USER MOD reduce.3.24.130724 H: found=0, std=0, add=1066, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1056 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 27 THR OG1 : rot 39:sc= -1.9! USER MOD Set 1.2: B 5 GLN : amide:sc= -0.347! K(o=-2.2!,f=0.46) USER MOD Set 2.1: B 1 MET N :NH3+ 164:sc= -0.0425 (180deg=-0.725) USER MOD Set 2.2: B 3 ASN : amide:sc= -1.7 K(o=-1.7,f=-11!) USER MOD Set 3.1: A 70 HIS : no HD1:sc= -0.0138 X(o=-0.029,f=-0.37) USER MOD Set 3.2: A 71 HIS : no HD1:sc= -0.0151 X(o=-0.029,f=0.039) USER MOD Set 4.1: A 5 GLN : amide:sc= -0.966! K(o=-3.1!,f=1.2) USER MOD Set 4.2: B 27 THR OG1 : rot -130:sc= -2.1! USER MOD Single : A 1 MET CE :methyl 179:sc= 0 (180deg=-0.00145) USER MOD Single : A 1 MET N :NH3+ 132:sc= 0.0401 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= -2.49 K(o=-2.5,f=-1.2) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -0.48 K(o=-0.48,f=-1.3) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 33 SER OG : rot 180:sc= -0.933 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.0278) USER MOD Single : A 50 GLN : amide:sc= -0.905 K(o=-0.91,f=-4.2!) USER MOD Single : A 62 TYR OH : rot -54:sc= -0.316 USER MOD Single : A 66 HIS : no HD1:sc= -4.91! C(o=-4.9!,f=-4.7!) USER MOD Single : A 67 HIS : no HD1:sc= -0.596 X(o=-0.6,f=-0.75) USER MOD Single : A 68 HIS : no HD1:sc= -0.789 X(o=-0.79,f=-0.94) USER MOD Single : A 69 HIS : no HD1:sc= -2.29 K(o=-2.3,f=-0.75) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 10 THR OG1 : rot 160:sc= 0 USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 GLN : amide:sc= -0.0571 X(o=-0.057,f=0) USER MOD Single : B 17 SER OG : rot -109:sc= 0.00154 USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : B 33 SER OG : rot 176:sc= -0.826 USER MOD Single : B 35 LYS NZ :NH3+ 171:sc= -3.73! (180deg=-4.17!) USER MOD Single : B 38 LYS NZ :NH3+ -171:sc= -1.32 (180deg=-1.62!) USER MOD Single : B 47 LYS NZ :NH3+ -164:sc=-0.00856 (180deg=-0.273) USER MOD Single : B 50 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : B 62 TYR OH : rot 123:sc= -0.485 USER MOD Single : B 66 HIS : no HD1:sc= 0.538! C(o=0.54!,f=-4.8!) USER MOD Single : B 67 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 HIS : no HD1:sc= -0.0267 X(o=-0.027,f=-0.019) USER MOD Single : B 69 HIS : no HD1:sc= -2.79! K(o=-2.8!,f=0.19) USER MOD Single : B 70 HIS : no HD1:sc= -0.394 X(o=-0.39,f=-0.59) USER MOD Single : B 71 HIS : no HD1:sc= -4.26! C(o=-4.3!,f=-4.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -15.248 6.451 -14.545 1.00 0.00 N ATOM 2 CA MET A 1 -13.827 6.548 -14.096 1.00 0.00 C ATOM 3 C MET A 1 -13.711 7.521 -12.928 1.00 0.00 C ATOM 4 O MET A 1 -14.479 8.455 -12.788 1.00 0.00 O ATOM 5 CB MET A 1 -12.963 7.034 -15.263 1.00 0.00 C ATOM 6 CG MET A 1 -11.489 7.029 -14.855 1.00 0.00 C ATOM 7 SD MET A 1 -10.473 7.574 -16.252 1.00 0.00 S ATOM 8 CE MET A 1 -10.603 9.353 -15.948 1.00 0.00 C ATOM 0 H1 MET A 1 -15.292 6.546 -15.580 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.638 5.529 -14.265 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.804 7.211 -14.103 1.00 0.00 H new ATOM 0 HA MET A 1 -13.484 5.566 -13.769 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.112 6.390 -16.130 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.265 8.039 -15.557 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.335 7.688 -14.001 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.190 6.028 -14.543 1.00 0.00 H new ATOM 0 HE1 MET A 1 -10.024 9.893 -16.697 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.648 9.657 -16.008 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.215 9.582 -14.955 1.00 0.00 H new ATOM 20 N ASP A 2 -12.752 7.293 -12.077 1.00 0.00 N ATOM 21 CA ASP A 2 -12.573 8.178 -10.913 1.00 0.00 C ATOM 22 C ASP A 2 -11.195 7.952 -10.278 1.00 0.00 C ATOM 23 O ASP A 2 -10.379 7.203 -10.783 1.00 0.00 O ATOM 24 CB ASP A 2 -13.664 7.878 -9.898 1.00 0.00 C ATOM 25 CG ASP A 2 -13.676 6.397 -9.527 1.00 0.00 C ATOM 26 OD1 ASP A 2 -12.603 5.843 -9.338 1.00 0.00 O ATOM 27 OD2 ASP A 2 -14.755 5.843 -9.416 1.00 0.00 O ATOM 0 H ASP A 2 -12.084 6.525 -12.145 1.00 0.00 H new ATOM 0 HA ASP A 2 -12.638 9.218 -11.234 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -13.507 8.479 -9.002 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -14.634 8.162 -10.307 1.00 0.00 H new ATOM 32 N ASN A 3 -10.929 8.598 -9.169 1.00 0.00 N ATOM 33 CA ASN A 3 -9.607 8.436 -8.487 1.00 0.00 C ATOM 34 C ASN A 3 -9.740 7.447 -7.319 1.00 0.00 C ATOM 35 O ASN A 3 -8.830 7.266 -6.529 1.00 0.00 O ATOM 36 CB ASN A 3 -9.149 9.803 -7.964 1.00 0.00 C ATOM 37 CG ASN A 3 -10.265 10.454 -7.146 1.00 0.00 C ATOM 38 OD1 ASN A 3 -11.136 11.105 -7.693 1.00 0.00 O ATOM 39 ND2 ASN A 3 -10.278 10.305 -5.853 1.00 0.00 N ATOM 0 H ASN A 3 -11.576 9.235 -8.704 1.00 0.00 H new ATOM 0 HA ASN A 3 -8.873 8.047 -9.193 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -8.257 9.685 -7.348 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -8.876 10.448 -8.799 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -11.018 10.734 -5.298 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -9.548 9.759 -5.395 1.00 0.00 H new ATOM 46 N ARG A 4 -10.866 6.801 -7.203 1.00 0.00 N ATOM 47 CA ARG A 4 -11.055 5.826 -6.088 1.00 0.00 C ATOM 48 C ARG A 4 -10.087 4.660 -6.273 1.00 0.00 C ATOM 49 O ARG A 4 -9.831 4.218 -7.378 1.00 0.00 O ATOM 50 CB ARG A 4 -12.501 5.307 -6.105 1.00 0.00 C ATOM 51 CG ARG A 4 -13.483 6.473 -5.912 1.00 0.00 C ATOM 52 CD ARG A 4 -13.632 6.811 -4.420 1.00 0.00 C ATOM 53 NE ARG A 4 -14.366 5.711 -3.729 1.00 0.00 N ATOM 54 CZ ARG A 4 -15.662 5.607 -3.843 1.00 0.00 C ATOM 55 NH1 ARG A 4 -16.328 6.443 -4.594 1.00 0.00 N ATOM 56 NH2 ARG A 4 -16.292 4.661 -3.209 1.00 0.00 N ATOM 0 H ARG A 4 -11.664 6.904 -7.830 1.00 0.00 H new ATOM 0 HA ARG A 4 -10.859 6.313 -5.133 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -12.704 4.803 -7.050 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -12.640 4.570 -5.315 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -13.128 7.349 -6.455 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -14.455 6.211 -6.330 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -12.650 6.947 -3.968 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -14.170 7.751 -4.302 1.00 0.00 H new ATOM 0 HE ARG A 4 -13.851 5.036 -3.164 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -15.835 7.182 -5.095 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -17.341 6.357 -4.679 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -15.773 4.005 -2.626 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -17.305 4.576 -3.295 1.00 0.00 H new ATOM 70 N GLN A 5 -9.526 4.165 -5.197 1.00 0.00 N ATOM 71 CA GLN A 5 -8.548 3.043 -5.309 1.00 0.00 C ATOM 72 C GLN A 5 -8.830 1.980 -4.254 1.00 0.00 C ATOM 73 O GLN A 5 -9.281 2.263 -3.153 1.00 0.00 O ATOM 74 CB GLN A 5 -7.138 3.587 -5.106 1.00 0.00 C ATOM 75 CG GLN A 5 -6.784 4.505 -6.272 1.00 0.00 C ATOM 76 CD GLN A 5 -5.375 5.063 -6.072 1.00 0.00 C ATOM 77 OE1 GLN A 5 -5.126 5.808 -5.142 1.00 0.00 O ATOM 78 NE2 GLN A 5 -4.435 4.728 -6.908 1.00 0.00 N ATOM 0 H GLN A 5 -9.704 4.491 -4.247 1.00 0.00 H new ATOM 0 HA GLN A 5 -8.641 2.592 -6.297 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -7.078 4.134 -4.165 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -6.424 2.766 -5.044 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -6.839 3.955 -7.211 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -7.504 5.321 -6.338 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -4.644 4.104 -7.687 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -3.489 5.090 -6.784 1.00 0.00 H new ATOM 87 N PHE A 6 -8.555 0.749 -4.593 1.00 0.00 N ATOM 88 CA PHE A 6 -8.771 -0.381 -3.648 1.00 0.00 C ATOM 89 C PHE A 6 -7.413 -0.952 -3.276 1.00 0.00 C ATOM 90 O PHE A 6 -6.713 -1.505 -4.103 1.00 0.00 O ATOM 91 CB PHE A 6 -9.606 -1.455 -4.341 1.00 0.00 C ATOM 92 CG PHE A 6 -10.861 -0.826 -4.890 1.00 0.00 C ATOM 93 CD1 PHE A 6 -11.946 -0.572 -4.044 1.00 0.00 C ATOM 94 CD2 PHE A 6 -10.933 -0.481 -6.246 1.00 0.00 C ATOM 95 CE1 PHE A 6 -13.110 0.012 -4.560 1.00 0.00 C ATOM 96 CE2 PHE A 6 -12.095 0.103 -6.759 1.00 0.00 C ATOM 97 CZ PHE A 6 -13.181 0.356 -5.915 1.00 0.00 C ATOM 0 H PHE A 6 -8.183 0.476 -5.503 1.00 0.00 H new ATOM 0 HA PHE A 6 -9.293 -0.041 -2.753 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -9.033 -1.916 -5.146 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -9.860 -2.247 -3.636 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -11.886 -0.826 -2.996 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -10.090 -0.666 -6.895 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -13.954 0.197 -3.912 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -12.154 0.359 -7.807 1.00 0.00 H new ATOM 0 HZ PHE A 6 -14.075 0.817 -6.309 1.00 0.00 H new ATOM 107 N LEU A 7 -7.021 -0.812 -2.039 1.00 0.00 N ATOM 108 CA LEU A 7 -5.694 -1.331 -1.602 1.00 0.00 C ATOM 109 C LEU A 7 -5.911 -2.503 -0.652 1.00 0.00 C ATOM 110 O LEU A 7 -6.577 -2.385 0.360 1.00 0.00 O ATOM 111 CB LEU A 7 -4.939 -0.211 -0.880 1.00 0.00 C ATOM 112 CG LEU A 7 -3.446 -0.573 -0.738 1.00 0.00 C ATOM 113 CD1 LEU A 7 -2.643 0.689 -0.413 1.00 0.00 C ATOM 114 CD2 LEU A 7 -3.238 -1.627 0.371 1.00 0.00 C ATOM 0 H LEU A 7 -7.567 -0.357 -1.307 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.114 -1.665 -2.463 