 7.134 -10.892 1.00 0.00 C ATOM 885 CG LEU A 56 4.250 7.850 -9.542 1.00 0.00 C ATOM 886 CD1 LEU A 56 3.765 9.270 -9.762 1.00 0.00 C ATOM 887 CD2 LEU A 56 3.213 7.118 -8.706 1.00 0.00 C ATOM 0 H LEU A 56 6.750 7.630 -10.640 1.00 0.00 H new ATOM 0 HA LEU A 56 5.171 5.340 -9.919 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.838 7.848 -11.630 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.526 6.747 -11.264 1.00 0.00 H new ATOM 0 HG LEU A 56 5.206 7.860 -9.019 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.614 9.756 -8.798 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.509 9.824 -10.335 1.00 0.00 H new ATOM 0 HD13 LEU A 56 2.824 9.252 -10.311 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.073 7.641 -7.760 1.00 0.00 H new ATOM 0 HD22 LEU A 56 2.267 7.085 -9.246 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.555 6.101 -8.511 1.00 0.00 H new ATOM 899 N SER A 57 6.129 5.486 -13.066 1.00 0.00 N ATOM 900 CA SER A 57 6.385 4.686 -14.271 1.00 0.00 C ATOM 901 C SER A 57 7.248 3.437 -14.026 1.00 0.00 C ATOM 902 O SER A 57 7.070 2.437 -14.722 1.00 0.00 O ATOM 903 CB SER A 57 7.008 5.554 -15.373 1.00 0.00 C ATOM 904 OG SER A 57 8.089 6.346 -14.908 1.00 0.00 O ATOM 0 H SER A 57 6.443 6.452 -13.158 1.00 0.00 H new ATOM 0 HA SER A 57 5.410 4.320 -14.593 1.00 0.00 H new ATOM 0 HB2 SER A 57 7.357 4.911 -16.181 1.00 0.00 H new ATOM 0 HB3 SER A 57 6.241 6.205 -15.792 1.00 0.00 H new ATOM 0 HG SER A 57 7.741 7.162 -14.491 1.00 0.00 H new ATOM 910 N ASP A 58 8.110 3.428 -13.004 1.00 0.00 N ATOM 911 CA ASP A 58 8.910 2.260 -12.600 1.00 0.00 C ATOM 912 C ASP A 58 8.054 1.048 -12.202 1.00 0.00 C ATOM 913 O ASP A 58 8.394 -0.093 -12.526 1.00 0.00 O ATOM 914 CB ASP A 58 9.804 2.631 -11.415 1.00 0.00 C ATOM 915 CG ASP A 58 11.021 1.695 -11.325 1.00 0.00 C ATOM 916 OD1 ASP A 58 11.997 1.903 -12.083 1.00 0.00 O ATOM 917 OD2 ASP A 58 11.020 0.761 -10.487 1.00 0.00 O ATOM 0 H ASP A 58 8.277 4.248 -12.421 1.00 0.00 H new ATOM 0 HA ASP A 58 9.502 1.977 -13.470 1.00 0.00 H new ATOM 0 HB2 ASP A 58 10.141 3.662 -11.519 1.00 0.00 H new ATOM 0 HB3 ASP A 58 9.229 2.575 -10.490 1.00 0.00 H new ATOM 922 N TYR A 59 6.919 1.304 -11.541 1.00 0.00 N ATOM 923 CA TYR A 59 5.940 0.287 -11.138 1.00 0.00 C ATOM 924 C TYR A 59 4.759 0.207 -12.125 1.00 0.00 C ATOM 925 O TYR A 59 3.725 -0.391 -11.824 1.00 0.00 O ATOM 926 CB TYR A 59 5.520 0.540 -9.682 1.00 0.00 C ATOM 927 CG TYR A 59 6.664 0.402 -8.692 1.00 0.00 C ATOM 928 CD1 TYR A 59 7.094 -0.877 -8.285 1.00 0.00 C ATOM 929 CD2 TYR A 59 7.313 1.548 -8.196 1.00 0.00 C ATOM 930 CE1 TYR A 59 8.173 -1.009 -7.388 1.00 0.00 C ATOM 931 CE2 TYR A 59 8.382 1.419 -7.289 1.00 0.00 C ATOM 932 CZ TYR A 59 8.819 0.140 -6.884 1.00 0.00 C ATOM 933 OH TYR A 59 9.846 0.022 -5.998 1.00 0.00 O ATOM 0 H TYR A 59 6.649 2.248 -11.264 1.00 0.00 H new ATOM 0 HA TYR A 59 6.397 -0.702 -11.178 1.00 0.00 H new ATOM 0 HB2 TYR A 59 5.099 1.542 -9.602 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.730 -0.160 -9.413 1.00 0.00 H new ATOM 0 HD1 TYR A 59 6.595 -1.758 -8.661 1.00 0.00 H new ATOM 0 HD2 TYR A 59 6.990 2.529 -8.512 1.00 0.00 H new ATOM 0 HE1 TYR A 59 8.506 -1.991 -7.086 1.00 0.00 H new ATOM 0 HE2 TYR A 59 8.869 2.302 -6.902 1.00 0.00 H new ATOM 0 HH TYR A 59 10.671 -0.197 -6.480 1.00 0.00 H new ATOM 943 N ASN A 60 4.916 0.800 -13.318 1.00 0.00 N ATOM 944 CA ASN A 60 3.924 0.906 -14.397 1.00 0.00 C ATOM 945 C ASN A 60 2.618 1.605 -13.961 1.00 0.00 C ATOM 946 O ASN A 60 1.557 1.375 -14.548 1.00 0.00 O ATOM 947 CB ASN A 60 3.713 -0.472 -15.061 1.00 0.00 C ATOM 948 CG ASN A 60 4.990 -1.036 -15.663 1.00 0.00 C ATOM 949 OD1 ASN A 60 5.475 -0.579 -16.690 1.00 0.00 O ATOM 950 ND2 ASN A 60 5.574 -2.049 -15.062 1.00 0.00 N ATOM 0 H ASN A 60 5.797 1.247 -13.571 1.00 0.00 H new ATOM 0 HA ASN A 60 4.324 1.573 -15.161 1.00 0.00 H new ATOM 0 HB2 ASN A 60 3.326 -1.172 -14.321 1.00 0.00 H new ATOM 0 HB3 ASN A 60 2.957 -0.383 -15.841 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.427 -2.450 -15.452 1.00 0.00 H new ATOM 0 HD22 ASN A 60 5.174 -2.434 -14.206 1.00 0.00 H new ATOM 957 N ILE A 61 2.690 2.474 -12.945 1.00 0.00 N ATOM 958 CA ILE A 61 1.566 3.252 -12.409 1.00 0.00 C ATOM 959 C ILE A 61 0.942 4.106 -13.530 1.00 0.00 C ATOM 960 O ILE A 61 1.630 4.915 -14.159 1.00 0.00 O ATOM 961 CB ILE A 61 2.036 4.142 -11.244 1.00 0.00 C ATOM 962 CG1 ILE A 61 2.650 3.351 -10.064 1.00 0.00 C ATOM 963 CG2 ILE A 61 0.883 5.057 -10.784 1.00 0.00 C ATOM 964 CD1 ILE A 61 1.675 2.902 -8.981 1.00 0.00 C ATOM 0 H ILE A 61 3.565 2.662 -12.456 1.00 0.00 H new ATOM 0 HA ILE A 61 0.809 2.567 -12.027 1.00 0.00 H new ATOM 0 HB ILE A 61 2.852 4.758 -11.622 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.149 2.468 -10.465 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.419 3.968 -9.600 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.223 5.684 -9.960 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.567 5.689 -11.614 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.043 4.446 -10.453 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.216 2.358 -8.207 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.192 3.775 -8.541 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.918 2.252 -9.420 1.00 0.00 H new ATOM 976 N GLN A 62 -0.357 3.927 -13.778 1.00 0.00 N ATOM 977 CA GLN A 62 -1.154 4.737 -14.712 1.00 0.00 C ATOM 978 C GLN A 62 -1.902 5.856 -13.968 1.00 0.00 C ATOM 979 O GLN A 62 -1.904 5.895 -12.732 1.00 0.00 O ATOM 980 CB GLN A 62 -2.152 3.825 -15.456 1.00 0.00 C ATOM 981 CG GLN A 62 -1.510 2.633 -16.189 1.00 0.00 C ATOM 982 CD GLN A 62 -0.447 3.057 -17.202 1.00 0.00 C ATOM 983 OE1 GLN A 62 -0.718 3.736 -18.185 1.00 0.00 O ATOM 984 NE2 GLN A 62 0.796 2.673 -17.010 1.00 0.00 N ATOM 0 H GLN A 62 -0.902 3.195 -13.324 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.484 5.206 -15.433 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -2.880 3.444 -14.739 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.702 4.426 -16.180 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -1.059 1.963 -15.457 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -2.288 2.067 -16.702 1.00 0.00 H new ATOM 0 HE21 GLN A 62 1.035 2.107 -16.196 1.00 0.00 H new ATOM 0 HE22 GLN A 62 1.521 2.941 -17.676 1.00 0.00 H new ATOM 993 N LYS A 63 -2.585 6.752 -14.696 1.00 0.00 N ATOM 994 CA LYS A 63 -3.500 7.713 -14.057 1.00 0.00 C ATOM 995 C LYS A 63 -4.636 6.995 -13.310 1.00 0.00 C ATOM 996 O LYS A 63 -4.953 5.842 -13.598 1.00 0.00 O ATOM 997 CB LYS A 63 -3.977 8.804 -15.045 1.00 0.00 C ATOM 998 CG LYS A 63 -5.365 8.639 -15.690 1.00 0.00 C ATOM 999 CD LYS A 63 -5.558 7.399 -16.571 1.00 0.00 C ATOM 1000 CE LYS A 63 -4.838 7.540 -17.919 1.00 0.00 C ATOM 1001 NZ LYS A 63 -5.109 6.380 -18.809 1.00 0.00 N ATOM 0 H LYS A 63 -2.524 6.832 -15.711 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.944 8.254 -13.291 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.965 9.759 -14.519 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -3.242 8.872 -15.847 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.111 8.615 -14.896 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -5.570 9.523 -16.293 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -5.182 6.520 -16.048 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.622 7.237 -16.742 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -5.160 8.459 -18.410 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -3.765 7.628 -17.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -4.607 6.509 -19.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -4.779 5.507 -18.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -6.131 6.312 -18.989 1.00 0.00 H new ATOM 1015 N GLU A 64 -5.244 7.697 -12.361 1.00 0.00 N ATOM 1016 CA GLU A 64 -6.322 7.269 -11.458 1.00 0.00 C ATOM 1017 C GLU A 64 -6.080 5.927 -10.726 1.00 0.00 C ATOM 1018 O GLU A 64 -7.024 5.308 -10.229 1.00 0.00 O ATOM 1019 CB GLU A 64 -7.695 7.409 -12.151 1.00 0.00 C ATOM 1020 CG GLU A 64 -7.946 6.448 -13.318 1.00 0.00 C ATOM 1021 CD GLU A 64 -9.418 6.497 -13.771 1.00 0.00 C ATOM 1022 OE1 GLU A 64 -9.785 7.395 -14.569 1.00 0.00 O ATOM 1023 OE2 GLU A 64 -10.222 5.630 -13.345 1.00 0.00 O ATOM 0 H GLU A 64 -4.977 8.665 -12.183 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.323 7.961 -10.616 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -8.476 7.259 -11.405 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -7.795 8.431 -12.517 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.296 6.708 -14.154 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.688 5.432 -13.018 1.00 0.00 H new ATOM 1030 N SER A 65 -4.817 5.487 -10.616 1.00 0.00 N ATOM 1031 CA SER A 65 -4.432 4.275 -9.879 1.00 0.00 C ATOM 1032 C SER A 65 -4.739 4.402 -8.383 1.00 0.00 C ATOM 1033 O SER A 65 -4.629 5.486 -7.810 1.00 0.00 O ATOM 1034 CB SER A 65 -2.936 3.978 -10.050 1.00 0.00 C ATOM 1035 OG SER A 65 -2.631 3.633 -11.389 1.00 0.00 O ATOM 0 H SER A 65 -4.025 5.969 -11.042 1.00 0.00 H new ATOM 0 HA SER A 65 -5.019 3.457 -10.295 1.00 0.00 H new ATOM 0 HB2 SER A 65 -2.354 4.851 -9.755 1.00 0.00 H new ATOM 0 HB3 SER A 65 -2.647 3.163 -9.387 1.00 0.00 H new ATOM 0 HG SER A 65 -2.370 4.438 -11.883 1.00 0.00 H new ATOM 1041 N THR A 66 -5.070 3.285 -7.735 1.00 0.00 N ATOM 1042 CA THR A 66 -5.500 3.210 -6.325 1.00 0.00 C ATOM 1043 C THR A 66 -4.489 2.436 -5.479 1.00 0.00 C ATOM 1044 O THR A 66 -4.560 1.211 -5.354 1.00 0.00 O ATOM 1045 CB THR A 66 -6.924 2.635 -6.192 1.00 0.00 C ATOM 1046 OG1 THR A 66 -7.073 1.427 -6.917 1.00 0.00 O ATOM 1047 CG2 THR A 66 -7.978 3.610 -6.723 1.00 0.00 C ATOM 0 H THR A 66 -5.048 2.371 -8.187 1.00 0.00 H new ATOM 0 HA THR A 66 -5.535 4.228 -5.937 1.00 0.00 H new ATOM 0 HB THR A 66 -7.071 2.458 -5.127 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.326 0.827 -6.711 1.00 0.00 H new ATOM 0 HG21 THR A 66 -8.969 3.170 -6.613 1.00 0.00 H new ATOM 0 HG22 THR A 66 -7.929 4.541 -6.159 1.00 0.00 H new ATOM 0 HG23 THR A 66 -7.787 3.814 -7.777 1.00 0.00 H new ATOM 1055 N LEU A 67 -3.505 3.158 -4.936 1.00 0.00 N ATOM 1056 CA LEU A 67 -2.383 2.617 -4.163 1.00 0.00 C ATOM 1057 C LEU A 67 -2.660 2.680 -2.651 1.00 0.00 C ATOM 1058 O LEU A 67 -3.697 3.187 -2.220 1.00 0.00 O ATOM 1059 CB LEU A 67 -1.081 3.361 -4.554 1.00 0.00 C ATOM 1060 CG LEU A 67 -0.648 3.298 -6.037 1.00 0.00 C ATOM 1061 CD1 LEU A 67 -1.020 1.978 -6.707 1.00 0.00 C ATOM 1062 CD2 LEU A 67 -1.197 4.438 -6.894 1.00 0.00 C ATOM 0 H LEU A 67 -3.466 4.173 -5.026 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.258 1.561 -4.404 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.196 4.410 -4.280 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.268 2.961 -3.948 1.00 0.00 H new ATOM 0 HG LEU A 67 0.437 3.394 -5.987 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.691 1.992 -7.746 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.534 1.155 -6.184 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.101 1.843 -6.670 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.848 4.322 -7.920 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.287 4.414 -6.876 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.848 5.392 -6.498 1.00 0.00 H new ATOM 1074 N HIS A 68 -1.728 2.186 -1.834 1.00 0.00 N ATOM 1075 CA HIS A 68 -1.817 2.207 -0.368 1.00 0.00 C ATOM 1076 C HIS A 68 -0.582 2.856 0.267 1.00 0.00 C ATOM 1077 O HIS A 68 0.513 2.788 -0.299 1.00 0.00 O ATOM 1078 CB HIS A 68 -1.997 0.778 0.164 1.00 0.00 C ATOM 1079 CG HIS A 68 -3.259 0.100 -0.306 1.00 0.00 C ATOM 1080 ND1 HIS A 68 -4.442 -0.004 0.396 1.00 0.00 N ATOM 1081 CD2 HIS A 68 -3.423 -0.547 -1.500 1.00 0.00 C ATOM 1082 CE1 HIS A 68 -5.306 -0.701 -0.366 1.00 0.00 C ATOM 1083 NE2 HIS A 68 -4.730 -1.039 -1.532 1.00 0.00 N ATOM 0 H HIS A 68 -0.872 1.751 -2.177 1.00 0.00 H new ATOM 0 HA HIS A 68 -2.683 2.810 -0.094 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -1.140 0.178 -0.141 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -1.996 0.805 1.254 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -4.628 0.378 1.323 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -2.679 -0.657 -2.275 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -6.317 -0.952 -0.081 1.00 0.00 H new ATOM 1091 N LEU A 69 -0.748 3.428 1.467 1.00 0.00 N ATOM 1092 CA LEU A 69 0.340 3.904 2.315 1.00 0.00 C ATOM 1093 C LEU A 69 0.380 3.165 3.663 1.00 0.00 C ATOM 1094 O LEU A 69 -0.648 2.755 4.208 1.00 0.00 O ATOM 1095 CB LEU A 69 0.308 5.436 2.476 1.00 0.00 C ATOM 1096 CG LEU A 69 -0.859 6.002 3.313 1.00 0.00 C ATOM 1097 CD1 LEU A 69 -0.378 7.234 4.067 1.00 0.00 C ATOM 1098 CD2 LEU A 69 -2.052 6.400 2.443 1.00 0.00 C ATOM 0 H LEU A 69 -1.669 3.574 1.881 1.00 0.00 H new ATOM 0 HA LEU A 69 1.276 3.667 1.809 1.00 0.00 H new ATOM 0 HB2 LEU A 69 1.245 5.753 2.933 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.269 5.885 1.484 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.184 5.219 3.999 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.197 7.640 4.661 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.446 6.959 4.725 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.038 7.986 3.355 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.848 6.793 3.075 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.744 7.165 1.731 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.416 5.526 1.902 1.00 0.00 H new ATOM 1110 N VAL A 70 1.590 3.008 4.193 1.00 0.00 N ATOM 1111 CA VAL A 70 1.920 2.336 5.458 1.00 0.00 C ATOM 1112 C VAL A 70 2.855 3.227 6.272 1.00 0.00 C ATOM 1113 O VAL A 70 3.955 3.551 5.833 1.00 0.00 O ATOM 1114 CB VAL A 70 2.452 0.897 5.229 1.00 0.00 C ATOM 1115 CG1 VAL A 70 3.008 0.610 3.822 1.00 0.00 C ATOM 1116 CG2 VAL A 70 3.486 0.439 6.275 1.00 0.00 C ATOM 0 H VAL A 70 2.422 3.367 3.725 1.00 0.00 H new ATOM 0 HA VAL A 70 1.014 2.196 6.047 1.00 0.00 H new ATOM 0 HB VAL A 70 1.541 0.310 5.344 1.00 0.00 H new ATOM 0 HG11 VAL A 70 3.353 -0.423 3.771 1.00 0.00 H new ATOM 0 HG12 VAL A 70 2.224 0.768 3.082 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.842 1.281 3.616 1.00 0.00 H new ATOM 0 HG21 VAL A 70 3.810 -0.576 6.046 1.00 0.00 H new ATOM 0 HG22 VAL A 70 4.347 1.108 6.253 1.00 0.00 H new ATOM 0 HG23 VAL A 70 3.035 0.461 7.267 1.00 0.00 H new ATOM 1126 N LEU A 71 2.404 3.666 7.446 1.00 