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -5.042 0.722 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.375 -0.046 0.105 1.00 0.00 H new ATOM 0 HG LEU A 7 -3.099 -0.996 -1.681 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.588 0.433 -0.313 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -2.765 1.415 -1.217 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -3.003 1.118 0.522 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.178 -1.866 0.452 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -3.594 -1.230 1.322 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -3.795 -2.530 0.123 1.00 0.00 H new ATOM 126 N SER A 8 -5.355 -3.642 -0.981 1.00 0.00 N ATOM 127 CA SER A 8 -5.512 -4.854 -0.120 1.00 0.00 C ATOM 128 C SER A 8 -4.161 -5.260 0.442 1.00 0.00 C ATOM 129 O SER A 8 -3.172 -5.320 -0.263 1.00 0.00 O ATOM 130 CB SER A 8 -6.081 -6.000 -0.951 1.00 0.00 C ATOM 131 OG SER A 8 -6.075 -7.193 -0.171 1.00 0.00 O ATOM 0 H SER A 8 -4.792 -3.785 -1.820 1.00 0.00 H new ATOM 0 HA SER A 8 -6.192 -4.627 0.701 1.00 0.00 H new ATOM 0 HB2 SER A 8 -7.097 -5.765 -1.270 1.00 0.00 H new ATOM 0 HB3 SER A 8 -5.488 -6.139 -1.855 1.00 0.00 H new ATOM 0 HG SER A 8 -6.441 -7.932 -0.700 1.00 0.00 H new ATOM 137 N LEU A 9 -4.109 -5.542 1.717 1.00 0.00 N ATOM 138 CA LEU A 9 -2.819 -5.949 2.344 1.00 0.00 C ATOM 139 C LEU A 9 -3.079 -7.057 3.363 1.00 0.00 C ATOM 140 O LEU A 9 -4.047 -7.030 4.109 1.00 0.00 O ATOM 141 CB LEU A 9 -2.181 -4.746 3.041 1.00 0.00 C ATOM 142 CG LEU A 9 -0.780 -5.124 3.555 1.00 0.00 C ATOM 143 CD1 LEU A 9 0.174 -5.404 2.374 1.00 0.00 C ATOM 144 CD2 LEU A 9 -0.228 -3.976 4.405 1.00 0.00 C ATOM 0 H LEU A 9 -4.907 -5.508 2.352 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.141 -6.316 1.574 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.110 -3.908 2.348 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -2.808 -4.421 3.871 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.856 -6.028 4.159 1.00 0.00 H new ATOM 0 HD11 LEU A 9 1.159 -5.669 2.757 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.217 -6.228 1.778 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.255 -4.512 1.752 1.00 0.00 H new ATOM 0 HD21 LEU A 9 0.764 -4.239 4.771 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -0.163 -3.073 3.798 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -0.892 -3.798 5.251 1.00 0.00 H new ATOM 156 N THR A 10 -2.215 -8.038 3.393 1.00 0.00 N ATOM 157 CA THR A 10 -2.372 -9.180 4.346 1.00 0.00 C ATOM 158 C THR A 10 -1.053 -9.414 5.081 1.00 0.00 C ATOM 159 O THR A 10 -0.030 -8.865 4.730 1.00 0.00 O ATOM 160 CB THR A 10 -2.747 -10.439 3.558 1.00 0.00 C ATOM 161 OG1 THR A 10 -1.568 -11.036 3.042 1.00 0.00 O ATOM 162 CG2 THR A 10 -3.680 -10.066 2.403 1.00 0.00 C ATOM 0 H THR A 10 -1.395 -8.098 2.789 1.00 0.00 H new ATOM 0 HA THR A 10 -3.154 -8.952 5.071 1.00 0.00 H new ATOM 0 HB THR A 10 -3.256 -11.143 4.217 1.00 0.00 H new ATOM 0 HG1 THR A 10 -1.803 -11.843 2.538 1.00 0.00 H new ATOM 0 HG21 THR A 10 -3.945 -10.964 1.845 1.00 0.00 H new ATOM 0 HG22 THR A 10 -4.585 -9.606 2.800 1.00 0.00 H new ATOM 0 HG23 THR A 10 -3.176 -9.362 1.741 1.00 0.00 H new ATOM 170 N GLY A 11 -1.077 -10.217 6.112 1.00 0.00 N ATOM 171 CA GLY A 11 0.169 -10.491 6.893 1.00 0.00 C ATOM 172 C GLY A 11 0.380 -9.371 7.914 1.00 0.00 C ATOM 173 O GLY A 11 1.441 -9.227 8.495 1.00 0.00 O ATOM 0 H GLY A 11 -1.910 -10.698 6.450 1.00 0.00 H new ATOM 0 HA2 GLY A 11 0.090 -11.452 7.401 1.00 0.00 H new ATOM 0 HA3 GLY A 11 1.026 -10.554 6.223 1.00 0.00 H new ATOM 177 N VAL A 12 -0.624 -8.577 8.140 1.00 0.00 N ATOM 178 CA VAL A 12 -0.501 -7.464 9.123 1.00 0.00 C ATOM 179 C VAL A 12 -0.370 -8.035 10.538 1.00 0.00 C ATOM 180 O VAL A 12 -1.096 -8.925 10.937 1.00 0.00 O ATOM 181 CB VAL A 12 -1.744 -6.574 9.026 1.00 0.00 C ATOM 182 CG1 VAL A 12 -1.720 -5.514 10.129 1.00 0.00 C ATOM 183 CG2 VAL A 12 -1.761 -5.882 7.660 1.00 0.00 C ATOM 0 H VAL A 12 -1.533 -8.650 7.683 1.00 0.00 H new ATOM 0 HA VAL A 12 0.387 -6.872 8.902 1.00 0.00 H new ATOM 0 HB VAL A 12 -2.636 -7.190 9.144 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -2.608 -4.887 10.050 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.706 -6.003 11.103 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -0.829 -4.896 10.020 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -2.644 -5.247 7.585 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -0.864 -5.272 7.550 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -1.787 -6.634 6.871 1.00 0.00 H new ATOM 193 N SER A 13 0.559 -7.527 11.302 1.00 0.00 N ATOM 194 CA SER A 13 0.745 -8.029 12.693 1.00 0.00 C ATOM 195 C SER A 13 -0.429 -7.565 13.556 1.00 0.00 C ATOM 196 O SER A 13 -0.974 -8.314 14.341 1.00 0.00 O ATOM 197 CB SER A 13 2.049 -7.467 13.253 1.00 0.00 C ATOM 198 OG SER A 13 2.255 -7.969 14.568 1.00 0.00 O ATOM 0 H SER A 13 1.199 -6.784 11.021 1.00 0.00 H new ATOM 0 HA SER A 13 0.786 -9.118 12.695 1.00 0.00 H new ATOM 0 HB2 SER A 13 2.884 -7.747 12.610 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.011 -6.378 13.270 1.00 0.00 H new ATOM 0 HG SER A 13 3.093 -7.610 14.928 1.00 0.00 H new ATOM 204 N LYS A 14 -0.828 -6.333 13.412 1.00 0.00 N ATOM 205 CA LYS A 14 -1.975 -5.832 14.219 1.00 0.00 C ATOM 206 C LYS A 14 -2.340 -4.413 13.785 1.00 0.00 C ATOM 207 O LYS A 14 -1.576 -3.734 13.128 1.00 0.00 O ATOM 208 CB LYS A 14 -1.615 -5.829 15.712 1.00 0.00 C ATOM 209 CG LYS A 14 -0.259 -5.110 15.944 1.00 0.00 C ATOM 210 CD LYS A 14 -0.475 -3.849 16.800 1.00 0.00 C ATOM 211 CE LYS A 14 -0.903 -4.240 18.231 1.00 0.00 C ATOM 212 NZ LYS A 14 0.214 -3.944 19.166 1.00 0.00 N ATOM 0 H LYS A 14 -0.412 -5.654 12.774 1.00 0.00 H new ATOM 0 HA LYS A 14 -2.827 -6.493 14.056 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.400 -5.330 16.280 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -1.558 -6.853 16.080 1.00 0.00 H new ATOM 0 HG2 LYS A 14 0.439 -5.783 16.442 1.00 0.00 H new ATOM 0 HG3 LYS A 14 0.187 -4.839 14.987 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.444 -3.263 16.835 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -1.238 -3.218 16.344 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -1.795 -3.686 18.522 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -1.158 -5.299 18.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.065 -4.204 20.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.053 -4.492 18.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.436 -2.929 19.131 1.00 0.00 H new ATOM 226 N VAL A 15 -3.507 -3.959 14.157 1.00 0.00 N ATOM 227 CA VAL A 15 -3.939 -2.582 13.778 1.00 0.00 C ATOM 228 C VAL A 15 -3.480 -1.577 14.837 1.00 0.00 C ATOM 229 O VAL A 15 -3.971 -1.555 15.951 1.00 0.00 O ATOM 230 CB VAL A 15 -5.462 -2.548 13.657 1.00 0.00 C ATOM 231 CG1 VAL A 15 -5.916 -1.123 13.335 1.00 0.00 C ATOM 232 CG2 VAL A 15 -5.903 -3.486 12.530 1.00 0.00 C ATOM 0 H VAL A 15 -4.183 -4.486 14.710 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.490 -2.313 12.822 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.909 -2.870 14.598 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -7.002 -1.098 13.249 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.600 -0.451 14.133 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -5.470 -0.803 12.394 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.989 -3.463 12.442 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.456 -3.161 11.590 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.578 -4.502 12.754 1.00 0.00 H new ATOM 242 N GLN A 16 -2.553 -0.731 14.485 1.00 0.00 N ATOM 243 CA GLN A 16 -2.061 0.292 15.446 1.00 0.00 C ATOM 244 C GLN A 16 -3.184 1.295 15.729 1.00 0.00 C ATOM 245 O GLN A 16 -3.284 1.855 16.803 1.00 0.00 O ATOM 246 CB GLN A 16 -0.863 1.014 14.825 1.00 0.00 C ATOM 247 CG GLN A 16 -0.232 1.971 15.842 1.00 0.00 C ATOM 248 CD GLN A 16 0.413 1.167 16.971 1.00 0.00 C ATOM 249 OE1 GLN A 16 -0.254 0.760 17.901 1.00 0.00 O ATOM 250 NE2 GLN A 16 1.693 0.916 16.927 1.00 0.00 N ATOM 0 H GLN A 16 -2.112 -0.705 13.565 1.00 0.00 H new ATOM 0 HA GLN A 16 -1.758 -0.181 16.380 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -0.123 0.286 14.493 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.182 1.569 13.943 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.516 2.596 15.353 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -0.991 2.640 16.246 1.00 0.00 H new ATOM 0 HE21 GLN A 16 2.253 1.258 16.146 1.00 0.00 H new ATOM 0 HE22 GLN A 16 2.133 0.378 17.674 1.00 0.00 H new ATOM 259 N SER A 17 -4.029 1.528 14.769 1.00 0.00 N ATOM 260 CA SER A 17 -5.142 2.498 14.979 1.00 0.00 C ATOM 261 C SER A 17 -6.153 2.372 13.837 1.00 0.00 C ATOM 262 O SER A 17 -5.845 1.872 12.772 1.00 0.00 O ATOM 263 CB SER A 17 -4.595 3.923 15.014 1.00 0.00 C ATOM 264 OG SER A 17 -5.613 4.803 15.478 1.00 0.00 O ATOM 0 H SER A 17 -4.000 1.091 13.848 1.00 0.00 H new ATOM 0 HA SER A 17 -5.630 2.278 15.928 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.725 3.976 15.669 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.264 4.223 14.020 1.00 0.00 H new ATOM 0 HG SER A 17 -5.266 5.719 15.504 1.00 0.00 H new ATOM 270 N PHE A 18 -7.362 2.822 14.053 1.00 0.00 N ATOM 271 CA PHE A 18 -8.408 2.729 12.988 1.00 0.00 C ATOM 272 C PHE A 18 -9.220 4.025 12.962 1.00 0.00 C ATOM 273 O PHE A 18 -10.038 4.279 13.827 1.00 0.00 O ATOM 274 CB PHE A 18 -9.317 1.521 13.285 1.00 0.00 C ATOM 275 