0.00 N ATOM 1127 CA LEU A 71 3.191 4.476 8.379 1.00 0.00 C ATOM 1128 C LEU A 71 3.959 3.606 9.382 1.00 0.00 C ATOM 1129 O LEU A 71 3.373 2.720 10.009 1.00 0.00 O ATOM 1130 CB LEU A 71 2.245 5.436 9.108 1.00 0.00 C ATOM 1131 CG LEU A 71 2.035 6.747 8.327 1.00 0.00 C ATOM 1132 CD1 LEU A 71 0.782 7.442 8.829 1.00 0.00 C ATOM 1133 CD2 LEU A 71 3.234 7.675 8.489 1.00 0.00 C ATOM 0 H LEU A 71 1.463 3.465 7.783 1.00 0.00 H new ATOM 0 HA LEU A 71 3.937 5.039 7.817 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.282 4.948 9.262 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.649 5.663 10.095 1.00 0.00 H new ATOM 0 HG LEU A 71 1.926 6.506 7.270 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.634 8.370 8.276 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -0.079 6.790 8.682 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.890 7.666 9.890 1.00 0.00 H new ATOM 0 HD21 LEU A 71 3.061 8.594 7.928 1.00 0.00 H new ATOM 0 HD22 LEU A 71 3.369 7.914 9.544 1.00 0.00 H new ATOM 0 HD23 LEU A 71 4.129 7.182 8.111 1.00 0.00 H new ATOM 1145 N ARG A 72 5.247 3.909 9.600 1.00 0.00 N ATOM 1146 CA ARG A 72 6.126 3.182 10.541 1.00 0.00 C ATOM 1147 C ARG A 72 5.636 3.137 11.999 1.00 0.00 C ATOM 1148 O ARG A 72 6.025 2.243 12.749 1.00 0.00 O ATOM 1149 CB ARG A 72 7.576 3.706 10.430 1.00 0.00 C ATOM 1150 CG ARG A 72 7.793 5.122 10.997 1.00 0.00 C ATOM 1151 CD ARG A 72 9.251 5.582 10.812 1.00 0.00 C ATOM 1152 NE ARG A 72 9.569 6.789 11.599 1.00 0.00 N ATOM 1153 CZ ARG A 72 9.845 6.891 12.886 1.00 0.00 C ATOM 1154 NH1 ARG A 72 9.890 5.861 13.683 1.00 0.00 N ATOM 1155 NH2 ARG A 72 10.078 8.066 13.391 1.00 0.00 N ATOM 0 H ARG A 72 5.719 4.677 9.123 1.00 0.00 H new ATOM 0 HA ARG A 72 6.093 2.138 10.229 1.00 0.00 H new ATOM 0 HB2 ARG A 72 8.239 3.015 10.951 1.00 0.00 H new ATOM 0 HB3 ARG A 72 7.871 3.700 9.381 1.00 0.00 H new ATOM 0 HG2 ARG A 72 7.123 5.822 10.499 1.00 0.00 H new ATOM 0 HG3 ARG A 72 7.537 5.135 12.056 1.00 0.00 H new ATOM 0 HD2 ARG A 72 9.923 4.775 11.104 1.00 0.00 H new ATOM 0 HD3 ARG A 72 9.434 5.782 9.756 1.00 0.00 H new ATOM 0 HE ARG A 72 9.577 7.665 11.077 1.00 0.00 H new ATOM 0 HH11 ARG A 72 9.708 4.926 13.319 1.00 0.00 H new ATOM 0 HH12 ARG A 72 10.108 5.990 14.671 1.00 0.00 H new ATOM 0 HH21 ARG A 72 10.046 8.893 12.795 1.00 0.00 H new ATOM 0 HH22 ARG A 72 10.293 8.161 14.384 1.00 0.00 H new ATOM 1366 N PRO B 328 -11.082 -16.907 10.377 1.00 0.00 N ATOM 1367 CA PRO B 328 -10.196 -15.787 10.039 1.00 0.00 C ATOM 1368 C PRO B 328 -10.565 -15.104 8.711 1.00 0.00 C ATOM 1369 O PRO B 328 -10.396 -13.894 8.571 1.00 0.00 O ATOM 1370 CB PRO B 328 -8.787 -16.388 10.005 1.00 0.00 C ATOM 1371 CG PRO B 328 -9.034 -17.856 9.662 1.00 0.00 C ATOM 1372 CD PRO B 328 -10.339 -18.158 10.385 1.00 0.00 C ATOM 0 HA PRO B 328 -10.281 -14.988 10.775 1.00 0.00 H new ATOM 0 HB2 PRO B 328 -8.161 -15.901 9.257 1.00 0.00 H new ATOM 0 HB3 PRO B 328 -8.281 -16.280 10.964 1.00 0.00 H new ATOM 0 HG2 PRO B 328 -9.123 -18.010 8.587 1.00 0.00 H new ATOM 0 HG3 PRO B 328 -8.222 -18.495 10.010 1.00 0.00 H new ATOM 0 HD2 PRO B 328 -10.894 -18.948 9.880 1.00 0.00 H new ATOM 0 HD3 PRO B 328 -10.154 -18.499 11.404 1.00 0.00 H new ATOM 1380 N GLU B 329 -11.130 -15.855 7.758 1.00 0.00 N ATOM 1381 CA GLU B 329 -11.602 -15.355 6.453 1.00 0.00 C ATOM 1382 C GLU B 329 -12.739 -14.315 6.538 1.00 0.00 C ATOM 1383 O GLU B 329 -12.984 -13.580 5.581 1.00 0.00 O ATOM 1384 CB GLU B 329 -12.012 -16.539 5.560 1.00 0.00 C ATOM 1385 CG GLU B 329 -13.239 -17.312 6.064 1.00 0.00 C ATOM 1386 CD GLU B 329 -13.571 -18.487 5.123 1.00 0.00 C ATOM 1387 OE1 GLU B 329 -13.020 -19.598 5.313 1.00 0.00 O ATOM 1388 OE2 GLU B 329 -14.390 -18.310 4.188 1.00 0.00 O ATOM 0 H GLU B 329 -11.278 -16.858 7.873 1.00 0.00 H new ATOM 0 HA GLU B 329 -10.761 -14.820 6.011 1.00 0.00 H new ATOM 0 HB2 GLU B 329 -12.217 -16.168 4.556 1.00 0.00 H new ATOM 0 HB3 GLU B 329 -11.171 -17.227 5.480 1.00 0.00 H new ATOM 0 HG2 GLU B 329 -13.050 -17.688 7.069 1.00 0.00 H new ATOM 0 HG3 GLU B 329 -14.095 -16.641 6.131 1.00 0.00 H new ATOM 1395 N GLU B 330 -13.418 -14.231 7.687 1.00 0.00 N ATOM 1396 CA GLU B 330 -14.498 -13.276 7.980 1.00 0.00 C ATOM 1397 C GLU B 330 -14.151 -12.317 9.134 1.00 0.00 C ATOM 1398 O GLU B 330 -14.506 -11.136 9.078 1.00 0.00 O ATOM 1399 CB GLU B 330 -15.827 -14.024 8.202 1.00 0.00 C ATOM 1400 CG GLU B 330 -15.767 -15.088 9.311 1.00 0.00 C ATOM 1401 CD GLU B 330 -17.115 -15.772 9.607 1.00 0.00 C ATOM 1402 OE1 GLU B 330 -18.021 -15.801 8.737 1.00 0.00 O ATOM 1403 OE2 GLU B 330 -17.259 -16.313 10.730 1.00 0.00 O ATOM 0 H GLU B 330 -13.224 -14.852 8.473 1.00 0.00 H new ATOM 0 HA GLU B 330 -14.620 -12.633 7.108 1.00 0.00 H new ATOM 0 HB2 GLU B 330 -16.603 -13.300 8.449 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -16.123 -14.503 7.269 1.00 0.00 H new ATOM 0 HG2 GLU B 330 -15.041 -15.850 9.028 1.00 0.00 H new ATOM 0 HG3 GLU B 330 -15.401 -14.622 10.226 1.00 0.00 H new ATOM 1410 N ARG B 331 -13.375 -12.765 10.134 1.00 0.00 N ATOM 1411 CA ARG B 331 -12.828 -11.927 11.217 1.00 0.00 C ATOM 1412 C ARG B 331 -11.925 -10.800 10.709 1.00 0.00 C ATOM 1413 O ARG B 331 -11.973 -9.689 11.238 1.00 0.00 O ATOM 1414 CB ARG B 331 -12.081 -12.818 12.211 1.00 0.00 C ATOM 1415 CG ARG B 331 -11.718 -12.023 13.473 1.00 0.00 C ATOM 1416 CD ARG B 331 -11.353 -12.921 14.652 1.00 0.00 C ATOM 1417 NE ARG B 331 -10.238 -13.838 14.341 1.00 0.00 N ATOM 1418 CZ ARG B 331 -10.299 -15.137 14.114 1.00 0.00 C ATOM 1419 NH1 ARG B 331 -11.425 -15.794 14.099 1.00 0.00 N ATOM 1420 NH2 ARG B 331 -9.200 -15.800 13.894 1.00 0.00 N ATOM 0 H ARG B 331 -13.103 -13.745 10.215 1.00 0.00 H new ATOM 0 HA ARG B 331 -13.666 -11.436 11.711 1.00 0.00 H new ATOM 0 HB2 ARG B 331 -12.700 -13.674 12.478 1.00 0.00 H new ATOM 0 HB3 ARG B 331 -11.176 -13.211 11.748 1.00 0.00 H new ATOM 0 HG2 ARG B 331 -10.880 -11.362 13.252 1.00 0.00 H new ATOM 0 HG3 ARG B 331 -12.559 -11.389 13.752 1.00 0.00 H new ATOM 0 HD2 ARG B 331 -11.082 -12.301 15.506 1.00 0.00 H new ATOM 0 HD3 ARG B 331 -12.227 -13.503 14.945 1.00 0.00 H new ATOM 0 HE ARG B 331 -9.310 -13.417 14.296 1.00 0.00 H new ATOM 0 HH11 ARG B 331 -12.304 -15.304 14.267 1.00 0.00 H new ATOM 0 HH12 ARG B 331 -11.427 -16.798 13.919 1.00 0.00 H new ATOM 0 HH21 ARG B 331 -8.303 -15.315 13.898 1.00 0.00 H new ATOM 0 HH22 ARG B 331 -9.237 -16.804 13.718 1.00 0.00 H new ATOM 1434 N TYR B 332 -11.128 -11.078 9.677 1.00 0.00 N ATOM 1435 CA TYR B 332 -10.150 -10.154 9.097 1.00 0.00 C ATOM 1436 C TYR B 332 -10.590 -9.615 7.723 1.00 0.00 C ATOM 1437 O TYR B 332 -9.750 -9.195 6.933 1.00 0.00 O ATOM 1438 CB TYR B 332 -8.773 -10.840 9.031 1.00 0.00 C ATOM 1439 CG TYR B 332 -8.281 -11.528 10.297 1.00 0.00 C ATOM 1440 CD1 TYR B 332 -8.381 -10.896 11.555 1.00 0.00 C ATOM 1441 CD2 TYR B 332 -7.694 -12.805 10.206 1.00 0.00 C ATOM 1442 CE1 TYR B 332 -7.933 -11.555 12.719 1.00 0.00 C ATOM 1443 CE2 TYR B 332 -7.237 -13.461 11.365 1.00 0.00 C ATOM 1444 CZ TYR B 332 -7.373 -12.847 12.625 1.00 0.00 C ATOM 1445 OH TYR B 332 -6.999 -13.523 13.747 1.00 0.00 O ATOM 0 H TYR B 332 -11.145 -11.982 9.205 1.00 0.00 H new ATOM 0 HA TYR B 332 -10.079 -9.281 9.745 1.00 0.00 H new ATOM 0 HB2 TYR B 332 -8.802 -11.581 8.232 1.00 0.00 H new ATOM 0 HB3 TYR B 332 -8.035 -10.091 8.744 1.00 0.00 H new ATOM 0 HD1 TYR B 332 -8.802 -9.904 11.627 1.00 0.00 H new ATOM 0 HD2 TYR B 332 -7.594 -13.283 9.243 1.00 0.00 H new ATOM 0 HE1 TYR B 332 -8.018 -11.071 13.681 1.00 0.00 H new ATOM 0 HE2 TYR B 332 -6.781 -14.437 11.288 1.00 0.00 H new ATOM 0 HH TYR B 332 -7.234 -12.997 14.540 1.00 0.00 H new ATOM 1455 N GLU B 333 -11.889 -9.641 7.400 1.00 0.00 N ATOM 1456 CA GLU B 333 -12.438 -9.274 6.081 1.00 0.00 C ATOM 1457 C GLU B 333 -11.912 -7.928 5.542 1.00 0.00 C ATOM 1458 O GLU B 333 -11.438 -7.860 4.408 1.00 0.00 O ATOM 1459 CB GLU B 333 -13.973 -9.296 6.146 1.00 0.00 C ATOM 1460 CG GLU B 333 -14.619 -8.915 4.808 1.00 0.00 C ATOM 1461 CD GLU B 333 -16.137 -9.175 4.828 1.00 0.00 C ATOM 1462 OE1 GLU B 333 -16.900 -8.303 5.314 1.00 0.00 O ATOM 1463 OE2 GLU B 333 -16.583 -10.246 4.348 1.00 0.00 O ATOM 0 H GLU B 333 -12.609 -9.925 8.064 1.00 0.00 H new ATOM 0 HA GLU B 333 -12.089 -10.018 5.365 1.00 0.00 H new ATOM 0 HB2 GLU B 333 -14.308 -10.291 6.438 1.00 0.00 H new ATOM 0 HB3 GLU B 333 -14.311 -8.607 6.919 1.00 0.00 H new ATOM 0 HG2 GLU B 333 -14.430 -7.862 4.597 1.00 0.00 H new ATOM 0 HG3 GLU B 333 -14.160 -9.489 4.003 1.00 0.00 H new ATOM 1470 N HIS B 334 -11.940 -6.872 6.359 1.00 0.00 N ATOM 1471 CA HIS B 334 -11.358 -5.562 6.041 1.00 0.00 C ATOM 1472 C HIS B 334 -9.890 -5.665 5.594 1.00 0.00 C ATOM 1473 O HIS B 334 -9.516 -5.184 4.524 1.00 0.00 O ATOM 1474 CB HIS B 334 -11.469 -4.650 7.271 1.00 0.00 C ATOM 1475 CG HIS B 334 -12.862 -4.125 7.516 1.00 0.00 C ATOM 1476 ND1 HIS B 334 -13.539 -3.214 6.732 1.00 0.00 N ATOM 1477 CD2 HIS B 334 -13.678 -4.457 8.566 1.00 0.00 C ATOM 1478 CE1 HIS B 334 -14.742 -3.002 7.292 1.00 0.00 C ATOM 1479 NE2 HIS B 334 -14.872 -3.737 8.412 1.00 0.00 N ATOM 0 H HIS B 334 -12.377 -6.903 7.280 1.00 0.00 H new ATOM 0 HA HIS B 334 -11.917 -5.142 5.205 1.00 0.00 H new ATOM 0 HB2 HIS B 334 -11.138 -5.201 8.151 1.00 0.00 H new ATOM 0 HB3 HIS B 334 -10.789 -3.807 7.149 1.00 0.00 H new ATOM 0 HD2 HIS B 334 -13.445 -5.146 9.365 1.00 0.00 H new ATOM 0 HE1 HIS B 334 -15.497 -2.337 6.899 1.00 0.00 H new ATOM 0 HE2 HIS B 334 -15.683 -3.765 9.030 1.00 0.00 H new ATOM 1487 N GLN B 335 -9.057 -6.310 6.409 1.00 0.00 N ATOM 1488 CA GLN B 335 -7.635 -6.524 6.145 1.00 0.00 C ATOM 1489 C GLN B 335 -7.394 -7.378 4.894 1.00 0.00 C ATOM 1490 O GLN B 335 -6.517 -7.060 4.094 1.00 0.00 O ATOM 1491 CB GLN B 335 -6.990 -7.180 7.372 1.00 0.00 C ATOM 1492 CG GLN B 335 -7.063 -6.302 8.632 1.00 0.00 C ATOM 1493 CD GLN B 335 -8.156 -6.754 9.599 1.00 0.00 C ATOM 1494 OE1 GLN B 335 -9.341 -6.745 9.297 1.00 0.00 O ATOM 1495 NE2 GLN B 335 -7.802 -7.165 10.796 1.00 0.00 N ATOM 0 H GLN B 335 -9.361 -6.710 7.297 1.00 0.00 H new ATOM 0 HA GLN B 335 -7.178 -5.553 5.954 1.00 0.00 H new ATOM 0 HB2 GLN B 335 -7.484 -8.131 7.570 1.00 0.00 H new ATOM 0 HB3 GLN B 335 -5.946 -7.403 7.151 1.00 0.00 H new ATOM 0 HG2 GLN B 335 -6.100 -6.324 9.142 1.00 0.00 H new ATOM 0 HG3 GLN B 335 -7.246 -5.268 8.340 1.00 0.00 H new ATOM 0 HE21 GLN B 335 -6.817 -7.177 11.060 1.00 0.00 H new ATOM 0 HE22 GLN B 335 -8.512 -7.472 11.461 1.00 0.00 H new ATOM 1504 N LEU B 336 -8.192 -8.428 4.685 1.00 0.00 N ATOM 1505 CA LEU B 336 -8.160 -9.274 3.489 1.00 0.00 C ATOM 1506 C LEU B 336 -8.460 -8.465 2.218 1.00 0.00 C ATOM 1507 O LEU B 336 -7.714 -8.577 1.247 1.00 0.00 O ATOM 1508 CB LEU B 336 -9.128 -10.461 3.673 1.00 0.00 C ATOM 1509 CG LEU B 336 -8.624 -11.490 4.704 1.00 0.00 C ATOM 1510 CD1 LEU B 336 -9.751 -12.406 5.167 1.00 0.00 C ATOM 1511 CD2 LEU B 336 -7.527 -12.373 4.110 1.00 0.00 C ATOM 0 H LEU B 336 -8.897 -8.721 5.361 1.00 0.00 H new ATOM 0 HA LEU B 336 -7.154 -9.673 3.360 1.00 0.00 H new ATOM 0 HB2 LEU B 336 -10.101 -10.085 3.988 1.00 0.00 H new ATOM 0 HB3 LEU B 336 -9.274 -10.957 2.713 1.00 0.00 H new ATOM 0 HG LEU B 336 -8.234 -10.919 5.547 1.00 0.00 H new ATOM 0 HD11 LEU B 336 -9.364 -13.120 5.894 1.00 0.00 H new ATOM 0 HD12 LEU B 336 -10.538 -11.810 5.628 1.00 0.00 H new ATOM 0 HD13 LEU B 336 -10.158 -12.944 4.311 1.00 0.00 H new ATOM 0 HD21 LEU B 336 -7.191 -13.089 4.860 1.00 0.00 H new ATOM 0 HD22 LEU B 336 -7.920 -12.909 3.246 1.00 0.00 H new ATOM 0 HD23 LEU B 336 -6.687 -11.751 3.800 1.00 0.00 H new ATOM 1523 N ARG B 337 -9.480 -7.596 2.231 1.00 0.00 N ATOM 1524 CA ARG B 337 -9.761 -6.628 1.151 1.00 0.00 C ATOM 1525 C ARG B 337 -8.579 -5.687 0.899 1.00 0.00 C ATOM 1526 O ARG B 337 -8.177 -5.534 -0.253 1.00 0.00 O ATOM 1527 CB ARG B 337 -11.047 -5.836 1.461 1.00 0.00 C ATOM 1528 CG ARG B 337 -12.332 -6.397 0.828 1.00 0.00 C ATOM 1529 CD ARG B 337 -12.658 -7.859 1.174 1.00 0.00 C ATOM 1530 NE ARG B 337 -12.097 -8.801 0.182 1.00 0.00 N ATOM 1531 CZ ARG B 337 -12.755 -9.529 -0.703 1.00 0.00 C ATOM 1532 NH1 ARG B 337 -14.056 -9.560 -0.769 1.00 0.00 N ATOM 1533 NH2 ARG B 337 -12.094 -10.248 -1.558 1.00 0.00 N ATOM 0 H ARG B 337 -10.146 -7.541 3.002 1.00 0.00 H new ATOM 0 HA ARG B 337 -9.914 -7.194 0.232 1.00 0.00 H new ATOM 0 HB2 ARG B 337 -11.180 -5.799 2.542 1.00 0.00 H new ATOM 0 HB3 ARG B 337 -10.913 -4.809 1.121 1.00 0.00 H new ATOM 0 HG2 ARG B 337 -13.171 -5.773 1.137 1.00 0.00 H new ATOM 0 HG3 ARG B 337 -12.251 -6.308 -0.255 1.00 0.00 H new ATOM 0 HD2 ARG B 337 -12.262 -8.095 2.162 1.00 0.00 H new ATOM 0 HD3 ARG B 337 -13.739 -7.987 1.225 1.00 0.00 H new ATOM 0 HE ARG B 337 -11.082 -8.901 0.181 1.00 0.00 H new ATOM 0 HH11 ARG B 337 -14.613 -9.006 -0.119 1.00 0.00 H new ATOM 0 HH12 ARG B 337 -14.517 -10.139 -1.471 1.00 0.00 H new ATOM 0 HH21 ARG B 337 -11.074 -10.248 -1.544 1.00 0.00 H new ATOM 0 HH22 ARG B 337 -12.594 -10.813 -2.244 1.00 0.00 H new ATOM 1547 N GLN B 338 -7.987 -5.101 1.947 1.00 0.00 N ATOM 1548 CA GLN B 338 -6.797 -4.243 1.824 1.00 0.00 C ATOM 1549 C GLN B 338 -5.639 -4.999 1.151 1.00 0.00 C ATOM 1550 O GLN B 338 -5.085 -4.512 0.169 1.00 0.00 O ATOM 1551 CB GLN B 338 -6.366 -3.668 3.188 1.00 0.00 C ATOM 1552 CG GLN B 338 -7.412 -2.728 3.815 1.00 0.00 C ATOM 1553 CD GLN B 338 -7.223 -1.269 3.413 1.00 0.00 C ATOM 1554 OE1 GLN B 338 -7.944 -0.709 2.597 1.00 0.00 O ATOM 1555 NE2 GLN B 338 -6.253 -0.597 3.993 1.00 0.00 N ATOM 0 H GLN B 338 -8.318 -5.207 2.906 1.00 0.00 H new ATOM 0 HA GLN B 338 -7.066 -3.401 1.187 1.00 0.00 H new ATOM 0 HB2 GLN B 338 -6.170 -4.491 3.875 1.00 0.00 H new ATOM 0 HB3 GLN B 338 -5.429 -3.126 3.065 1.00 0.00 H new ATOM 0 HG2 GLN B 338 -8.409 -3.054 3.518 1.00 0.00 H new ATOM 0 HG3 GLN B 338 -7.360 -2.809 4.901 1.00 0.00 H new ATOM 0 HE21 GLN B 338 -5.649 -1.058 4.674 1.00 0.00 H new ATOM 0 HE22 GLN B 338 -6.104 0.385 3.762 1.00 0.00 H new ATOM 1564 N LEU B 339 -5.309 -6.208 1.621 1.00 0.00 N ATOM 1565 CA LEU B 339 -4.298 -7.089 1.022 1.00 0.00 C ATOM 1566 C LEU B 339 -4.592 -7.403 -0.454 1.00 0.00 C ATOM 1567 O LEU B 339 -3.724 -7.219 -1.306 1.00 0.00 O ATOM 1568 CB LEU B 339 -4.173 -8.379 1.854 1.00 0.00 C ATOM 1569 CG LEU B 339 -3.500 -8.196 3.226 1.00 0.00 C ATOM 1570 CD1 LEU B 339 -3.607 -9.503 4.007 1.00 0.00 C ATOM 1571 CD2 LEU B 339 -2.020 -7.832 3.100 1.00 0.00 C ATOM 0 H LEU B 339 -5.748 -6.611 2.449 1.00 0.00 H new ATOM 