CG PHE A 18 -10.693 1.700 12.666 1.00 0.00 C ATOM 276 CD1 PHE A 18 -10.829 2.257 11.387 1.00 0.00 C ATOM 277 CD2 PHE A 18 -11.834 1.320 13.386 1.00 0.00 C ATOM 278 CE1 PHE A 18 -12.099 2.432 10.831 1.00 0.00 C ATOM 279 CE2 PHE A 18 -13.104 1.497 12.829 1.00 0.00 C ATOM 280 CZ PHE A 18 -13.238 2.051 11.551 1.00 0.00 C ATOM 0 H PHE A 18 -7.672 3.252 14.924 1.00 0.00 H new ATOM 0 HA PHE A 18 -7.944 2.591 12.011 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -8.857 0.613 12.897 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -9.415 1.393 14.363 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -9.951 2.551 10.831 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -11.732 0.890 14.372 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -12.202 2.861 9.845 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -13.983 1.206 13.386 1.00 0.00 H new ATOM 0 HZ PHE A 18 -14.219 2.185 11.120 1.00 0.00 H new ATOM 290 N ASP A 19 -9.011 4.836 11.956 1.00 0.00 N ATOM 291 CA ASP A 19 -9.771 6.117 11.828 1.00 0.00 C ATOM 292 C ASP A 19 -10.265 6.245 10.372 1.00 0.00 C ATOM 293 O ASP A 19 -9.578 5.842 9.455 1.00 0.00 O ATOM 294 CB ASP A 19 -8.840 7.300 12.190 1.00 0.00 C ATOM 295 CG ASP A 19 -9.592 8.336 13.040 1.00 0.00 C ATOM 296 OD1 ASP A 19 -10.294 7.926 13.950 1.00 0.00 O ATOM 297 OD2 ASP A 19 -9.455 9.515 12.761 1.00 0.00 O ATOM 0 H ASP A 19 -8.338 4.663 11.209 1.00 0.00 H new ATOM 0 HA ASP A 19 -10.626 6.128 12.504 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -7.972 6.933 12.737 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -8.468 7.769 11.279 1.00 0.00 H new ATOM 302 N PRO A 20 -11.430 6.809 10.148 1.00 0.00 N ATOM 303 CA PRO A 20 -11.982 6.990 8.770 1.00 0.00 C ATOM 304 C PRO A 20 -11.205 8.058 7.985 1.00 0.00 C ATOM 305 O PRO A 20 -11.336 8.176 6.781 1.00 0.00 O ATOM 306 CB PRO A 20 -13.434 7.431 9.012 1.00 0.00 C ATOM 307 CG PRO A 20 -13.428 8.055 10.372 1.00 0.00 C ATOM 308 CD PRO A 20 -12.353 7.322 11.173 1.00 0.00 C ATOM 0 HA PRO A 20 -11.908 6.082 8.171 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -13.762 8.141 8.253 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -14.116 6.582 8.970 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -13.208 9.121 10.310 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -14.403 7.958 10.849 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -11.846 7.993 11.867 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -12.780 6.513 11.766 1.00 0.00 H new ATOM 316 N LYS A 21 -10.398 8.834 8.659 1.00 0.00 N ATOM 317 CA LYS A 21 -9.597 9.898 7.975 1.00 0.00 C ATOM 318 C LYS A 21 -8.110 9.565 8.110 1.00 0.00 C ATOM 319 O LYS A 21 -7.250 10.266 7.610 1.00 0.00 O ATOM 320 CB LYS A 21 -9.888 11.246 8.634 1.00 0.00 C ATOM 321 CG LYS A 21 -11.329 11.666 8.319 1.00 0.00 C ATOM 322 CD LYS A 21 -11.674 12.960 9.073 1.00 0.00 C ATOM 323 CE LYS A 21 -11.035 14.167 8.375 1.00 0.00 C ATOM 324 NZ LYS A 21 -11.573 15.423 8.966 1.00 0.00 N ATOM 0 H LYS A 21 -10.256 8.777 9.668 1.00 0.00 H new ATOM 0 HA LYS A 21 -9.864 9.948 6.919 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.746 11.174 9.712 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.190 12.000 8.270 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -11.446 11.818 7.246 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.019 10.873 8.606 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -12.756 13.087 9.116 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.319 12.896 10.102 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -9.951 14.134 8.488 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -11.245 14.136 7.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -11.140 16.242 8.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -12.604 15.454 8.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -11.351 15.452 9.982 1.00 0.00 H new ATOM 338 N GLU A 22 -7.799 8.497 8.787 1.00 0.00 N ATOM 339 CA GLU A 22 -6.368 8.112 8.960 1.00 0.00 C ATOM 340 C GLU A 22 -6.295 6.698 9.547 1.00 0.00 C ATOM 341 O GLU A 22 -6.654 6.469 10.685 1.00 0.00 O ATOM 342 CB GLU A 22 -5.672 9.097 9.905 1.00 0.00 C ATOM 343 CG GLU A 22 -4.181 8.760 9.971 1.00 0.00 C ATOM 344 CD GLU A 22 -3.437 9.846 10.751 1.00 0.00 C ATOM 345 OE1 GLU A 22 -4.090 10.578 11.477 1.00 0.00 O ATOM 346 OE2 GLU A 22 -2.228 9.921 10.615 1.00 0.00 O ATOM 0 H GLU A 22 -8.473 7.872 9.229 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.867 8.136 7.992 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.811 10.119 9.552 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.115 9.040 10.899 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -4.039 7.792 10.452 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.772 8.679 8.964 1.00 0.00 H new ATOM 353 N ILE A 23 -5.829 5.743 8.777 1.00 0.00 N ATOM 354 CA ILE A 23 -5.734 4.333 9.281 1.00 0.00 C ATOM 355 C ILE A 23 -4.266 3.937 9.411 1.00 0.00 C ATOM 356 O ILE A 23 -3.481 4.102 8.496 1.00 0.00 O ATOM 357 CB ILE A 23 -6.432 3.387 8.302 1.00 0.00 C ATOM 358 CG1 ILE A 23 -7.913 3.767 8.205 1.00 0.00 C ATOM 359 CG2 ILE A 23 -6.309 1.948 8.811 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.586 2.950 7.102 1.00 0.00 C ATOM 0 H ILE A 23 -5.509 5.879 7.818 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.218 4.265 10.255 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.967 3.466 7.319 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.408 3.584 9.159 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.012 4.832 7.993 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.806 1.272 8.115 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -5.256 1.679 8.889 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -6.778 1.868 9.792 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.639 3.224 7.037 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -8.098 3.155 6.149 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.501 1.888 7.332 1.00 0.00 H new ATOM 372 N LEU A 24 -3.890 3.411 10.549 1.00 0.00 N ATOM 373 CA LEU A 24 -2.469 2.990 10.771 1.00 0.00 C ATOM 374 C LEU A 24 -2.416 1.475 10.911 1.00 0.00 C ATOM 375 O LEU A 24 -3.073 0.897 11.755 1.00 0.00 O ATOM 376 CB LEU A 24 -1.951 3.629 12.058 1.00 0.00 C ATOM 377 CG LEU A 24 -2.147 5.147 11.993 1.00 0.00 C ATOM 378 CD1 LEU A 24 -1.633 5.781 13.288 1.00 0.00 C ATOM 379 CD2 LEU A 24 -1.381 5.717 10.795 1.00 0.00 C ATOM 0 H LEU A 24 -4.511 3.253 11.342 1.00 0.00 H new ATOM 0 HA LEU A 24 -1.854 3.307 9.929 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -2.481 3.220 12.918 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.895 3.394 12.193 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.207 5.372 11.876 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.771 6.861 13.244 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -2.188 5.378 14.135 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.573 5.556 13.408 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.523 6.797 10.753 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.319 5.495 10.903 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.755 5.265 9.876 1.00 0.00 H new ATOM 391 N LEU A 25 -1.633 0.826 10.088 1.00 0.00 N ATOM 392 CA LEU A 25 -1.517 -0.666 10.154 1.00 0.00 C ATOM 393 C LEU A 25 -0.069 -1.041 10.415 1.00 0.00 C ATOM 394 O LEU A 25 0.835 -0.622 9.714 1.00 0.00 O ATOM 395 CB LEU A 25 -1.969 -1.272 8.822 1.00 0.00 C ATOM 396 CG LEU A 25 -3.388 -0.797 8.496 1.00 0.00 C ATOM 397 CD1 LEU A 25 -3.816 -1.374 7.145 1.00 0.00 C ATOM 398 CD2 LEU A 25 -4.365 -1.266 9.587 1.00 0.00 C ATOM 0 H LEU A 25 -1.063 1.268 9.366 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.146 -1.049 10.957 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.285 -0.978 8.026 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.943 -2.360 8.879 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.401 0.292 8.453 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.826 -1.038 6.909 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.130 -1.033 6.370 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.798 -2.463 7.192 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.371 -0.923 9.346 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.356 -2.355 9.640 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -4.062 -0.853 10.549 1.00 0.00 H new ATOM 410 N GLU A 26 0.166 -1.834 11.423 1.00 0.00 N ATOM 411 CA GLU A 26 1.559 -2.251 11.740 1.00 0.00 C ATOM 412 C GLU A 26 1.837 -3.593 11.077 1.00 0.00 C ATOM 413 O GLU A 26 1.190 -4.589 11.363 1.00 0.00 O ATOM 414 CB GLU A 26 1.729 -2.375 13.256 1.00 0.00 C ATOM 415 CG GLU A 26 3.217 -2.562 13.619 1.00 0.00 C ATOM 416 CD GLU A 26 3.598 -4.047 13.526 1.00 0.00 C ATOM 417 OE1 GLU A 26 3.872 -4.502 12.427 1.00 0.00 O ATOM 418 OE2 GLU A 26 3.615 -4.698 14.556 1.00 0.00 O ATOM 0 H GLU A 26 -0.550 -2.212 12.043 1.00 0.00 H new ATOM 0 HA GLU A 26 2.261 -1.505 11.366 1.00 0.00 H new ATOM 0 HB2 GLU A 26 1.338 -1.483 13.746 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.149 -3.221 13.625 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.841 -1.975 12.945 1.00 0.00 H new ATOM 0 HG3 GLU A 26 3.403 -2.193 14.628 1.00 0.00 H new ATOM 425 N THR A 27 2.795 -3.622 10.185 1.00 0.00 N ATOM 426 CA THR A 27 3.141 -4.883 9.462 1.00 0.00 C ATOM 427 C THR A 27 4.569 -5.310 9.791 1.00 0.00 C ATOM 428 O THR A 27 5.408 -4.500 10.135 1.00 0.00 O ATOM 