0 HA LEU B 339 -3.344 -6.561 1.036 1.00 0.00 H new ATOM 0 HB2 LEU B 339 -5.169 -8.795 2.006 1.00 0.00 H new ATOM 0 HB3 LEU B 339 -3.605 -9.112 1.281 1.00 0.00 H new ATOM 0 HG LEU B 339 -4.010 -7.380 3.738 1.00 0.00 H new ATOM 0 HD11 LEU B 339 -3.133 -9.384 4.981 1.00 0.00 H new ATOM 0 HD12 LEU B 339 -4.657 -9.760 4.143 1.00 0.00 H new ATOM 0 HD13 LEU B 339 -3.107 -10.299 3.455 1.00 0.00 H new ATOM 0 HD21 LEU B 339 -1.589 -7.713 4.094 1.00 0.00 H new ATOM 0 HD22 LEU B 339 -1.494 -8.625 2.569 1.00 0.00 H new ATOM 0 HD23 LEU B 339 -1.921 -6.898 2.548 1.00 0.00 H new ATOM 1583 N ASN B 340 -5.813 -7.827 -0.785 1.00 0.00 N ATOM 1584 CA ASN B 340 -6.231 -8.036 -2.178 1.00 0.00 C ATOM 1585 C ASN B 340 -5.977 -6.787 -3.048 1.00 0.00 C ATOM 1586 O ASN B 340 -5.372 -6.893 -4.114 1.00 0.00 O ATOM 1587 CB ASN B 340 -7.719 -8.402 -2.262 1.00 0.00 C ATOM 1588 CG ASN B 340 -8.193 -9.642 -1.527 1.00 0.00 C ATOM 1589 OD1 ASN B 340 -9.355 -9.738 -1.150 1.00 0.00 O ATOM 1590 ND2 ASN B 340 -7.376 -10.651 -1.344 1.00 0.00 N ATOM 0 H ASN B 340 -6.540 -8.035 -0.100 1.00 0.00 H new ATOM 0 HA ASN B 340 -5.629 -8.861 -2.559 1.00 0.00 H new ATOM 0 HB2 ASN B 340 -8.293 -7.554 -1.889 1.00 0.00 H new ATOM 0 HB3 ASN B 340 -7.974 -8.521 -3.315 1.00 0.00 H new ATOM 0 HD21 ASN B 340 -7.710 -11.502 -0.893 1.00 0.00 H new ATOM 0 HD22 ASN B 340 -6.406 -10.584 -1.653 1.00 0.00 H new ATOM 1597 N ASP B 341 -6.411 -5.608 -2.587 1.00 0.00 N ATOM 1598 CA ASP B 341 -6.248 -4.322 -3.281 1.00 0.00 C ATOM 1599 C ASP B 341 -4.773 -3.891 -3.429 1.00 0.00 C ATOM 1600 O ASP B 341 -4.413 -3.288 -4.445 1.00 0.00 O ATOM 1601 CB ASP B 341 -7.068 -3.225 -2.577 1.00 0.00 C ATOM 1602 CG ASP B 341 -8.597 -3.376 -2.715 1.00 0.00 C ATOM 1603 OD1 ASP B 341 -9.083 -3.958 -3.716 1.00 0.00 O ATOM 1604 OD2 ASP B 341 -9.331 -2.839 -1.850 1.00 0.00 O ATOM 0 H ASP B 341 -6.899 -5.518 -1.696 1.00 0.00 H new ATOM 0 HA ASP B 341 -6.627 -4.464 -4.293 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -6.811 -3.221 -1.518 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -6.774 -2.256 -2.980 1.00 0.00 H new ATOM 1609 N MET B 342 -3.895 -4.259 -2.485 1.00 0.00 N ATOM 1610 CA MET B 342 -2.440 -4.074 -2.600 1.00 0.00 C ATOM 1611 C MET B 342 -1.833 -4.956 -3.696 1.00 0.00 C ATOM 1612 O MET B 342 -0.842 -4.563 -4.311 1.00 0.00 O ATOM 1613 CB MET B 342 -1.723 -4.419 -1.285 1.00 0.00 C ATOM 1614 CG MET B 342 -2.205 -3.632 -0.064 1.00 0.00 C ATOM 1615 SD MET B 342 -0.946 -2.634 0.763 1.00 0.00 S ATOM 1616 CE MET B 342 -1.464 -2.929 2.464 1.00 0.00 C ATOM 0 H MET B 342 -4.178 -4.699 -1.609 1.00 0.00 H new ATOM 0 HA MET B 342 -2.297 -3.022 -2.848 1.00 0.00 H new ATOM 0 HB2 MET B 342 -1.850 -5.483 -1.087 1.00 0.00 H new ATOM 0 HB3 MET B 342 -0.655 -4.244 -1.414 1.00 0.00 H new ATOM 0 HG2 MET B 342 -3.018 -2.976 -0.374 1.00 0.00 H new ATOM 0 HG3 MET B 342 -2.620 -4.334 0.659 1.00 0.00 H new ATOM 0 HE1 MET B 342 -0.872 -2.309 3.137 1.00 0.00 H new ATOM 0 HE2 MET B 342 -2.519 -2.677 2.572 1.00 0.00 H new ATOM 0 HE3 MET B 342 -1.314 -3.980 2.713 1.00 0.00 H new ATOM 1626 N GLY B 343 -2.410 -6.142 -3.926 1.00 0.00 N ATOM 1627 CA GLY B 343 -1.957 -7.131 -4.909 1.00 0.00 C ATOM 1628 C GLY B 343 -1.951 -8.597 -4.445 1.00 0.00 C ATOM 1629 O GLY B 343 -1.371 -9.430 -5.144 1.00 0.00 O ATOM 0 H GLY B 343 -3.236 -6.450 -3.413 1.00 0.00 H new ATOM 0 HA2 GLY B 343 -2.593 -7.054 -5.791 1.00 0.00 H new ATOM 0 HA3 GLY B 343 -0.947 -6.866 -5.221 1.00 0.00 H new ATOM 1633 N PHE B 344 -2.547 -8.945 -3.293 1.00 0.00 N ATOM 1634 CA PHE B 344 -2.409 -10.272 -2.667 1.00 0.00 C ATOM 1635 C PHE B 344 -3.732 -11.051 -2.705 1.00 0.00 C ATOM 1636 O PHE B 344 -4.534 -10.993 -1.768 1.00 0.00 O ATOM 1637 CB PHE B 344 -1.867 -10.145 -1.235 1.00 0.00 C ATOM 1638 CG PHE B 344 -0.557 -9.394 -1.077 1.00 0.00 C ATOM 1639 CD1 PHE B 344 0.667 -10.017 -1.388 1.00 0.00 C ATOM 1640 CD2 PHE B 344 -0.560 -8.083 -0.567 1.00 0.00 C ATOM 1641 CE1 PHE B 344 1.879 -9.335 -1.175 1.00 0.00 C ATOM 1642 CE2 PHE B 344 0.648 -7.395 -0.373 1.00 0.00 C ATOM 1643 CZ PHE B 344 1.870 -8.028 -0.653 1.00 0.00 C ATOM 0 H PHE B 344 -3.144 -8.308 -2.765 1.00 0.00 H new ATOM 0 HA PHE B 344 -1.685 -10.844 -3.247 1.00 0.00 H new ATOM 0 HB2 PHE B 344 -2.622 -9.648 -0.626 1.00 0.00 H new ATOM 0 HB3 PHE B 344 -1.738 -11.148 -0.828 1.00 0.00 H new ATOM 0 HD1 PHE B 344 0.675 -11.019 -1.790 1.00 0.00 H new ATOM 0 HD2 PHE B 344 -1.497 -7.603 -0.323 1.00 0.00 H new ATOM 0 HE1 PHE B 344 2.817 -9.815 -1.412 1.00 0.00 H new ATOM 0 HE2 PHE B 344 0.638 -6.378 -0.008 1.00 0.00 H new ATOM 0 HZ PHE B 344 2.801 -7.513 -0.468 1.00 0.00 H new ATOM 1653 N PHE B 345 -3.990 -11.768 -3.801 1.00 0.00 N ATOM 1654 CA PHE B 345 -5.223 -12.547 -3.998 1.00 0.00 C ATOM 1655 C PHE B 345 -5.173 -13.973 -3.399 1.00 0.00 C ATOM 1656 O PHE B 345 -6.189 -14.667 -3.361 1.00 0.00 O ATOM 1657 CB PHE B 345 -5.560 -12.565 -5.499 1.00 0.00 C ATOM 1658 CG PHE B 345 -7.005 -12.917 -5.811 1.00 0.00 C ATOM 1659 CD1 PHE B 345 -8.028 -11.986 -5.542 1.00 0.00 C ATOM 1660 CD2 PHE B 345 -7.333 -14.167 -6.372 1.00 0.00 C ATOM 1661 CE1 PHE B 345 -9.368 -12.301 -5.831 1.00 0.00 C ATOM 1662 CE2 PHE B 345 -8.673 -14.482 -6.662 1.00 0.00 C ATOM 1663 CZ PHE B 345 -9.691 -13.549 -6.394 1.00 0.00 C ATOM 0 H PHE B 345 -3.344 -11.827 -4.588 1.00 0.00 H new ATOM 0 HA PHE B 345 -6.020 -12.053 -3.442 1.00 0.00 H new ATOM 0 HB2 PHE B 345 -5.338 -11.585 -5.921 1.00 0.00 H new ATOM 0 HB3 PHE B 345 -4.908 -13.282 -5.997 1.00 0.00 H new ATOM 0 HD1 PHE B 345 -7.782 -11.026 -5.112 1.00 0.00 H new ATOM 0 HD2 PHE B 345 -6.554 -14.885 -6.580 1.00 0.00 H new ATOM 0 HE1 PHE B 345 -10.149 -11.585 -5.621 1.00 0.00 H new ATOM 0 HE2 PHE B 345 -8.921 -15.442 -7.091 1.00 0.00 H new ATOM 0 HZ PHE B 345 -10.719 -13.790 -6.620 1.00 0.00 H new ATOM 1673 N ASP B 346 -4.017 -14.428 -2.900 1.00 0.00 N ATOM 1674 CA ASP B 346 -3.863 -15.720 -2.210 1.00 0.00 C ATOM 1675 C ASP B 346 -4.467 -15.674 -0.790 1.00 0.00 C ATOM 1676 O ASP B 346 -3.766 -15.463 0.203 1.00 0.00 O ATOM 1677 CB ASP B 346 -2.383 -16.156 -2.175 1.00 0.00 C ATOM 1678 CG ASP B 346 -1.795 -16.618 -3.520 1.00 0.00 C ATOM 1679 OD1 ASP B 346 -2.548 -16.867 -4.493 1.00 0.00 O ATOM 1680 OD2 ASP B 346 -0.552 -16.779 -3.588 1.00 0.00 O ATOM 0 H ASP B 346 -3.146 -13.901 -2.964 1.00 0.00 H new ATOM 0 HA ASP B 346 -4.417 -16.468 -2.777 1.00 0.00 H new ATOM 0 HB2 ASP B 346 -1.786 -15.323 -1.805 1.00 0.00 H new ATOM 0 HB3 ASP B 346 -2.279 -16.968 -1.455 1.00 0.00 H new ATOM 1685 N PHE B 347 -5.783 -15.884 -0.679 1.00 0.00 N ATOM 1686 CA PHE B 347 -6.528 -15.842 0.587 1.00 0.00 C ATOM 1687 C PHE B 347 -5.947 -16.761 1.672 1.00 0.00 C ATOM 1688 O PHE B 347 -5.818 -16.341 2.819 1.00 0.00 O ATOM 1689 CB PHE B 347 -8.005 -16.177 0.335 1.00 0.00 C ATOM 1690 CG PHE B 347 -8.733 -15.137 -0.493 1.00 0.00 C ATOM 1691 CD1 PHE B 347 -9.205 -13.959 0.118 1.00 0.00 C ATOM 1692 CD2 PHE B 347 -8.926 -15.334 -1.873 1.00 0.00 C ATOM 1693 CE1 PHE B 347 -9.858 -12.979 -0.650 1.00 0.00 C ATOM 1694 CE2 PHE B 347 -9.570 -14.349 -2.643 1.00 0.00 C ATOM 1695 CZ PHE B 347 -10.032 -13.171 -2.033 1.00 0.00 C ATOM 0 H PHE B 347 -6.374 -16.093 -1.484 1.00 0.00 H new ATOM 0 HA PHE B 347 -6.436 -14.826 0.971 1.00 0.00 H new ATOM 0 HB2 PHE B 347 -8.069 -17.141 -0.170 1.00 0.00 H new ATOM 0 HB3 PHE B 347 -8.512 -16.286 1.294 1.00 0.00 H new ATOM 0 HD1 PHE B 347 -9.065 -13.808 1.178 1.00 0.00 H new ATOM 0 HD2 PHE B 347 -8.579 -16.243 -2.342 1.00 0.00 H new ATOM 0 HE1 PHE B 347 -10.226 -12.080 -0.179 1.00 0.00 H new ATOM 0 HE2 PHE B 347 -9.709 -14.498 -3.704 1.00 0.00 H new ATOM 0 HZ PHE B 347 -10.521 -12.412 -2.626 1.00 0.00 H new ATOM 1705 N ASP B 348 -5.554 -17.990 1.326 1.00 0.00 N ATOM 1706 CA ASP B 348 -4.956 -18.945 2.270 1.00 0.00 C ATOM 1707 C ASP B 348 -3.625 -18.444 2.865 1.00 0.00 C ATOM 1708 O ASP B 348 -3.401 -18.558 4.072 1.00 0.00 O ATOM 1709 CB ASP B 348 -4.778 -20.299 1.570 1.00 0.00 C ATOM 1710 CG ASP B 348 -4.286 -21.385 2.541 1.00 0.00 C ATOM 1711 OD1 ASP B 348 -5.096 -21.867 3.369 1.00 0.00 O ATOM 1712 OD2 ASP B 348 -3.097 -21.775 2.464 1.00 0.00 O ATOM 0 H ASP B 348 -5.641 -18.355 0.378 1.00 0.00 H new ATOM 0 HA ASP B 348 -5.635 -19.055 3.115 1.00 0.00 H new ATOM 0 HB2 ASP B 348 -5.726 -20.608 1.130 1.00 0.00 H new ATOM 0 HB3 ASP B 348 -4.066 -20.194 0.751 1.00 0.00 H new ATOM 1717 N ARG B 349 -2.768 -17.819 2.041 1.00 0.00 N ATOM 1718 CA ARG B 349 -1.539 -17.141 2.487 1.00 0.00 C ATOM 1719 C ARG B 349 -1.846 -15.953 3.389 1.00 0.00 C ATOM 1720 O ARG B 349 -1.260 -15.839 4.465 1.00 0.00 O ATOM 1721 CB ARG B 349 -0.700 -16.660 1.296 1.00 0.00 C ATOM 1722 CG ARG B 349 0.070 -17.785 0.604 1.00 0.00 C ATOM 1723 CD ARG B 349 1.006 -17.179 -0.448 1.00 0.00 C ATOM 1724 NE ARG B 349 2.076 -18.118 -0.808 1.00 0.00 N ATOM 1725 CZ ARG B 349 2.410 -18.597 -1.989 1.00 0.00 C ATOM 1726 NH1 ARG B 349 1.765 -18.321 -3.089 1.00 0.00 N ATOM 1727 NH2 ARG B 349 3.443 -19.387 -2.071 1.00 0.00 N ATOM 0 H ARG B 349 -2.911 -17.770 1.032 1.00 0.00 H new ATOM 0 HA ARG B 349 -0.970 -17.878 3.054 1.00 0.00 H new ATOM 0 HB2 ARG B 349 -1.355 -16.178 0.570 1.00 0.00 H new ATOM 0 HB3 ARG B 349 0.006 -15.904 1.640 1.00 0.00 H new ATOM 0 HG2 ARG B 349 0.644 -18.353 1.336 1.00 0.00 H new ATOM 0 HG3 ARG B 349 -0.624 -18.481 0.133 1.00 0.00 H new ATOM 0 HD2 ARG B 349 0.435 -16.915 -1.338 1.00 0.00 H new ATOM 0 HD3 ARG B 349 1.442 -16.257 -0.064 1.00 0.00 H new ATOM 0 HE ARG B 349 2.645 -18.448 -0.028 1.00 0.00 H new ATOM 0 HH11 ARG B 349 0.954 -17.703 -3.063 1.00 0.00 H new ATOM 0 HH12 ARG B 349 2.072 -18.723 -3.975 1.00 0.00 H new ATOM 0 HH21 ARG B 349 3.973 -19.622 -1.232 1.00 0.00 H new ATOM 0 HH22 ARG B 349 3.721 -19.771 -2.974 1.00 0.00 H new ATOM 1741 N ASN B 350 -2.770 -15.088 2.966 1.00 0.00 N ATOM 1742 CA ASN B 350 -3.188 -13.917 3.735 1.00 0.00 C ATOM 1743 C ASN B 350 -3.686 -14.334 5.127 1.00 0.00 C ATOM 1744 O ASN B 350 -3.239 -13.789 6.132 1.00 0.00 O ATOM 1745 CB ASN B 350 -4.275 -13.132 2.982 1.00 0.00 C ATOM 1746 CG ASN B 350 -3.860 -12.546 1.643 1.00 0.00 C ATOM 1747 OD1 ASN B 350 -2.696 -12.445 1.292 1.00 0.00 O ATOM 1748 ND2 ASN B 350 -4.821 -12.100 0.867 1.00 0.00 N ATOM 0 H ASN B 350 -3.253 -15.183 2.072 1.00 0.00 H new ATOM 0 HA ASN B 350 -2.324 -13.265 3.862 1.00 0.00 H new ATOM 0 HB2 ASN B 350 -5.127 -13.792 2.820 1.00 0.00 H new ATOM 0 HB3 ASN B 350 -4.619 -12.319 3.622 1.00 0.00 H new ATOM 0 HD21 ASN B 350 -4.594 -11.669 -0.029 1.00 0.00 H new ATOM 0 HD22 ASN B 350 -5.794 -12.185 1.161 1.00 0.00 H new ATOM 1755 N VAL B 351 -4.559 -15.344 5.195 1.00 0.00 N ATOM 1756 CA VAL B 351 -5.046 -15.956 6.441 1.00 0.00 C ATOM 1757 C VAL B 351 -3.892 -16.481 7.298 1.00 0.00 C ATOM 1758 O VAL B 351 -3.795 -16.097 8.462 1.00 0.00 O ATOM 1759 CB VAL B 351 -6.091 -17.049 6.135 1.00 0.00 C ATOM 1760 CG1 VAL B 351 -6.357 -17.986 7.319 1.00 0.00 C ATOM 1761 CG2 VAL B 351 -7.426 -16.392 5.763 1.00 0.00 C ATOM 0 H VAL B 351 -4.960 -15.773 4.361 1.00 0.00 H new ATOM 0 HA VAL B 351 -5.541 -15.184 7.030 1.00 0.00 H new ATOM 0 HB VAL B 351 -5.679 -17.640 5.317 1.00 0.00 H new ATOM 0 HG11 VAL B 351 -7.101 -18.730 7.034 1.00 0.00 H new ATOM 0 HG12 VAL B 351 -5.431 -18.488 7.601 1.00 0.00 H new ATOM 0 HG13 VAL B 351 -6.728 -17.407 8.165 1.00 0.00 H new ATOM 0 HG21 VAL B 351 -8.164 -17.165 5.547 1.00 0.00 H new ATOM 0 HG22 VAL B 351 -7.774 -15.780 6.595 1.00 0.00 H new ATOM 0 HG23 VAL B 351 -7.290 -15.764 4.883 1.00 0.00 H new ATOM 1771 N ALA B 352 -3.003 -17.323 6.759 1.00 0.00 N ATOM 1772 CA ALA B 352 -1.902 -17.908 7.528 1.00 0.00 C ATOM 1773 C ALA B 352 -0.959 -16.839 8.119 1.00 0.00 C ATOM 1774 O ALA B 352 -0.472 -16.985 9.243 1.00 0.00 O ATOM 1775 CB ALA B 352 -1.153 -18.896 6.626 1.00 0.00 C ATOM 0 H ALA B 352 -3.027 -17.616 5.782 1.00 0.00 H new ATOM 0 HA ALA B 352 -2.312 -18.436 8.389 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -0.328 -19.343 7.182 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -1.836 -19.680 6.298 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -0.761 -18.369 5.756 1.00 0.00 H new ATOM 1781 N ALA B 353 -0.748 -15.742 7.389 1.00 0.00 N ATOM 1782 CA ALA B 353 0.002 -14.572 7.828 1.00 0.00 C ATOM 1783 C ALA B 353 -0.744 -13.771 8.918 1.00 0.00 C ATOM 1784 O ALA B 353 -0.187 -13.520 9.989 1.00 0.00 O ATOM 1785 CB ALA B 353 0.312 -13.731 6.585 1.00 0.00 C ATOM 0 H ALA B 353 -1.110 -15.644 6.440 1.00 0.00 H new ATOM 0 HA ALA B 353 0.932 -14.882 8.304 1.00 0.00 H new ATOM 0 HB1 ALA B 353 0.874 -12.844 6.877 1.00 0.00 H new ATOM 0 HB2 ALA B 353 0.903 -14.321 5.884 1.00 0.00 H new ATOM 0 HB3 ALA B 353 -0.621 -13.429 6.108 1.00 0.00 H new ATOM 1791 N LEU B 354 -2.009 -13.396 8.688 1.00 0.00 N ATOM 1792 CA LEU B 354 -2.843 -12.620 9.620 1.00 0.00 C ATOM 1793 C LEU B 354 -3.018 -13.336 10.967 1.00 0.00 C ATOM 1794 O LEU B 354 -2.913 -12.697 12.015 1.00 0.00 O ATOM 1795 CB LEU B 354 -4.210 -12.323 8.970 1.00 0.00 C ATOM 1796 CG LEU B 354 -4.172 -11.264 7.849 1.00 0.00 C ATOM 1797 CD1 LEU B 354 -5.460 -11.324 7.028 1.00 0.00 C ATOM 1798 CD2 LEU B 354 -4.041 -9.843 8.401 1.00 0.00 C ATOM 0 H LEU B 354 -2.496 -13.630 7.823 1.00 0.00 H new ATOM 0 HA LEU B 354 -2.334 -11.679 9.828 1.00 0.00 H new ATOM 0 HB2 LEU B 354 -4.613 -13.250 8.562 1.00 0.00 H new ATOM 0 HB3 LEU B 354 -4.901 -11.989 9.744 1.00 0.00 H new ATOM 0 HG LEU B 354 -3.300 -11.490 7.235 1.00 0.00 H new ATOM 0 HD11 LEU B 354 -5.424 -10.573 6.239 1.00 0.00 H new ATOM 0 HD12 LEU B 354 -5.562 -12.314 6.582 1.00 0.00 H new ATOM 0 HD13 LEU B 354 -6.314 -11.129 7.676 1.00 0.00 H new ATOM 0 HD21 LEU B 354 -4.018 -9.132 7.575 1.00 0.00 H new ATOM 0 HD22 LEU B 354 -4.892 -9.623 9.046 1.00 0.00 H new ATOM 0 HD23 LEU B 354 -3.119 -9.760 8.976 1.00 0.00 H new ATOM 1810 N ARG B 355 -3.209 -14.663 10.949 1.00 0.00 N ATOM 1811 CA ARG B 355 -3.383 -15.514 12.142 1.00 0.00 C ATOM 1812 C ARG B 355 -2.230 -15.455 13.153 1.00 0.00 C ATOM 1813 O ARG B 355 -2.469 -15.681 14.340 1.00 0.00 O ATOM 1814 CB ARG B 355 -3.599 -16.976 11.714 1.00 0.00 C ATOM 1815 CG ARG B 355 -5.031 -17.254 11.229 1.00 0.00 C ATOM 1816 CD ARG B 355 -5.159 -18.693 10.711 1.00 0.00 C ATOM 1817 NE ARG B 355 -5.104 -19.685 11.803 1.00 0.00 N ATOM 1818 CZ ARG B 355 -5.252 -20.994 11.703 1.00 0.00 C ATOM 1819 NH1 ARG B 355 -5.474 -21.581 10.561 1.00 0.00 N ATOM 1820 NH2 ARG B 355 -5.181 -21.749 12.762 1.00 0.00 