429 CB THR A 27 3.023 -4.646 7.956 1.00 0.00 C ATOM 430 OG1 THR A 27 3.502 -5.791 7.266 1.00 0.00 O ATOM 431 CG2 THR A 27 3.856 -3.423 7.558 1.00 0.00 C ATOM 0 H THR A 27 3.360 -2.814 9.924 1.00 0.00 H new ATOM 0 HA THR A 27 2.455 -5.670 9.774 1.00 0.00 H new ATOM 0 HB THR A 27 1.980 -4.468 7.695 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.221 -6.601 7.741 1.00 0.00 H new ATOM 0 HG21 THR A 27 3.769 -3.258 6.484 1.00 0.00 H new ATOM 0 HG22 THR A 27 3.491 -2.545 8.091 1.00 0.00 H new ATOM 0 HG23 THR A 27 4.901 -3.595 7.815 1.00 0.00 H new ATOM 439 N ILE A 28 4.829 -6.592 9.673 1.00 0.00 N ATOM 440 CA ILE A 28 6.189 -7.160 9.962 1.00 0.00 C ATOM 441 C ILE A 28 6.873 -6.393 11.106 1.00 0.00 C ATOM 442 O ILE A 28 6.807 -6.779 12.257 1.00 0.00 O ATOM 443 CB ILE A 28 7.070 -7.087 8.706 1.00 0.00 C ATOM 444 CG1 ILE A 28 6.324 -7.675 7.503 1.00 0.00 C ATOM 445 CG2 ILE A 28 8.361 -7.877 8.942 1.00 0.00 C ATOM 446 CD1 ILE A 28 5.797 -9.075 7.827 1.00 0.00 C ATOM 0 H ILE A 28 4.140 -7.285 9.382 1.00 0.00 H new ATOM 0 HA ILE A 28 6.062 -8.200 10.262 1.00 0.00 H new ATOM 0 HB ILE A 28 7.310 -6.044 8.500 1.00 0.00 H new ATOM 0 HG12 ILE A 28 5.495 -7.023 7.229 1.00 0.00 H new ATOM 0 HG13 ILE A 28 6.991 -7.722 6.642 1.00 0.00 H new ATOM 0 HG21 ILE A 28 8.987 -7.826 8.051 1.00 0.00 H new ATOM 0 HG22 ILE A 28 8.899 -7.450 9.789 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.117 -8.918 9.155 1.00 0.00 H new ATOM 0 HD11 ILE A 28 5.271 -9.475 6.960 1.00 0.00 H new ATOM 0 HD12 ILE A 28 6.632 -9.729 8.078 1.00 0.00 H new ATOM 0 HD13 ILE A 28 5.113 -9.019 8.673 1.00 0.00 H new ATOM 458 N GLN A 29 7.534 -5.314 10.792 1.00 0.00 N ATOM 459 CA GLN A 29 8.231 -4.508 11.834 1.00 0.00 C ATOM 460 C GLN A 29 8.012 -3.020 11.541 1.00 0.00 C ATOM 461 O GLN A 29 8.212 -2.167 12.387 1.00 0.00 O ATOM 462 CB GLN A 29 9.734 -4.819 11.777 1.00 0.00 C ATOM 463 CG GLN A 29 10.240 -4.634 10.339 1.00 0.00 C ATOM 464 CD GLN A 29 11.747 -4.907 10.280 1.00 0.00 C ATOM 465 OE1 GLN A 29 12.461 -4.658 11.232 1.00 0.00 O ATOM 466 NE2 GLN A 29 12.267 -5.414 9.192 1.00 0.00 N ATOM 0 H GLN A 29 7.622 -4.951 9.843 1.00 0.00 H new ATOM 0 HA GLN A 29 7.839 -4.751 12.822 1.00 0.00 H new ATOM 0 HB2 GLN A 29 10.279 -4.160 12.453 1.00 0.00 H new ATOM 0 HB3 GLN A 29 9.918 -5.840 12.110 1.00 0.00 H new ATOM 0 HG2 GLN A 29 9.712 -5.311 9.668 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.031 -3.620 9.998 1.00 0.00 H new ATOM 0 HE21 GLN A 29 11.671 -5.624 8.392 1.00 0.00 H new ATOM 0 HE22 GLN A 29 13.269 -5.599 9.144 1.00 0.00 H new ATOM 475 N GLY A 30 7.612 -2.692 10.338 1.00 0.00 N ATOM 476 CA GLY A 30 7.398 -1.255 9.977 1.00 0.00 C ATOM 477 C GLY A 30 5.929 -0.867 10.142 1.00 0.00 C ATOM 478 O GLY A 30 5.060 -1.704 10.295 1.00 0.00 O ATOM 0 H GLY A 30 7.424 -3.358 9.588 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.020 -0.620 10.609 1.00 0.00 H new ATOM 0 HA3 GLY A 30 7.711 -1.084 8.947 1.00 0.00 H new ATOM 482 N VAL A 31 5.648 0.415 10.104 1.00 0.00 N ATOM 483 CA VAL A 31 4.244 0.903 10.248 1.00 0.00 C ATOM 484 C VAL A 31 3.853 1.684 9.003 1.00 0.00 C ATOM 485 O VAL A 31 4.586 2.535 8.534 1.00 0.00 O ATOM 486 CB VAL A 31 4.134 1.812 11.470 1.00 0.00 C ATOM 487 CG1 VAL A 31 2.775 2.528 11.467 1.00 0.00 C ATOM 488 CG2 VAL A 31 4.261 0.965 12.737 1.00 0.00 C ATOM 0 H VAL A 31 6.343 1.151 9.978 1.00 0.00 H new ATOM 0 HA VAL A 31 3.577 0.050 10.373 1.00 0.00 H new ATOM 0 HB VAL A 31 4.929 2.557 11.441 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.703 3.175 12.341 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.682 3.129 10.562 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.974 1.789 11.495 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.183 1.608 13.614 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.463 0.222 12.760 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.227 0.460 12.742 1.00 0.00 H new ATOM 498 N LEU A 32 2.695 1.401 8.468 1.00 0.00 N ATOM 499 CA LEU A 32 2.225 2.120 7.248 1.00 0.00 C ATOM 500 C LEU A 32 1.026 2.993 7.610 1.00 0.00 C ATOM 501 O LEU A 32 0.094 2.550 8.257 1.00 0.00 O ATOM 502 CB LEU A 32 1.813 1.103 6.183 1.00 0.00 C ATOM 503 CG LEU A 32 1.332 1.836 4.917 1.00 0.00 C ATOM 504 CD1 LEU A 32 2.459 2.723 4.358 1.00 0.00 C ATOM 505 CD2 LEU A 32 0.912 0.804 3.867 1.00 0.00 C ATOM 0 H LEU A 32 2.050 0.697 8.827 1.00 0.00 H new ATOM 0 HA LEU A 32 3.029 2.745 6.859 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.656 0.455 5.941 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.019 0.463 6.567 1.00 0.00 H new ATOM 0 HG LEU A 32 0.481 2.470 5.168 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.108 3.237 3.463 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.749 3.459 5.108 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.319 2.103 4.106 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.570 1.318 2.968 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.763 0.169 3.621 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.103 0.190 4.263 1.00 0.00 H new ATOM 517 N SER A 33 1.046 4.233 7.195 1.00 0.00 N ATOM 518 CA SER A 33 -0.085 5.162 7.497 1.00 0.00 C ATOM 519 C SER A 33 -0.760 5.577 6.194 1.00 0.00 C ATOM 520 O SER A 33 -0.113 5.995 5.246 1.00 0.00 O ATOM 521 CB SER A 33 0.458 6.400 8.202 1.00 0.00 C ATOM 522 OG SER A 33 -0.627 7.253 8.552 1.00 0.00 O ATOM 0 H SER A 33 1.806 4.646 6.654 1.00 0.00 H new ATOM 0 HA SER A 33 -0.810 4.662 8.139 1.00 0.00 H new ATOM 0 HB2 SER A 33 1.012 6.111 9.095 1.00 0.00 H new ATOM 0 HB3 SER A 33 1.156 6.927 7.551 1.00 0.00 H new ATOM 0 HG SER A 33 -0.283 8.050 9.007 1.00 0.00 H new ATOM 528 N ILE A 34 -2.063 5.460 6.142 1.00 0.00 N ATOM 529 CA ILE A 34 -2.827 5.836 4.913 1.00 0.00 C ATOM 530 C ILE A 34 -3.691 7.056 5.206 1.00 0.00 C ATOM 531 O ILE A 34 -4.386 7.114 6.203 1.00 0.00 O ATOM 532 CB ILE A 34 -3.724 4.676 4.493 1.00 0.00 C ATOM 533 CG1 ILE A 34 -2.853 3.460 4.163 1.00 0.00 C ATOM 534 CG2 ILE A 34 -4.525 5.082 3.255 1.00 0.00 C ATOM 535 CD1 ILE A 34 -3.738 2.229 3.964 1.00 0.00 C ATOM 0 H ILE A 34 -2.638 5.115 6.910 1.00 0.00 H new ATOM 0 HA ILE A 34 -2.127 6.065 4.110 1.00 0.00 H new ATOM 0 HB ILE A 34 -4.408 4.425 5.303 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -2.272 3.651 3.261 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -2.141 3.281 4.969 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.168 4.256 2.951 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.138 5.953 3.488 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -3.840 5.327 2.443 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -3.114 1.366 3.729 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.300 2.033 4.877 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -4.432 2.409 3.143 1.00 0.00 H new ATOM 547 N LYS A 35 -3.650 8.036 4.342 1.00 0.00 N ATOM 548 CA LYS A 35 -4.465 9.273 4.549 1.00 0.00 C ATOM 549 C LYS A 35 -5.215 9.607 3.268 1.00 0.00 C ATOM 550 O LYS A 35 -4.741 9.370 2.171 1.00 0.00 O ATOM 551 CB LYS A 35 -3.545 10.435 4.909 1.00 0.00 C ATOM 552 CG LYS A 35 -2.937 10.193 6.292 1.00 0.00 C ATOM 553 CD LYS A 35 -1.934 11.309 6.622 1.00 0.00 C ATOM 554 CE LYS A 35 -2.677 12.590 7.020 1.00 0.00 C ATOM 555 NZ LYS A 35 -1.715 13.553 7.626 1.00 0.00 N ATOM 0 H LYS A 35 -3.083 8.034 3.494 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.177 9.105 5.357 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.755 10.532 4.164 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.104 11.371 4.904 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.724 10.164 7.045 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -2.438 9.224 6.316 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -1.281 10.992 7.435 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.298 11.503 5.759 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -3.151 13.035 6.145 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -3.471 12.357 7.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -2.218 14.422 7.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -1.282 13.127 8.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -0.973 13.783 6.935 1.00 0.00 H new ATOM 569 N GLY A 36 -6.389 10.155 3.397 1.00 0.00 N ATOM 570 CA GLY A 36 -7.182 10.507 2.194 1.00 0.00 C ATOM 571 C GLY A 36 -8.607 10.864 2.600 1.00 0.00 C ATOM 572 O GLY A 36 -8.851 11.400 3.664 1.00 0.00 O ATOM 0 H GLY A 36 -6.833 10.374 4.289 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.720 11.348 1.676 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.192 9.670 1.496 1.00 0.00 H new ATOM 576 N GLU A 37 -9.547 10.578 1.741 1.00 0.00 N ATOM 577 CA GLU A 37 -10.977 10.906 2.015 1.00 0.00 C ATOM 578 C GLU A 37 -11.811 9.618 2.040 1.00 0.00 C ATOM 579 O GLU A 37 -11.655 8.739 1.213 1.00 0.00 O ATOM 580 CB GLU A 37 -11.504 11.843 0.899 1.00 0.00 C ATOM 581 CG GLU A 37 -10.369 12.721 0.346 1.00 0.00 C ATOM 582 CD GLU A 37 -9.931 13.726 1.409 1.00 0.00 C ATOM 583 OE1 GLU A 37 -9.659 13.305 2.520 1.00 0.00 O ATOM 584 OE2 GLU A 37 -9.875 14.902 1.090 1.00 0.00 O ATOM 0 H GLU A 37 -9.382 10.122 0.844 1.00 0.00 H new ATOM 0 HA GLU A 37 -11.058 11.401 2.983 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -11.937 11.250 0.094 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -12.300 12.475 1.293 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.525 12.098 0.051 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -10.705 13.246 -0.548 1.00 0.00 H new ATOM 591 N LYS A 38 -12.701 9.516 2.986 1.00 0.00 N ATOM 592 CA LYS A 38 -13.573 8.310 3.090 1.00 0.00 C ATOM 593 C LYS A 38 -12.720 7.036 3.057 1.00 0.00 C ATOM 594 O LYS A 38 -12.727 6.281 2.106 1.00 0.00 O ATOM 595 CB LYS A 38 -14.572 8.304 1.931 1.00 0.00 C ATOM 596 CG LYS A 38 -15.318 9.644 1.888 1.00 0.00 C ATOM 597 CD LYS A 38 -16.170 9.816 3.153 1.00 0.00 C ATOM 598 CE LYS A 38 -17.188 10.937 2.941 1.00 0.00 C ATOM 599 NZ LYS A 38 -18.087 11.007 4.127 1.00 0.00 N ATOM 0 H LYS A 38 -12.865 10.225 3.701 1.00 0.00 H new ATOM 0 HA LYS A 38 -14.116 8.339 4.035 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -14.050 8.136 0.989 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -15.281 7.485 2.053 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.604 10.464 1.807 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.954 9.687 1.004 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -16.685 8.884 3.386 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.531 10.049 4.005 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -16.676 11.889 2.800 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -17.770 10.751 2.