N ATOM 0 H ARG B 355 -3.248 -15.193 10.078 1.00 0.00 H new ATOM 0 HA ARG B 355 -4.257 -15.112 12.655 1.00 0.00 H new ATOM 0 HB2 ARG B 355 -2.897 -17.223 10.918 1.00 0.00 H new ATOM 0 HB3 ARG B 355 -3.372 -17.632 12.554 1.00 0.00 H new ATOM 0 HG2 ARG B 355 -5.735 -17.092 12.046 1.00 0.00 H new ATOM 0 HG3 ARG B 355 -5.295 -16.553 10.437 1.00 0.00 H new ATOM 0 HD2 ARG B 355 -6.100 -18.801 10.171 1.00 0.00 H new ATOM 0 HD3 ARG B 355 -4.358 -18.894 9.999 1.00 0.00 H new ATOM 0 HE ARG B 355 -4.933 -19.319 12.739 1.00 0.00 H new ATOM 0 HH11 ARG B 355 -5.539 -21.027 9.707 1.00 0.00 H new ATOM 0 HH12 ARG B 355 -5.583 -22.594 10.521 1.00 0.00 H new ATOM 0 HH21 ARG B 355 -5.010 -21.330 13.676 1.00 0.00 H new ATOM 0 HH22 ARG B 355 -5.296 -22.759 12.677 1.00 0.00 H new ATOM 1834 N ARG B 356 -1.002 -15.139 12.715 1.00 0.00 N ATOM 1835 CA ARG B 356 0.196 -15.016 13.578 1.00 0.00 C ATOM 1836 C ARG B 356 0.617 -13.567 13.813 1.00 0.00 C ATOM 1837 O ARG B 356 1.114 -13.222 14.884 1.00 0.00 O ATOM 1838 CB ARG B 356 1.345 -15.876 13.025 1.00 0.00 C ATOM 1839 CG ARG B 356 1.936 -15.416 11.684 1.00 0.00 C ATOM 1840 CD ARG B 356 3.062 -16.357 11.253 1.00 0.00 C ATOM 1841 NE ARG B 356 3.787 -15.832 10.083 1.00 0.00 N ATOM 1842 CZ ARG B 356 4.670 -16.483 9.350 1.00 0.00 C ATOM 1843 NH1 ARG B 356 4.977 -17.734 9.526 1.00 0.00 N ATOM 1844 NH2 ARG B 356 5.304 -15.887 8.394 1.00 0.00 N ATOM 0 H ARG B 356 -0.804 -14.957 11.731 1.00 0.00 H new ATOM 0 HA ARG B 356 -0.072 -15.399 14.563 1.00 0.00 H new ATOM 0 HB2 ARG B 356 2.145 -15.899 13.765 1.00 0.00 H new ATOM 0 HB3 ARG B 356 0.986 -16.899 12.911 1.00 0.00 H new ATOM 0 HG2 ARG B 356 1.157 -15.397 10.922 1.00 0.00 H new ATOM 0 HG3 ARG B 356 2.317 -14.399 11.776 1.00 0.00 H new ATOM 0 HD2 ARG B 356 3.758 -16.497 12.081 1.00 0.00 H new ATOM 0 HD3 ARG B 356 2.648 -17.337 11.016 1.00 0.00 H new ATOM 0 HE ARG B 356 3.586 -14.869 9.813 1.00 0.00 H new ATOM 0 HH11 ARG B 356 4.525 -18.271 10.267 1.00 0.00 H new ATOM 0 HH12 ARG B 356 5.669 -18.179 8.923 1.00 0.00 H new ATOM 0 HH21 ARG B 356 5.124 -14.902 8.199 1.00 0.00 H new ATOM 0 HH22 ARG B 356 5.984 -16.402 7.835 1.00 0.00 H new ATOM 1858 N SER B 357 0.344 -12.716 12.829 1.00 0.00 N ATOM 1859 CA SER B 357 0.511 -11.259 12.858 1.00 0.00 C ATOM 1860 C SER B 357 -0.477 -10.520 13.778 1.00 0.00 C ATOM 1861 O SER B 357 -0.340 -9.312 13.975 1.00 0.00 O ATOM 1862 CB SER B 357 0.364 -10.727 11.432 1.00 0.00 C ATOM 1863 OG SER B 357 1.361 -11.281 10.593 1.00 0.00 O ATOM 0 H SER B 357 -0.022 -13.040 11.934 1.00 0.00 H new ATOM 0 HA SER B 357 1.502 -11.067 13.270 1.00 0.00 H new ATOM 0 HB2 SER B 357 -0.625 -10.974 11.045 1.00 0.00 H new ATOM 0 HB3 SER B 357 0.443 -9.640 11.433 1.00 0.00 H new ATOM 0 HG SER B 357 1.045 -12.134 10.228 1.00 0.00 H new ATOM 1869 N GLY B 358 -1.487 -11.206 14.331 1.00 0.00 N ATOM 1870 CA GLY B 358 -2.491 -10.622 15.230 1.00 0.00 C ATOM 1871 C GLY B 358 -3.591 -9.874 14.474 1.00 0.00 C ATOM 1872 O GLY B 358 -4.231 -8.976 15.025 1.00 0.00 O ATOM 0 H GLY B 358 -1.631 -12.202 14.162 1.00 0.00 H new ATOM 0 HA2 GLY B 358 -2.941 -11.413 15.830 1.00 0.00 H new ATOM 0 HA3 GLY B 358 -2.000 -9.937 15.922 1.00 0.00 H new ATOM 1876 N GLY B 359 -3.775 -10.201 13.190 1.00 0.00 N ATOM 1877 CA GLY B 359 -4.699 -9.539 12.277 1.00 0.00 C ATOM 1878 C GLY B 359 -4.181 -8.218 11.682 1.00 0.00 C ATOM 1879 O GLY B 359 -4.950 -7.515 11.029 1.00 0.00 O ATOM 0 H GLY B 359 -3.263 -10.963 12.747 1.00 0.00 H new ATOM 0 HA2 GLY B 359 -4.933 -10.222 11.460 1.00 0.00 H new ATOM 0 HA3 GLY B 359 -5.632 -9.342 12.805 1.00 0.00 H new ATOM 1883 N SER B 360 -2.908 -7.855 11.895 1.00 0.00 N ATOM 1884 CA SER B 360 -2.265 -6.678 11.281 1.00 0.00 C ATOM 1885 C SER B 360 -2.040 -6.863 9.775 1.00 0.00 C ATOM 1886 O SER B 360 -1.389 -7.824 9.360 1.00 0.00 O ATOM 1887 CB SER B 360 -0.921 -6.383 11.957 1.00 0.00 C ATOM 1888 OG SER B 360 -0.288 -5.292 11.302 1.00 0.00 O ATOM 0 H SER B 360 -2.283 -8.378 12.509 1.00 0.00 H new ATOM 0 HA SER B 360 -2.945 -5.838 11.425 1.00 0.00 H new ATOM 0 HB2 SER B 360 -1.076 -6.148 13.010 1.00 0.00 H new ATOM 0 HB3 SER B 360 -0.281 -7.265 11.918 1.00 0.00 H new ATOM 0 HG SER B 360 0.570 -5.103 11.736 1.00 0.00 H new ATOM 1894 N VAL B 361 -2.528 -5.914 8.963 1.00 0.00 N ATOM 1895 CA VAL B 361 -2.320 -5.852 7.501 1.00 0.00 C ATOM 1896 C VAL B 361 -0.828 -5.892 7.160 1.00 0.00 C ATOM 1897 O VAL B 361 -0.365 -6.828 6.519 1.00 0.00 O ATOM 1898 CB VAL B 361 -2.963 -4.592 6.879 1.00 0.00 C ATOM 1899 CG1 VAL B 361 -2.793 -4.568 5.353 1.00 0.00 C ATOM 1900 CG2 VAL B 361 -4.462 -4.484 7.161 1.00 0.00 C ATOM 0 H VAL B 361 -3.097 -5.143 9.312 1.00 0.00 H new ATOM 0 HA VAL B 361 -2.809 -6.728 7.075 1.00 0.00 H new ATOM 0 HB VAL B 361 -2.443 -3.756 7.346 1.00 0.00 H new ATOM 0 HG11 VAL B 361 -3.257 -3.668 4.949 1.00 0.00 H new ATOM 0 HG12 VAL B 361 -1.732 -4.571 5.105 1.00 0.00 H new ATOM 0 HG13 VAL B 361 -3.269 -5.447 4.920 1.00 0.00 H new ATOM 0 HG21 VAL B 361 -4.855 -3.579 6.698 1.00 0.00 H new ATOM 0 HG22 VAL B 361 -4.973 -5.354 6.749 1.00 0.00 H new ATOM 0 HG23 VAL B 361 -4.628 -4.442 8.238 1.00 0.00 H new ATOM 1910 N GLN B 362 -0.068 -4.881 7.588 1.00 0.00 N ATOM 1911 CA GLN B 362 1.374 -4.742 7.338 1.00 0.00 C ATOM 1912 C GLN B 362 2.215 -5.829 8.035 1.00 0.00 C ATOM 1913 O GLN B 362 3.252 -6.233 7.507 1.00 0.00 O ATOM 1914 CB GLN B 362 1.801 -3.337 7.763 1.00 0.00 C ATOM 1915 CG GLN B 362 1.466 -2.366 6.627 1.00 0.00 C ATOM 1916 CD GLN B 362 2.296 -2.609 5.360 1.00 0.00 C ATOM 1917 OE1 GLN B 362 3.427 -3.070 5.389 1.00 0.00 O ATOM 1918 NE2 GLN B 362 1.777 -2.296 4.196 1.00 0.00 N ATOM 0 H GLN B 362 -0.449 -4.110 8.136 1.00 0.00 H new ATOM 0 HA GLN B 362 1.558 -4.883 6.273 1.00 0.00 H new ATOM 0 HB2 GLN B 362 1.285 -3.044 8.677 1.00 0.00 H new ATOM 0 HB3 GLN B 362 2.869 -3.314 7.979 1.00 0.00 H new ATOM 0 HG2 GLN B 362 0.407 -2.454 6.383 1.00 0.00 H new ATOM 0 HG3 GLN B 362 1.630 -1.345 6.971 1.00 0.00 H new ATOM 0 HE21 GLN B 362 0.834 -1.909 4.145 1.00 0.00 H new ATOM 0 HE22 GLN B 362 2.316 -2.439 3.342 1.00 0.00 H new ATOM 1927 N GLY B 363 1.750 -6.360 9.173 1.00 0.00 N ATOM 1928 CA GLY B 363 2.340 -7.543 9.812 1.00 0.00 C ATOM 1929 C GLY B 363 2.291 -8.764 8.884 1.00 0.00 C ATOM 1930 O GLY B 363 3.319 -9.389 8.613 1.00 0.00 O ATOM 0 H GLY B 363 0.950 -5.979 9.679 1.00 0.00 H new ATOM 0 HA2 GLY B 363 3.374 -7.333 10.085 1.00 0.00 H new ATOM 0 HA3 GLY B 363 1.805 -7.764 10.736 1.00 0.00 H new ATOM 1934 N ALA B 364 1.108 -9.055 8.332 1.00 0.00 N ATOM 1935 CA ALA B 364 0.922 -10.099 7.329 1.00 0.00 C ATOM 1936 C ALA B 364 1.688 -9.809 6.023 1.00 0.00 C ATOM 1937 O ALA B 364 2.283 -10.711 5.432 1.00 0.00 O ATOM 1938 CB ALA B 364 -0.580 -10.272 7.080 1.00 0.00 C ATOM 0 H ALA B 364 0.247 -8.565 8.574 1.00 0.00 H new ATOM 0 HA ALA B 364 1.341 -11.031 7.709 1.00 0.00 H new ATOM 0 HB1 ALA B 364 -0.738 -11.049 6.332 1.00 0.00 H new ATOM 0 HB2 ALA B 364 -1.072 -10.558 8.010 1.00 0.00 H new ATOM 0 HB3 ALA B 364 -1.000 -9.332 6.721 1.00 0.00 H new ATOM 1944 N LEU B 365 1.713 -8.547 5.588 1.00 0.00 N ATOM 1945 CA LEU B 365 2.400 -8.069 4.398 1.00 0.00 C ATOM 1946 C LEU B 365 3.908 -8.350 4.421 1.00 0.00 C ATOM 1947 O LEU B 365 4.461 -8.736 3.397 1.00 0.00 O ATOM 1948 CB LEU B 365 2.080 -6.575 4.246 1.00 0.00 C ATOM 1949 CG LEU B 365 2.250 -6.082 2.810 1.00 0.00 C ATOM 1950 CD1 LEU B 365 1.071 -5.208 2.397 1.00 0.00 C ATOM 1951 CD2 LEU B 365 3.534 -5.286 2.622 1.00 0.00 C ATOM 0 H LEU B 365 1.229 -7.799 6.084 1.00 0.00 H new ATOM 0 HA LEU B 365 2.041 -8.617 3.527 1.00 0.00 H new ATOM 0 HB2 LEU B 365 1.056 -6.392 4.571 1.00 0.00 H new ATOM 0 HB3 LEU B 365 2.731 -5.999 4.904 1.00 0.00 H new ATOM 0 HG LEU B 365 2.297 -6.972 2.182 1.00 0.00 H new ATOM 0 HD11 LEU B 365 1.212 -4.868 1.371 1.00 0.00 H new ATOM 0 HD12 LEU B 365 0.149 -5.785 2.464 1.00 0.00 H new ATOM 0 HD13 LEU B 365 1.008 -4.345 3.060 1.00 0.00 H new ATOM 0 HD21 LEU B 365 3.610 -4.957 1.586 1.00 0.00 H new ATOM 0 HD22 LEU B 365 3.522 -4.416 3.279 1.00 0.00 H new ATOM 0 HD23 LEU B 365 4.391 -5.914 2.867 1.00 0.00 H new ATOM 1963 N ASP B 366 4.571 -8.232 5.575 1.00 0.00 N ATOM 1964 CA ASP B 366 5.978 -8.621 5.743 1.00 0.00 C ATOM 1965 C ASP B 366 6.217 -10.121 5.467 1.00 0.00 C ATOM 1966 O ASP B 366 7.154 -10.480 4.750 1.00 0.00 O ATOM 1967 CB ASP B 366 6.450 -8.234 7.150 1.00 0.00 C ATOM 1968 CG ASP B 366 7.954 -8.494 7.333 1.00 0.00 C ATOM 1969 OD1 ASP B 366 8.773 -7.699 6.813 1.00 0.00 O ATOM 1970 OD2 ASP B 366 8.324 -9.484 8.010 1.00 0.00 O ATOM 0 H ASP B 366 4.146 -7.862 6.425 1.00 0.00 H new ATOM 0 HA ASP B 366 6.566 -8.081 5.001 1.00 0.00 H new ATOM 0 HB2 ASP B 366 6.238 -7.180 7.329 1.00 0.00 H new ATOM 0 HB3 ASP B 366 5.889 -8.802 7.892 1.00 0.00 H new ATOM 1975 N SER B 367 5.340 -11.000 5.972 1.00 0.00 N ATOM 1976 CA SER B 367 5.372 -12.447 5.685 1.00 0.00 C ATOM 1977 C SER B 367 5.146 -12.754 4.198 1.00 0.00 C ATOM 1978 O SER B 367 5.822 -13.617 3.635 1.00 0.00 O ATOM 1979 CB SER B 367 4.318 -13.199 6.509 1.00 0.00 C ATOM 1980 OG SER B 367 4.632 -13.165 7.893 1.00 0.00 O ATOM 0 H SER B 367 4.581 -10.728 6.597 1.00 0.00 H new ATOM 0 HA SER B 367 6.370 -12.786 5.962 1.00 0.00 H new ATOM 0 HB2 SER B 367 3.337 -12.753 6.344 1.00 0.00 H new ATOM 0 HB3 SER B 367 4.258 -14.234 6.172 1.00 0.00 H new ATOM 0 HG SER B 367 3.825 -13.352 8.416 1.00 0.00 H new ATOM 1986 N LEU B 368 4.217 -12.037 3.555 1.00 0.00 N ATOM 1987 CA LEU B 368 3.918 -12.133 2.121 1.00 0.00 C ATOM 1988 C LEU B 368 5.086 -11.643 1.240 1.00 0.00 C ATOM 1989 O LEU B 368 5.413 -12.297 0.249 1.00 0.00 O ATOM 1990 CB LEU B 368 2.622 -11.353 1.821 1.00 0.00 C ATOM 1991 CG LEU B 368 1.350 -11.999 2.409 1.00 0.00 C ATOM 1992 CD1 LEU B 368 0.207 -10.988 2.480 1.00 0.00 C ATOM 1993 CD2 LEU B 368 0.879 -13.177 1.556 1.00 0.00 C ATOM 0 H LEU B 368 3.633 -11.351 4.034 1.00 0.00 H new ATOM 0 HA LEU B 368 3.776 -13.184 1.871 1.00 0.00 H new ATOM 0 HB2 LEU B 368 2.719 -10.342 2.216 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.506 -11.264 0.741 1.00 0.00 H new ATOM 0 HG LEU B 368 1.610 -12.346 3.409 1.00 0.00 H new ATOM 0 HD11 LEU B 368 -0.678 -11.468 2.898 1.00 0.00 H new ATOM 0 HD12 LEU B 368 0.500 -10.152 3.115 1.00 0.00 H new ATOM 0 HD13 LEU B 368 -0.018 -10.622 1.478 1.00 0.00 H new ATOM 0 HD21 LEU B 368 -0.019 -13.610 1.997 1.00 0.00 H new ATOM 0 HD22 LEU B 368 0.656 -12.830 0.547 1.00 0.00 H new ATOM 0 HD23 LEU B 368 1.663 -13.933 1.514 1.00 0.00 H new ATOM 2005 N LEU B 369 5.755 -10.545 1.616 1.00 0.00 N ATOM 2006 CA LEU B 369 6.978 -10.035 0.972 1.00 0.00 C ATOM 2007 C LEU B 369 8.135 -11.044 1.059 1.00 0.00 C ATOM 2008 O LEU B 369 8.810 -11.302 0.061 1.00 0.00 O ATOM 2009 CB LEU B 369 7.391 -8.681 1.603 1.00 0.00 C ATOM 2010 CG LEU B 369 7.102 -7.421 0.765 1.00 0.00 C ATOM 2011 CD1 LEU B 369 7.982 -7.352 -0.486 1.00 0.00 C ATOM 2012 CD2 LEU B 369 5.641 -7.293 0.343 1.00 0.00 C ATOM 0 H LEU B 369 5.453 -9.968 2.401 1.00 0.00 H new ATOM 0 HA LEU B 369 6.757 -9.884 -0.085 1.00 0.00 H new ATOM 0 HB2 LEU B 369 6.880 -8.580 2.560 1.00 0.00 H new ATOM 0 HB3 LEU B 369 8.460 -8.714 1.814 1.00 0.00 H new ATOM 0 HG LEU B 369 7.337 -6.589 1.429 1.00 0.00 H new ATOM 0 HD11 LEU B 369 7.746 -6.448 -1.048 1.00 0.00 H new ATOM 0 HD12 LEU B 369 9.031 -7.332 -0.192 1.00 0.00 H new ATOM 0 HD13 LEU B 369 7.796 -8.226 -1.110 1.00 0.00 H new ATOM 0 HD21 LEU B 369 5.510 -6.384 -0.244 1.00 0.00 H new ATOM 0 HD22 LEU B 369 5.359 -8.157 -0.259 1.00 0.00 H new ATOM 0 HD23 LEU B 369 5.009 -7.247 1.230 1.00 0.00 H new ATOM 2024 N ASN B 370 8.354 -11.630 2.241 1.00 0.00 N ATOM 2025 CA ASN B 370 9.364 -12.671 2.460 1.00 0.00 C ATOM 2026 C ASN B 370 9.011 -14.020 1.791 1.00 0.00 C ATOM 2027 O ASN B 370 9.893 -14.857 1.581 1.00 0.00 O ATOM 2028 CB ASN B 370 9.575 -12.824 3.976 1.00 0.00 C ATOM 2029 CG ASN B 370 10.827 -13.628 4.298 1.00 0.00 C ATOM 2030 OD1 ASN B 370 10.697 -14.773 4.931 1.00 0.00 O flip ATOM 2031 ND2 ASN B 370 11.944 -13.229 3.999 1.00 0.00 N flip ATOM 0 H ASN B 370 7.829 -11.392 3.082 1.00 0.00 H new ATOM 0 HA ASN B 370 10.292 -12.359 1.980 1.00 0.00 H new ATOM 0 HB2 ASN B 370 9.650 -11.837 4.433 1.00 0.00 H new ATOM 0 HB3 ASN B 370 8.706 -13.314 4.416 1.00 0.00 H new ATOM 0 HD21 ASN B 370 12.054 -12.342 3.508 1.00 0.00 H new ATOM 0 HD22 ASN B 370 12.765 -13.783 4.241 1.00 0.00 H new ATOM 2038 N GLY B 371 7.737 -14.238 1.438 1.00 0.00 N ATOM 2039 CA GLY B 371 7.233 -15.461 0.799 1.00 0.00 C ATOM 2040 C GLY B 371 7.180 -16.682 1.729 1.00 0.00 C ATOM 2041 O GLY B 371 7.264 -17.819 1.260 1.00 0.00 O ATOM 0 H GLY B 371 7.005 -13.545 1.595 1.00 0.00 H new ATOM 0 HA2 GLY B 371 6.232 -15.269 0.412 1.00 0.00 H new ATOM 0 HA3 GLY B 371 7.865 -15.697 -0.057 1.00 0.00 H new ATOM 2045 N ASP B 372 7.101 -16.459 3.043 1.00 0.00 N ATOM 2046 CA ASP B 372 7.178 -17.513 4.067 1.00 0.00 C ATOM 2047 C ASP B 372 5.921 -18.408 4.131 1.00 0.00 C ATOM 2048 O ASP B 372 6.029 -19.618 4.359 1.00 0.00 O ATOM 2049 CB ASP B 372 7.437 -16.855 5.428 1.00 0.00 C ATOM 2050 CG ASP B 372 7.699 -17.895 6.528 1.00 0.00 C ATOM 2051 OD1 ASP B 372 8.745 -18.585 6.481 1.00 0.00 O ATOM 2052 OD2 ASP B 372 6.872 -17.983 7.466 1.00 0.00 O ATOM 0 H ASP B 372 6.980 -15.526 3.436 1.00 0.00 H new ATOM 0 HA ASP B 372 7.997 -18.178 3.793 1.00 0.00 H new ATOM 0 HB2 ASP B 372 8.294 -16.186 5.350 1.00 0.00 H new ATOM 0 HB3 ASP B 372 6.578 -16.243 5.704 1.00 0.00 H new ATOM 2057 N VAL B 373 4.735 -17.821 3.916 1.00 0.00 N ATOM 2058 CA VAL B 373 3.433 -18.512 3.788 1.00 0.00 C ATOM 2059 C VAL B 373 3.276 -19.259 2.458 1.00 0.00 C ATOM 2060 O VAL B 373 2.728 -20.382 2.482 1.00 0.00 O ATOM 2061 CB VAL B 373 2.242 -17.565 4.029 1.00 0.00 C ATOM 2062 CG1 VAL B 373 2.037 -17.333 5.528 1.00 0.00 C ATOM 2063 CG2 VAL B 373 2.376 -16.196 3.346 1.00 0.00 C ATOM 2064 OXT VAL B 373 3.683 -18.732 1.397 1.00 0.00 O ATOM 0 H VAL B 373 4.647 -16.809 3.822 1.00 0.00 H new ATOM 0 HA VAL B 373 3.427 -19.264 4.577 1.00 0.00 H new ATOM 0 HB VAL B 373 1.385 -18.070 3.583 1.00 0.00 H new ATOM 0 HG11 VAL B 373 1.192 -16.662 5.680 1.00 0.00 H new ATOM 0 HG12 VAL B 373 1.837 -18.285 6.020 1.00 0.00 H new ATOM 0 HG13 VAL B 373 2.936 -16.887 5.953 1.00 0.00 H new ATOM 0 HG21 VAL B 373 1.496 -15.592 3.566 1.00 0.00 H new ATOM 0 HG22 VAL B 373 3.267 -15.689 3.718 1.00 0.00 H new ATOM 0 HG23 VAL B 373 2.461 -16.334 2.268 1.00 0.00 H new