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -18.783 11.768 3.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -18.583 10.100 4.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -17.523 11.202 4.979 1.00 0.00 H new ATOM 613 N LEU A 39 -11.996 6.788 4.115 1.00 0.00 N ATOM 614 CA LEU A 39 -11.146 5.561 4.197 1.00 0.00 C ATOM 615 C LEU A 39 -11.898 4.507 5.004 1.00 0.00 C ATOM 616 O LEU A 39 -11.574 4.229 6.142 1.00 0.00 O ATOM 617 CB LEU A 39 -9.818 5.907 4.883 1.00 0.00 C ATOM 618 CG LEU A 39 -8.859 6.525 3.861 1.00 0.00 C ATOM 619 CD1 LEU A 39 -9.550 7.680 3.135 1.00 0.00 C ATOM 620 CD2 LEU A 39 -7.616 7.045 4.584 1.00 0.00 C ATOM 0 H LEU A 39 -11.956 7.390 4.937 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.934 5.176 3.200 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -9.991 6.604 5.703 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.376 5.010 5.316 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.569 5.768 3.133 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.864 8.116 2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.435 7.308 2.619 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.844 8.440 3.858 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -6.931 7.486 3.859 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.909 7.801 5.313 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.121 6.220 5.096 1.00 0.00 H new ATOM 632 N GLY A 40 -12.925 3.933 4.423 1.00 0.00 N ATOM 633 CA GLY A 40 -13.740 2.903 5.149 1.00 0.00 C ATOM 634 C GLY A 40 -13.759 1.595 4.364 1.00 0.00 C ATOM 635 O GLY A 40 -12.991 1.389 3.446 1.00 0.00 O ATOM 0 H GLY A 40 -13.236 4.134 3.473 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -13.324 2.733 6.142 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -14.758 3.267 5.288 1.00 0.00 H new ATOM 639 N LEU A 46 -13.786 -12.154 8.531 1.00 0.00 N ATOM 640 CA LEU A 46 -12.452 -12.752 8.822 1.00 0.00 C ATOM 641 C LEU A 46 -12.155 -13.831 7.772 1.00 0.00 C ATOM 642 O LEU A 46 -12.250 -15.015 8.035 1.00 0.00 O ATOM 643 CB LEU A 46 -12.458 -13.367 10.230 1.00 0.00 C ATOM 644 CG LEU A 46 -11.062 -13.914 10.579 1.00 0.00 C ATOM 645 CD1 LEU A 46 -10.030 -12.769 10.628 1.00 0.00 C ATOM 646 CD2 LEU A 46 -11.122 -14.613 11.946 1.00 0.00 C ATOM 0 HA LEU A 46 -11.680 -11.983 8.782 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -12.755 -12.615 10.961 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -13.194 -14.170 10.281 1.00 0.00 H new ATOM 0 HG LEU A 46 -10.756 -14.625 9.811 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.049 -13.174 10.876 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -9.985 -12.278 9.656 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -10.326 -12.045 11.387 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -10.136 -15.003 12.199 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -11.436 -13.898 12.707 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -11.837 -15.435 11.903 1.00 0.00 H new ATOM 658 N LYS A 47 -11.803 -13.428 6.578 1.00 0.00 N ATOM 659 CA LYS A 47 -11.502 -14.423 5.503 1.00 0.00 C ATOM 660 C LYS A 47 -10.270 -15.242 5.885 1.00 0.00 C ATOM 661 O LYS A 47 -10.329 -16.441 6.076 1.00 0.00 O ATOM 662 CB LYS A 47 -11.214 -13.672 4.198 1.00 0.00 C ATOM 663 CG LYS A 47 -10.941 -14.678 3.070 1.00 0.00 C ATOM 664 CD LYS A 47 -10.694 -13.929 1.758 1.00 0.00 C ATOM 665 CE LYS A 47 -10.401 -14.934 0.643 1.00 0.00 C ATOM 666 NZ LYS A 47 -11.675 -15.564 0.193 1.00 0.00 N ATOM 0 H LYS A 47 -11.711 -12.451 6.300 1.00 0.00 H new ATOM 0 HA LYS A 47 -12.355 -15.089 5.376 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -12.062 -13.039 3.937 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -10.354 -13.015 4.328 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -10.075 -15.291 3.318 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -11.789 -15.354 2.960 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -11.566 -13.328 1.500 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.856 -13.242 1.872 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -9.915 -14.433 -0.194 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -9.711 -15.699 1.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -11.545 -16.593 0.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -12.426 -15.361 0.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -11.945 -15.178 -0.734 1.00 0.00 H new ATOM 680 N ALA A 48 -9.142 -14.597 5.983 1.00 0.00 N ATOM 681 CA ALA A 48 -7.888 -15.322 6.337 1.00 0.00 C ATOM 682 C ALA A 48 -6.938 -14.367 7.072 1.00 0.00 C ATOM 683 O ALA A 48 -5.747 -14.339 6.825 1.00 0.00 O ATOM 684 CB ALA A 48 -7.228 -15.837 5.055 1.00 0.00 C ATOM 0 H ALA A 48 -9.033 -13.594 5.833 1.00 0.00 H new ATOM 0 HA ALA A 48 -8.117 -16.166 6.988 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -6.310 -16.368 5.306 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -7.910 -16.514 4.541 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -6.993 -14.995 4.403 1.00 0.00 H new ATOM 690 N GLY A 49 -7.464 -13.582 7.974 1.00 0.00 N ATOM 691 CA GLY A 49 -6.606 -12.620 8.734 1.00 0.00 C ATOM 692 C GLY A 49 -6.130 -11.500 7.808 1.00 0.00 C ATOM 693 O GLY A 49 -5.107 -10.881 8.042 1.00 0.00 O ATOM 0 H GLY A 49 -8.454 -13.564 8.220 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -7.168 -12.199 9.568 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -5.748 -13.142 9.158 1.00 0.00 H new ATOM 697 N GLN A 50 -6.856 -11.237 6.759 1.00 0.00 N ATOM 698 CA GLN A 50 -6.454 -10.165 5.797 1.00 0.00 C ATOM 699 C GLN A 50 -7.449 -9.014 5.866 1.00 0.00 C ATOM 700 O GLN A 50 -8.592 -9.184 6.243 1.00 0.00 O ATOM 701 CB GLN A 50 -6.438 -10.737 4.377 1.00 0.00 C ATOM 702 CG GLN A 50 -7.697 -11.571 4.132 1.00 0.00 C ATOM 703 CD GLN A 50 -7.629 -12.189 2.736 1.00 0.00 C ATOM 704 OE1 GLN A 50 -7.588 -13.398 2.595 1.00 0.00 O ATOM 705 NE2 GLN A 50 -7.604 -11.411 1.690 1.00 0.00 N ATOM 0 H GLN A 50 -7.721 -11.722 6.521 1.00 0.00 H new ATOM 0 HA GLN A 50 -5.460 -9.800 6.057 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -6.382 -9.926 3.651 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -5.551 -11.354 4.235 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -7.781 -12.354 4.885 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -8.585 -10.945 4.223 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.638 -10.398 1.807 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -7.550 -11.815 0.755 1.00 0.00 H new ATOM 714 N VAL A 51 -7.014 -7.830 5.507 1.00 0.00 N ATOM 715 CA VAL A 51 -7.920 -6.642 5.549 1.00 0.00 C ATOM 716 C VAL A 51 -7.793 -5.853 4.254 1.00 0.00 C ATOM 717 O VAL A 51 -6.854 -6.017 3.496 1.00 0.00 O ATOM 718 CB VAL A 51 -7.544 -5.747 6.728 1.00 0.00 C ATOM 719 CG1 VAL A 51 -7.796 -6.496 8.034 1.00 0.00 C ATOM 720 CG2 VAL A 51 -6.063 -5.369 6.635 1.00 0.00 C ATOM 0 H VAL A 51 -6.066 -7.636 5.185 1.00 0.00 H new ATOM 0 HA VAL A 51 -8.949 -6.982 5.667 1.00 0.00 H new ATOM 0 HB VAL A 51 -8.150 -4.842 6.703 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.528 -5.859 8.877 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.850 -6.764 8.102 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.190 -7.401 8.057 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -5.797 -4.730 7.477 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -5.455 -6.273 6.659 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -5.882 -4.834 5.703 1.00 0.00 H new ATOM 730 N GLU A 52 -8.745 -5.000 3.989 1.00 0.00 N ATOM 731 CA GLU A 52 -8.712 -4.190 2.738 1.00 0.00 C ATOM 732 C GLU A 52 -9.068 -2.743 3.054 1.00 0.00 C ATOM 733 O GLU A 52 -9.641 -2.435 4.084 1.00 0.00 O ATOM 734 CB GLU A 52 -9.716 -4.763 1.730 1.00 0.00 C ATOM 735 CG GLU A 52 -9.155 -6.039 1.078 1.00 0.00 C ATOM 736 CD GLU A 52 -9.334 -7.223 2.029 1.00 0.00 C ATOM 737 OE1 GLU A 52 -10.458 -7.471 2.432 1.00 0.00 O ATOM 738 OE2 GLU A 52 -8.342 -7.865 2.339 1.00 0.00 O ATOM 0 H GLU A 52 -9.551 -4.828 4.591 1.00 0.00 H new ATOM 0 HA GLU A 52 -7.710 -4.226 2.310 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.657 -4.988 2.232 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -9.934 -4.021 0.962 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -9.669 -6.235 0.137 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -8.099 -5.905 0.843 1.00 0.00 H new ATOM 745 N VAL A 53 -8.716 -1.848 2.173 1.00 0.00 N ATOM 746 CA VAL A 53 -9.006 -0.399 2.385 1.00 0.00 C ATOM 747 C VAL A 53 -9.737 0.141 1.164 1.00 0.00 C ATOM 748 O VAL A 53 -9.364 -0.122 0.036 1.00 0.00 O ATOM 749 CB VAL A 53 -7.690 0.357 2.574 1.00 0.00 C ATOM 750 CG1 VAL A 53 -7.954 1.867 2.541 1.00 0.00 C ATOM 751 CG2 VAL A 53 -7.080 -0.028 3.921 1.00 0.00 C ATOM 0 H VAL A 53 -8.232 -2.062 1.301 1.00 0.00 H new ATOM 0 HA VAL A 53 -9.627 -0.268 3.271 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.000 0.097 1.771 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.015 2.404 2.676 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.393 2.139 1.581 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.643 2.134 3.343 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -6.141 0.508 4.062 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.771 0.235 4.722 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.892 -1.101 3.942 1.00 0.00 H new ATOM 761 N GLU A 54 -10.775 0.904 1.379 1.00 0.00 N ATOM 762 CA GLU A 54 -11.546 1.479 0.237 1.00 0.00 C ATOM 763 C GLU A 54 -11.555 2.998 0.349 1.00 0.00 C ATOM 764 O GLU A 54 -11.938 3.569 1.363 1.00 0.00 O ATOM 765 CB GLU A 54 -12.981 0.950 0.273 1.00 0.00 C ATOM 766 CG GLU A 54 -13.718 1.386 -0.995 1.00 0.00 C ATOM 767 CD GLU A 54 -15.052 0.641 -1.094 1.00 0.00 C ATOM 768 OE1 GLU A 54 -15.543 0.206 -0.064 1.00 0.00 O ATOM 769 OE2 GLU A 54 -15.540 0.489 -2.200 1.00 0.00 O ATOM 0 H GLU A 54 -11.125 1.156 2.303 1.00 0.00 H new ATOM 0 HA GLU A 54 -11.079 1.188 -0.704 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -12.977 -0.137 0.348 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -13.497 1.329 1.155 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -13.891 2.462 -0.976 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -13.107 1.177 -1.873 1.00 0.00 H new ATOM 776 N GLY A 55 -11.131 3.662 -0.693 1.00 0.00 N ATOM 777 CA GLY A 55 -11.104 5.150 -0.675 1.00 0.00 C ATOM 778 C GLY A 55 -9.961 5.652 -1.554 1.00 0.00 C ATOM 779 O GLY A 55 -9.212 4.888 -2.128 1.00 0.00 O ATOM 0 H GLY A 55 -10.801 3.234 -1.558 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.054 5.545 -1.035 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -10.976 5.509 0.346 1.00 0.00 H new ATOM 783 N LEU A 56 -9.827 6.945 -1.664 1.00 0.00 N ATOM 784 CA LEU A 56 -8.746 7.530 -2.507 1.00 0.00 C ATOM 785 C LEU A 56 -7.554 7.891 -1.621 1.00 0.00 C ATOM 786 O LEU A 56 -7.694 8.547 -0.605 1.00 0.00 O ATOM 787 CB LEU A 56 -9.274 8.785 -3.220 1.00 0.00 C ATOM 788 CG LEU A 56 -10.183 9.614 -2.273 1.00 0.00 C ATOM 789 CD1 LEU A 56 -10.043 11.112 -2.596 1.00 0.00 C ATOM 790 CD2 LEU A 56 -11.658 9.204 -2.451 1.00 0.00 C ATOM 0 H LEU A 56 -10.426 7.628 -1.201 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.428 6.804 -3.256 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -8.437 9.397 -3.556 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -9.835 8.495 -4.109 1.00 0.00 H new ATOM 0 HG LEU A 56 -9.875 9.423 -1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -10.683 11.689 -1.929 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -9.006 11.418 -2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -10.341 11.291 -3.629 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.283 9.794 -1.780 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -11.963 9.382 -3.482 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -11.772 8.146 -2.216 1.00 0.00 H new ATOM 802 N ILE A 57 -6.379 7.467 -1.997 1.00 0.00 N ATOM 803 CA ILE A 57 -5.176 7.784 -1.181 1.00 0.00 C ATOM 804 C ILE A 57 -4.635 9.154 -1.581 1.00 0.00 C ATOM 805 O ILE A 57 -4.302 9.401 -2.727 1.00 0.00 O ATOM 806 CB ILE A 57 -4.104 6.717 -1.410 1.00 0.00 C ATOM 807 CG1 ILE A 57 -4.612 5.368 -0.886 1.00 0.00 C ATOM 808 CG2 ILE A 57 -2.822 7.110 -0.669 1.00 0.00 C ATOM 809 CD1 ILE A 57 -3.664 4.251 -1.332 1.00 0.00 C ATOM 0 H ILE A 57 -6.201 6.914 -2.835 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.447 7.798 -0.125 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.891 6.636 -2.476 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -4.677 5.391 0.202 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -5.617 5.176 -1.261 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -2.059 6.349 -0.833 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.464 8.069 -1.044 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -3.029 7.192 0.398 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -4.028 3.294 -0.958 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.622 4.223 -2.421 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.667 4.440 -0.935 1.00 0.00 H new ATOM 821 N ASP A 58 -4.539 10.046 -0.638 1.00 0.00 N ATOM 822 CA ASP A 58 -4.015 11.412 -0.920 1.00 0.00 C ATOM 823 C ASP A 58 -2.570 11.501 -0.435 1.00 0.00 C ATOM 824 O ASP A 58 -1.788 12.305 -0.906 1.00 0.00 O ATOM 825 CB ASP A 58 -4.873 12.427 -0.169 1.00 0.00 C ATOM 826 CG ASP A 58 -4.439 13.845 -0.541 1.00 0.00 C ATOM 827 OD1 ASP A 58 -4.538 14.188 -1.707 1.00 0.00 O ATOM 828 OD2 ASP A 58 -4.015 14.565 0.350 1.00 0.00 O ATOM 0 H ASP A 58 -4.806 9.885 0.333 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.050 11.619 -1.990 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -5.925 12.282 -0.416 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -4.774 12.276 0.906 1.00 0.00 H new ATOM 833 N ALA A 59 -2.199 10.682 0.513 1.00 0.00 N ATOM 834 CA ALA A 59 -0.794 10.745 1.017 1.00 0.00 C ATOM 835 C ALA A 59 -0.430 9.464 1.768 1.00 0.00 C ATOM 836 O ALA A 59 -1.259 8.826 2.385 1.00 0.00 O ATOM 837 CB ALA A 59 -0.639 11.932 1.967 1.00 0.00 C ATOM 0 H ALA A 59 -2.796 9.983 0.955 1.00 0.00 H new ATOM 0 HA ALA A 59 -0.130 10.859 0.160 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.387 11.974 2.332 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.874 12.855 1.437 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.320 11.814 2.810 1.00 0.00 H new ATOM 843 N LEU A 60 0.828 9.100 1.727 1.00 0.00 N ATOM 844 CA LEU A 60 1.304 7.872 2.435 1.00 0.00 C ATOM 845 C LEU A 60 2.539 8.210 3.249 1.00 0.00 C ATOM 846 O LEU A 60 3.354 9.020 2.849 1.00 0.00 O ATOM 847 CB LEU A 60 1.652 6.793 1.399 1.00 0.00 C ATOM 848 CG LEU A 60 0.383 6.035 0.984 1.00 0.00 C ATOM 849 CD1 LEU A 60 0.594 5.373 -0.379 1.00 0.00 C ATOM 850 CD2 LEU A 60 0.051 4.950 2.019 1.00 0.00 C ATOM 0 H LEU A 60 1.555 9.610 1.225 1.00 0.00 H new ATOM 0 HA LEU A 60 0.522 7.502 3.098 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.114 7.252 0.525 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.381 6.098 1.816 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.441 6.746 0.925 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -0.310 4.837 -0.667 1.00 0.00 H new ATOM 0 HD12 LEU A 60 0.816 6.137 -1.124 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.427 4.673 -0.318 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.851 4.420 1.713 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.880 4.246 2.087 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -0.113 5.413 2.992 1.00 0.00 H new ATOM 862 N VAL A 61 2.690 7.598 4.393 1.00 0.00 N ATOM 863 CA VAL A 61 3.888 7.886 5.234 1.00 0.00 C ATOM 864 C VAL A 61 4.398 6.601 5.889 1.00 0.00 C ATOM 865 O VAL A 61 3.695 5.935 6.626 1.00 0.00 O ATOM 866 CB VAL A 61 3.515 8.900 6.314 1.00 0.00 C ATOM 867 CG1 VAL A 61 4.781 9.347 7.057 1.00 0.00 C ATOM 868 CG2 VAL A 61 2.832 10.108 5.659 1.00 0.00 C ATOM 0 H VAL A 61 2.039 6.915 4.780 1.00 0.00 H new ATOM 0 HA VAL A 61 4.677 8.294 4.602 1.00 0.00 H new ATOM 0 HB VAL A 61 2.829 8.444 7.028 1.00 0.00 H new ATOM 0 HG11 VAL A 61 4.514 10.070 7.827 1.00 0.00 H new ATOM 0 HG12 VAL A 61 5.256 8.482 7.520 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.474 9.807 6.352 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.564 10.835 6.426 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.515 10.569 4.945 1.00 0.00 H new ATOM 0 HG23 VAL A 61 1.932 9.780 5.140 1.00 0.00 H new ATOM 878 N TYR A 62 5.632 6.266 5.633 1.00 0.00 N ATOM 879 CA TYR A 62 6.254 5.046 6.232 1.00 0.00 C ATOM 880 C TYR A 62 7.699 5.410 6.624 1.00 0.00 C ATOM 881 O TYR A 62 8.494 5.720 5.762 1.00 0.00 O ATOM 882 CB TYR A 62 6.281 3.927 5.178 1.00 0.00 C ATOM 883 CG TYR A 62 7.038 2.723 5.714 1.00 0.00 C ATOM 884 CD1 TYR A 62 8.438 2.716 5.709 1.00 0.00 C ATOM 885 CD2 TYR A 62 6.340 1.613 6.205 1.00 0.00 C ATOM 886 CE1 TYR A 62 9.138 1.614 6.210 1.00 0.00 C ATOM 887 CE2 TYR A 62 7.042 0.506 6.702 1.00 0.00 C ATOM 888 CZ TYR A 62 8.440 0.503 6.695 1.00 0.00 C ATOM 889 OH TYR A 62 9.134 -0.586 7.186 1.00 0.00 O ATOM 0 H TYR A 62 6.251 6.797 5.020 1.00 0.00 H new ATOM 0 HA TYR A 62 5.691 4.707 7.101 1.00 0.00 H new ATOM 0 HB2 TYR A 62 5.263 3.639 4.916 1.00 0.00 H new ATOM 0 HB3 TYR A 62 6.755 4.288 4.265 1.00 0.00 H new ATOM 0 HD1 TYR A 62 8.979 3.564 5.317 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.260 1.610 6.201 1.00 0.00 H new ATOM 0 HE1 TYR A 62 10.218 1.621 6.222 1.00 0.00 H new ATOM 0 HE2 TYR A 62 6.502 -0.345 7.091 1.00 0.00 H new ATOM 0 HH TYR A 62 9.774 -0.897 6.512 1.00 0.00 H new ATOM 899 N PRO A 63 8.058 5.394 7.894 1.00 0.00 N ATOM 900 CA PRO A 63 9.455 5.732 8.315 1.00 0.00 C ATOM 901 C PRO A 63 10.491 4.898 7.544 1.00 0.00 C ATOM 902 O PRO A 63 11.013 3.920 8.043 1.00 0.00 O ATOM 903 CB PRO A 63 9.483 5.404 9.816 1.00 0.00 C ATOM 904 CG PRO A 63 8.055 5.479 10.262 1.00 0.00 C ATOM 905 CD PRO A 63 7.202 5.087 9.051 1.00 0.00 C ATOM 0 HA PRO A 63 9.710 6.772 8.109 1.00 0.00 H new ATOM 0 HB2 PRO A 63 9.900 4.413 9.995 1.00 0.00 H new ATOM 0 HB3 PRO A 63 10.104 6.114 10.363 1.00 0.00 H new ATOM 0 HG2 PRO A 63 7.874 4.805 11.099 1.00 0.00 H new ATOM 0 HG3 PRO A 63 7.807 6.484 10.603 1.00 0.00 H new ATOM 0 HD2 PRO A 63 6.932 4.031 9.078 1.00 0.00 H new ATOM 0 HD3 PRO A 63 6.271 5.653 9.019 1.00 0.00 H new ATOM 913 N LEU A 64 10.775 5.271 6.330 1.00 0.00 N ATOM 914 CA LEU A 64 11.752 4.500 5.523 1.00 0.00 C ATOM 915 C LEU A 64 13.063 4.351 6.310 1.00 0.00 C ATOM 916 O LEU A 64 14.001 5.109 6.160 1.00 0.00 O ATOM 917 CB LEU A 64 11.972 5.217 4.181 1.00 0.00 C ATOM 918 CG LEU A 64 12.521 4.242 3.121 1.00 0.00 C ATOM 919 CD1 LEU A 64 13.060 5.039 1.930 1.00 0.00 C ATOM 920 CD2 LEU A 64 13.668 3.379 3.671 1.00 0.00 C ATOM 0 H LEU A 64 10.369 6.081 5.861 1.00 0.00 H new ATOM 0 HA LEU A 64 11.372 3.499 5.317 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.032 5.646 3.835 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.669 6.044 4.316 1.00 0.00 H new ATOM 0 HG LEU A 64 11.701 3.588 2.825 1.00 0.00 H new ATOM 0 HD11 LEU A 64 13.449 4.352 1.179 1.00 0.00 H new ATOM 0 HD12 LEU A 64 12.256 5.634 1.496 1.00 0.00 H new ATOM 0 HD13 LEU A 64 13.859 5.700 2.266 1.00 0.00 H new ATOM 0 HD21 LEU A 64 14.024 2.707 2.890 1.00 0.00 H new ATOM 0 HD22 LEU A 64 14.485 4.024 3.996 1.00 0.00 H new ATOM 0 HD23 LEU A 64 13.309 2.794 4.518 1.00 0.00 H new ATOM 932 N GLU A 65 13.115 3.358 7.148 1.00 0.00 N ATOM 933 CA GLU A 65 14.340 3.101 7.967 1.00 0.00 C ATOM 934 C GLU A 65 14.738 4.349 8.763 1.00 0.00 C ATOM 935 O GLU A 65 15.269 5.305 8.235 1.00 0.00 O ATOM 936 CB GLU A 65 15.496 2.641 7.045 1.00 0.00 C ATOM 937 CG GLU A 65 16.909 2.811 7.716 1.00 0.00 C ATOM 938 CD GLU A 65 17.592 1.451 7.904 1.00 0.00 C ATOM 939 OE1 GLU A 65 17.060 0.647 8.646 1.00 0.00 O ATOM 940 OE2 GLU A 65 18.640 1.244 7.310 1.00 0.00 O ATOM 0 H GLU A 65 12.351 2.700 7.306 1.00 0.00 H new ATOM 0 HA GLU A 65 14.125 2.309 8.684 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.348 1.595 6.778 1.00 0.00 H new ATOM 0 HB3 GLU A 65 15.467 3.214 6.118 1.00 0.00 H new ATOM 0 HG2 GLU A 65 17.535 3.454 7.098 1.00 0.00 H new ATOM 0 HG3 GLU A 65 16.801 3.305 8.682 1.00 0.00 H new ATOM 947 N HIS A 66 14.520 4.290 10.046 1.00 0.00 N ATOM 948 CA HIS A 66 14.898 5.402 10.963 1.00 0.00 C ATOM 949 C HIS A 66 14.447 6.759 10.435 1.00 0.00 C ATOM 950 O HIS A 66 14.013 6.909 9.310 1.00 0.00 O ATOM 951 CB HIS A 66 16.414 5.433 11.140 1.00 0.00 C ATOM 952 CG HIS A 66 16.760 6.505 12.139 1.00 0.00 C ATOM 953 ND1 HIS A 66 17.264 7.741 11.761 1.00 0.00 N ATOM 954 CD2 HIS A 66 16.658 6.546 13.508 1.00 0.00 C ATOM 955 CE1 HIS A 66 17.444 8.467 12.880 1.00 0.00 C ATOM 956 NE2 HIS A 66 17.089 7.783 13.970 1.00 0.00 N ATOM 0 H HIS A 66 14.083 3.494 10.511 1.00 0.00 H new ATOM 0 HA HIS A 66 14.399 5.217 11.914 1.00 0.00 H new ATOM 0 HB2 HIS A 66 16.774 4.464 11.485 1.00 0.00 H new ATOM 0 HB3 HIS A 66 16.902 5.633 10.186 1.00 0.00 H new ATOM 0 HD2 HIS A 66 16.298 5.740 14.130 1.00 0.00 H new ATOM 0 HE1 HIS A 66 17.828 9.476 12.894 1.00 0.00 H new ATOM 0 HE2 HIS A 66 17.126 8.102 14.938 1.00 0.00 H new ATOM 964 N HIS A 67 14.553 7.767 11.261 1.00 0.00 N ATOM 965 CA HIS A 67 14.141 9.124 10.829 1.00 0.00 C ATOM 966 C HIS A 67 14.477 10.152 11.915 1.00 0.00 C ATOM 967 O HIS A 67 15.209 9.888 12.853 1.00 0.00 O ATOM 968 CB HIS A 67 12.618 9.142 10.547 1.00 0.00 C ATOM 969 CG HIS A 67 12.341 9.984 9.333 1.00 0.00 C ATOM 970 ND1 HIS A 67 13.118 9.891 8.190 1.00 0.00 N ATOM 971 CD2 HIS A 67 11.391 10.938 9.071 1.00 0.00 C ATOM 972 CE1 HIS A 67 12.633 10.766 7.301 1.00 0.00 C ATOM 973 NE2 HIS A 67 11.579 11.429 7.785 1.00 0.00 N ATOM 0 H HIS A 67 14.908 7.704 12.215 1.00 0.00 H new ATOM 0 HA HIS A 67 14.682 9.383 9.919 1.00 0.00 H new ATOM 0 HB2 HIS A 67 12.255 8.126 10.388 1.00 0.00 H new ATOM 0 HB3 HIS A 67 12.083 9.541 11.409 1.00 0.00 H new ATOM 0 HD2 HIS A 67 10.619 11.257 9.756 1.00 0.00 H new ATOM 0 HE1 HIS A 67 13.043 10.918 6.314 1.00 0.00 H new ATOM 0 HE2 HIS A 67 11.028 12.145 7.311 1.00 0.00 H new ATOM 981 N HIS A 68 13.932 11.330 11.778 1.00 0.00 N ATOM 982 CA HIS A 68 14.188 12.409 12.779 1.00 0.00 C ATOM 983 C HIS A 68 15.697 12.504 13.024 1.00 0.00 C ATOM 984 O HIS A 68 16.160 12.637 14.141 1.00 0.00 O ATOM 985 CB HIS A 68 13.444 12.083 14.094 1.00 0.00 C ATOM 986 CG HIS A 68 12.209 11.275 13.790 1.00 0.00 C ATOM 987 ND1 HIS A 68 11.228 11.720 12.913 1.00 0.00 N ATOM 988 CD2 HIS A 68 11.787 10.048 14.236 1.00 0.00 C ATOM 989 CE1 HIS A 68 10.273 10.770 12.859 1.00 0.00 C ATOM 990 NE2 HIS A 68 10.568 9.733 13.645 1.00 0.00 N ATOM 0 H HIS A 68 13.315 11.595 11.010 1.00 0.00 H new ATOM 0 HA HIS A 68 13.823 13.366 12.405 1.00 0.00 H new ATOM 0 HB2 HIS A 68 14.098 11.527 14.765 1.00 0.00 H new ATOM 0 HB3 HIS A 68 13.170 13.005 14.607 1.00 0.00 H new ATOM 0 HD2 HIS A 68 12.319 9.423 14.938 1.00 0.00 H new ATOM 0 HE1 HIS A 68 9.380 10.840 12.255 1.00 0.00 H new ATOM 0 HE2 HIS A 68 10.016 8.887 13.783 1.00 0.00 H new ATOM 998 N HIS A 69 16.474 12.431 11.977 1.00 0.00 N ATOM 999 CA HIS A 69 17.952 12.500 12.138 1.00 0.00 C ATOM 1000 C HIS A 69 18.395 13.916 12.503 1.00 0.00 C ATOM 1001 O HIS A 69 17.814 14.899 12.085 1.00 0.00 O ATOM 1002 CB HIS A 69 18.638 12.076 10.836 1.00 0.00 C ATOM 1003 CG HIS A 69 18.254 13.013 9.720 1.00 0.00 C ATOM 1004 ND1 HIS A 69 17.494 12.597 8.636 1.00 0.00 N ATOM 1005 CD2 HIS A 69 18.518 14.346 9.503 1.00 0.00 C ATOM 1006 CE1 HIS A 69 17.326 13.657 7.823 1.00 0.00 C ATOM 1007 NE2 HIS A 69 17.928 14.745 8.308 1.00 0.00 N ATOM 0 H HIS A 69 16.147 12.326 11.017 1.00 0.00 H new ATOM 0 HA HIS A 69 18.238 11.824 12.944 1.00 0.00 H new ATOM 0 HB2 HIS A 69 19.720 12.079 10.968 1.00 0.00 H new ATOM 0 HB3 HIS A 69 18.351 11.056 10.580 1.00 0.00 H new ATOM 0 HD2 HIS A 69 19.093 14.983 10.158 1.00 0.00 H new ATOM 0 HE1 HIS A 69 16.774 13.630 6.895 1.00 0.00 H new ATOM 0 HE2 HIS A 69 17.951 15.675 7.890 1.00 0.00 H new ATOM 1015 N HIS A 70 19.435 14.016 13.286 1.00 0.00 N ATOM 1016 CA HIS A 70 19.955 15.354 13.692 1.00 0.00 C ATOM 1017 C HIS A 70 21.186 15.163 14.592 1.00 0.00 C ATOM 1018 O HIS A 70 21.266 14.239 15.377 1.00 0.00 O ATOM 1019 CB HIS A 70 18.843 16.161 14.423 1.00 0.00 C ATOM 1020 CG HIS A 70 18.646 17.493 13.744 1.00 0.00 C ATOM 1021 ND1 HIS A 70 19.620 18.481 13.767 1.00 0.00 N ATOM 1022 CD2 HIS A 70 17.609 18.002 13.005 1.00 0.00 C ATOM 1023 CE1 HIS A 70 19.153 19.522 13.058 1.00 0.00 C ATOM 1024 NE2 HIS A 70 17.933 19.281 12.574 1.00 0.00 N ATOM 0 H HIS A 70 19.951 13.222 13.665 1.00 0.00 H new ATOM 0 HA HIS A 70 20.250 15.921 12.809 1.00 0.00 H new ATOM 0 HB2 HIS A 70 17.910 15.598 14.417 1.00 0.00 H new ATOM 0 HB3 HIS A 70 19.118 16.312 15.467 1.00 0.00 H new ATOM 0 HD2 HIS A 70 16.684 17.488 12.791 1.00 0.00 H new ATOM 0 HE1 HIS A 70 19.698 20.441 12.899 1.00 0.00 H new ATOM 0 HE2 HIS A 70 17.359 19.905 12.007 1.00 0.00 H new ATOM 1032 N HIS A 71 22.148 16.034 14.466 1.00 0.00 N ATOM 1033 CA HIS A 71 23.395 15.925 15.285 1.00 0.00 C ATOM 1034 C HIS A 71 23.061 15.945 16.784 1.00 0.00 C ATOM 1035 O HIS A 71 21.892 16.049 17.114 1.00 0.00 O ATOM 1036 CB HIS A 71 24.315 17.101 14.938 1.00 0.00 C ATOM 1037 CG HIS A 71 23.762 18.380 15.512 1.00 0.00 C ATOM 1038 ND1 HIS A 71 24.338 19.006 16.610 1.00 0.00 N ATOM 1039 CD2 HIS A 71 22.686 19.160 15.159 1.00 0.00 C ATOM 1040 CE1 HIS A 71 23.613 20.108 16.876 1.00 0.00 C ATOM 1041 NE2 HIS A 71 22.598 20.247 16.023 1.00 0.00 N ATOM 1042 OXT HIS A 71 23.988 15.860 17.577 1.00 0.00 O ATOM 0 H HIS A 71 22.126 16.827 13.824 1.00 0.00 H new ATOM 0 HA HIS A 71 23.894 14.982 15.062 1.00 0.00 H new ATOM 0 HB2 HIS A 71 25.315 16.919 15.332 1.00 0.00 H new ATOM 0 HB3 HIS A 71 24.411 17.191 13.856 1.00 0.00 H new ATOM 0 HD2 HIS A 71 22.013 18.960 14.338 1.00 0.00 H new ATOM 0 HE1 HIS A 71 23.827 20.795 17.681 1.00 0.00 H new ATOM 0 HE2 HIS A 71 21.903 20.993 16.007 1.00 0.00 H new TER 1050 HIS A 71 ATOM 1051 N MET B 1 10.655 -15.443 7.953 1.00 0.00 N ATOM 1052 CA MET B 1 9.650 -16.259 7.215 1.00 0.00 C ATOM 1053 C MET B 1 8.231 -15.845 7.624 1.00 0.00 C ATOM 1054 O MET B 1 8.029 -15.114 8.573 1.00 0.00 O ATOM 1055 CB MET B 1 9.857 -17.746 7.533 1.00 0.00 C ATOM 1056 CG MET B 1 10.148 -17.921 9.026 1.00 0.00 C ATOM 1057 SD MET B 1 10.319 -19.684 9.400 1.00 0.00 S ATOM 1058 CE MET B 1 10.513 -19.524 11.193 1.00 0.00 C ATOM 0 H1 MET B 1 11.588 -15.897 7.884 1.00 0.00 H new ATOM 0 H2 MET B 1 10.701 -14.491 7.538 1.00 0.00 H new ATOM 0 H3 MET B 1 10.378 -15.371 8.953 1.00 0.00 H new ATOM 0 HA MET B 1 9.778 -16.092 6.146 1.00 0.00 H new ATOM 0 HB2 MET B 1 8.968 -18.313 7.257 1.00 0.00 H new ATOM 0 HB3 MET B 1 10.684 -18.142 6.943 1.00 0.00 H new ATOM 0 HG2 MET B 1 11.061 -17.390 9.295 1.00 0.00 H new ATOM 0 HG3 MET B 1 9.342 -17.488 9.618 1.00 0.00 H new ATOM 0 HE1 MET B 1 10.636 -20.513 11.635 1.00 0.00 H new ATOM 0 HE2 MET B 1 11.392 -18.917 11.411 1.00 0.00 H new ATOM 0 HE3 MET B 1 9.628 -19.046 11.613 1.00 0.00 H new ATOM 1070 N ASP B 2 7.248 -16.310 6.900 1.00 0.00 N ATOM 1071 CA ASP B 2 5.836 -15.958 7.222 1.00 0.00 C ATOM 1072 C ASP B 2 5.685 -14.433 7.253 1.00 0.00 C ATOM 1073 O ASP B 2 4.792 -13.902 7.883 1.00 0.00 O ATOM 1074 CB ASP B 2 5.443 -16.553 8.586 1.00 0.00 C ATOM 1075 CG ASP B 2 5.034 -18.018 8.416 1.00 0.00 C ATOM 1076 OD1 ASP B 2 4.323 -18.305 7.465 1.00 0.00 O ATOM 1077 OD2 ASP B 2 5.442 -18.827 9.233 1.00 0.00 O ATOM 0 H ASP B 2 7.365 -16.923 6.093 1.00 0.00 H new ATOM 0 HA ASP B 2 5.178 -16.370 6.457 1.00 0.00 H new ATOM 0 HB2 ASP B 2 6.280 -16.478 9.280 1.00 0.00 H new ATOM 0 HB3 ASP B 2 4.619 -15.984 9.017 1.00 0.00 H new ATOM 1082 N ASN B 3 6.544 -13.730 6.563 1.00 0.00 N ATOM 1083 CA ASN B 3 6.460 -12.237 6.523 1.00 0.00 C ATOM 1084 C ASN B 3 6.064 -11.795 5.111 1.00 0.00 C ATOM 1085 O ASN B 3 6.103 -10.626 4.773 1.00 0.00 O ATOM 1086 CB ASN B 3 7.823 -11.638 6.893 1.00 0.00 C ATOM 1087 CG ASN B 3 8.939 -12.349 6.122 1.00 0.00 C ATOM 1088 OD1 ASN B 3 9.156 -13.532 6.296 1.00 0.00 O ATOM 1089 ND2 ASN B 3 9.659 -11.671 5.271 1.00 0.00 N ATOM 0 H ASN B 3 7.309 -14.129 6.019 1.00 0.00 H new ATOM 0 HA ASN B 3 5.712 -11.889 7.236 1.00 0.00 H new ATOM 0 HB2 ASN B 3 7.835 -10.572 6.664 1.00 0.00 H new ATOM 0 HB3 ASN B 3 7.992 -11.735 7.965 1.00 0.00 H new ATOM 0 HD21 ASN B 3 10.405 -12.134 4.751 1.00 0.00 H new ATOM 0 HD22 ASN B 3 9.476 -10.678 5.126 1.00 0.00 H new ATOM 1096 N ARG B 4 5.682 -12.724 4.280 1.00 0.00 N ATOM 1097 CA ARG B 4 5.291 -12.365 2.886 1.00 0.00 C ATOM 1098 C ARG B 4 3.975 -11.596 2.898 1.00 0.00 C ATOM 1099 O ARG B 4 3.096 -11.848 3.703 1.00 0.00 O ATOM 1100 CB ARG B 4 5.122 -13.640 2.050 1.00 0.00 C ATOM 1101 CG ARG B 4 6.407 -14.475 2.089 1.00 0.00 C ATOM 1102 CD ARG B 4 7.472 -13.861 1.175 1.00 0.00 C ATOM 1103 NE ARG B 4 6.943 -13.767 -0.219 1.00 0.00 N ATOM 1104 CZ ARG B 4 6.996 -14.798 -1.020 1.00 0.00 C ATOM 1105 NH1 ARG B 4 7.485 -15.936 -0.603 1.00 0.00 N ATOM 1106 NH2 ARG B 4 6.550 -14.690 -2.238 1.00 0.00 N ATOM 0 H ARG B 4 5.623 -13.717 4.505 1.00 0.00 H new ATOM 0 HA ARG B 4 6.072 -11.742 2.450 1.00 0.00 H new ATOM 0 HB2 ARG B 4 4.287 -14.227 2.433 1.00 0.00 H new ATOM 0 HB3 ARG B 4 4.881 -13.378 1.020 1.00 0.00 H new ATOM 0 HG2 ARG B 4 6.783 -14.528 3.111 1.00 0.00 H new ATOM 0 HG3 ARG B 4 6.194 -15.497 1.774 1.00 0.00 H new ATOM 0 HD2 ARG B 4 7.749 -12.871 1.537 1.00 0.00 H new ATOM 0 HD3 ARG B 4 8.375 -14.471 1.192 1.00 0.00 H new ATOM 0 HE ARG B 4 6.537 -12.891 -0.548 1.00 0.00 H new ATOM 0 HH11 ARG B 4 7.828 -16.024 0.353 1.00 0.00 H new ATOM 0 HH12 ARG B 4 7.523 -16.737 -1.234 1.00 0.00 H new ATOM 0 HH21 ARG B 4 6.162 -13.804 -2.562 1.00 0.00 H new ATOM 0 HH22 ARG B 4 6.589 -15.491 -2.868 1.00 0.00 H new ATOM 1120 N GLN B 5 3.835 -10.649 2.011 1.00 0.00 N ATOM 1121 CA GLN B 5 2.583 -9.844 1.963 1.00 0.00 C ATOM 1122 C GLN B 5 2.196 -9.581 0.510 1.00 0.00 C ATOM 1123 O GLN B 5 3.035 -9.495 -0.374 1.00 0.00 O ATOM 1124 CB GLN B 5 2.814 -8.515 2.677 1.00 0.00 C ATOM 1125 CG GLN B 5 3.046 -8.778 4.164 1.00 0.00 C ATOM 1126 CD GLN B 5 3.184 -7.448 4.899 1.00 0.00 C ATOM 1127 OE1 GLN B 5 4.185 -6.767 4.771 1.00 0.00 O ATOM 1128 NE2 GLN B 5 2.204 -7.032 5.652 1.00 0.00 N ATOM 0 H GLN B 5 4.537 -10.398 1.315 1.00 0.00 H new ATOM 0 HA GLN B 5 1.779 -10.391 2.455 1.00 0.00 H new ATOM 0 HB2 GLN B 5 3.675 -8.002 2.247 1.00 0.00 H new ATOM 0 HB3 GLN B 5 1.953 -7.861 2.541 1.00 0.00 H new ATOM 0 HG2 GLN B 5 2.215 -9.350 4.577 1.00 0.00 H new ATOM 0 HG3 GLN B 5 3.946 -9.378 4.302 1.00 0.00 H new ATOM 0 HE21 GLN B 5 1.365 -7.603 5.759 1.00 0.00 H new ATOM 0 HE22 GLN B 5 2.276 -6.136 6.134 1.00 0.00 H new ATOM 1137 N PHE B 6 0.920 -9.453 0.265 1.00 0.00 N ATOM 1138 CA PHE B 6 0.421 -9.193 -1.117 1.00 0.00 C ATOM 1139 C PHE B 6 -0.123 -7.775 -1.167 1.00 0.00 C ATOM 1140 O PHE B 6 -0.948 -7.393 -0.359 1.00 0.00 O ATOM 1141 CB PHE B 6 -0.711 -10.167 -1.436 1.00 0.00 C ATOM 1142 CG PHE B 6 -0.218 -11.579 -1.239 1.00 0.00 C ATOM 1143 CD1 PHE B 6 0.749 -12.106 -2.099 1.00 0.00 C ATOM 1144 CD2 PHE B 6 -0.730 -12.364 -0.196 1.00 0.00 C ATOM 1145 CE1 PHE B 6 1.211 -13.414 -1.916 1.00 0.00 C ATOM 1146 CE2 PHE B 6 -0.267 -13.671 -0.011 1.00 0.00 C ATOM 1147 CZ PHE B 6 0.701 -14.197 -0.873 1.00 0.00 C ATOM 0 H PHE B 6 0.191 -9.519 0.975 1.00 0.00 H new ATOM 0 HA PHE B 6 1.228 -9.321 -1.839 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -1.567 -9.974 -0.789 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -1.050 -10.027 -2.463 1.00 0.00 H new ATOM 0 HD1 PHE B 6 1.140 -11.503 -2.905 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -1.482 -11.959 0.465 1.00 0.00 H new ATOM 0 HE1 PHE B 6 1.961 -13.820 -2.579 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -0.656 -14.273 0.796 1.00 0.00 H new ATOM 0 HZ PHE B 6 1.055 -15.208 -0.734 1.00 0.00 H new ATOM 1157 N LEU B 7 0.326 -6.982 -2.103 1.00 0.00 N ATOM 1158 CA LEU B 7 -0.171 -5.575 -2.197 1.00 0.00 C ATOM 1159 C LEU B 7 -0.776 -5.357 -3.579 1.00 0.00 C ATOM 1160 O LEU B 7 -0.127 -5.538 -4.592 1.00 0.00 O ATOM 1161 CB LEU B 7 0.998 -4.611 -1.977 1.00 0.00 C ATOM 1162 CG LEU B 7 0.472 -3.193 -1.665 1.00 0.00 C ATOM 1163 CD1 LEU B 7 1.582 -2.369 -1.012 1.00 0.00 C ATOM 1164 CD2 LEU B 7 -0.012 -2.490 -2.949 1.00 0.00 C ATOM 0 H LEU B 7 1.015 -7.246 -2.807 1.00 0.00 H new ATOM 0 HA LEU B 7 -0.930 -5.392 -1.437 1.00 0.00 H new ATOM 0 HB2 LEU B 7 1.620 -4.965 -1.155 1.00 0.00 H new ATOM 0 HB3 LEU B 7 1.629 -4.585 -2.865 1.00 0.00 H new ATOM 0 HG LEU B 7 -0.373 -3.279 -0.982 1.00 0.00 H new ATOM 0 HD11 LEU B 7 1.211 -1.368 -0.792 1.00 0.00 H new ATOM 0 HD12 LEU B 7 1.897 -2.851 -0.086 1.00 0.00 H new ATOM 0 HD13 LEU B 7 2.431 -2.299 -1.692 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -0.378 -1.493 -2.702 1.00 0.00 H new ATOM 0 HD22 LEU B 7 0.816 -2.409 -3.654 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -0.817 -3.070 -3.400 1.00 0.00 H new ATOM 1176 N SER B 8 -2.028 -4.971 -3.628 1.00 0.00 N ATOM 1177 CA SER B 8 -2.714 -4.740 -4.936 1.00 0.00 C ATOM 1178 C SER B 8 -3.214 -3.305 -5.015 1.00 0.00 C ATOM 1179 O SER B 8 -3.578 -2.699 -4.025 1.00 0.00 O ATOM 1180 CB SER B 8 -3.901 -5.698 -5.063 1.00 0.00 C ATOM 1181 OG SER B 8 -5.005 -5.171 -4.341 1.00 0.00 O ATOM 0 H SER B 8 -2.610 -4.805 -2.807 1.00 0.00 H new ATOM 0 HA SER B 8 -2.007 -4.918 -5.747 1.00 0.00 H new ATOM 0 HB2 SER B 8 -4.167 -5.830 -6.112 1.00 0.00 H new ATOM 0 HB3 SER B 8 -3.634 -6.681 -4.676 1.00 0.00 H new ATOM 0 HG SER B 8 -5.769 -5.780 -4.421 1.00 0.00 H new ATOM 1187 N LEU B 9 -3.232 -2.755 -6.197 1.00 0.00 N ATOM 1188 CA LEU B 9 -3.711 -1.356 -6.366 1.00 0.00 C ATOM 1189 C LEU B 9 -4.356 -1.211 -7.745 1.00 0.00 C ATOM 1190 O LEU B 9 -3.912 -1.804 -8.717 1.00 0.00 O ATOM 1191 CB LEU B 9 -2.538 -0.380 -6.246 1.00 0.00 C ATOM 1192 CG LEU B 9 -3.070 1.065 -6.213 1.00 0.00 C ATOM 1193 CD1 LEU B 9 -3.893 1.305 -4.928 1.00 0.00 C ATOM 1194 CD2 LEU B 9 -1.891 2.043 -6.274 1.00 0.00 C ATOM 0 H LEU B 9 -2.934 -3.217 -7.056 1.00 0.00 H new ATOM 0 HA LEU B 9 -4.441 -1.129 -5.589 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -1.969 -0.589 -5.340 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -1.857 -0.509 -7.087 1.00 0.00 H new ATOM 0 HG LEU B 9 -3.719 1.227 -7.073 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -4.262 2.330 -4.919 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -4.737 0.615 -4.902 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -3.262 1.139 -4.055 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -2.266 3.066 -6.251 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -1.236 1.877 -5.419 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -1.332 1.882 -7.196 1.00 0.00 H new ATOM 1206 N THR B 10 -5.401 -0.427 -7.839 1.00 0.00 N ATOM 1207 CA THR B 10 -6.097 -0.227 -9.149 1.00 0.00 C ATOM 1208 C THR B 10 -6.287 1.268 -9.416 1.00 0.00 C ATOM 1209 O THR B 10 -6.221 2.090 -8.521 1.00 0.00 O ATOM 1210 CB THR B 10 -7.472 -0.908 -9.105 1.00 0.00 C ATOM 1211 OG1 THR B 10 -8.409 -0.036 -8.493 1.00 0.00 O ATOM 1212 CG2 THR B 10 -7.384 -2.207 -8.302 1.00 0.00 C ATOM 0 H THR B 10 -5.806 0.088 -7.057 1.00 0.00 H new ATOM 0 HA THR B 10 -5.492 -0.663 -9.944 1.00 0.00 H new ATOM 0 HB THR B 10 -7.793 -1.137 -10.121 1.00 0.00 H new ATOM 0 HG1 THR B 10 -9.318 -0.307 -8.741 1.00 0.00 H new ATOM 0 HG21 THR B 10 -8.363 -2.685 -8.275 1.00 0.00 H new ATOM 0 HG22 THR B 10 -6.666 -2.878 -8.773 1.00 0.00 H new ATOM 0 HG23 THR B 10 -7.060 -1.985 -7.285 1.00 0.00 H new ATOM 1220 N GLY B 11 -6.528 1.623 -10.650 1.00 0.00 N ATOM 1221 CA GLY B 11 -6.738 3.060 -11.007 1.00 0.00 C ATOM 1222 C GLY B 11 -5.387 3.771 -11.184 1.00 0.00 C ATOM 1223 O GLY B 11 -5.299 4.983 -11.110 1.00 0.00 O ATOM 0 H GLY B 11 -6.589 0.974 -11.434 1.00 0.00 H new ATOM 0 HA2 GLY B 11 -7.317 3.132 -11.928 1.00 0.00 H new ATOM 0 HA3 GLY B 11 -7.317 3.554 -10.227 1.00 0.00 H new ATOM 1227 N VAL B 12 -4.337 3.039 -11.422 1.00 0.00 N ATOM 1228 CA VAL B 12 -3.008 3.694 -11.605 1.00 0.00 C ATOM 1229 C VAL B 12 -3.005 4.507 -12.904 1.00 0.00 C ATOM 1230 O VAL B 12 -3.453 4.053 -13.941 1.00 0.00 O ATOM 1231 CB VAL B 12 -1.908 2.629 -11.656 1.00 0.00 C ATOM 1232 CG1 VAL B 12 -2.072 1.762 -12.907 1.00 0.00 C ATOM 1233 CG2 VAL B 12 -0.539 3.313 -11.690 1.00 0.00 C ATOM 0 H VAL B 12 -4.338 2.022 -11.498 1.00 0.00 H new ATOM 0 HA VAL B 12 -2.819 4.362 -10.765 1.00 0.00 H new ATOM 0 HB VAL B 12 -1.984 1.997 -10.771 1.00 0.00 H new ATOM 0 HG11 VAL B 12 -1.285 1.008 -12.933 1.00 0.00 H new ATOM 0 HG12 VAL B 12 -3.045 1.270 -12.884 1.00 0.00 H new ATOM 0 HG13 VAL B 12 -2.003 2.389 -13.796 1.00 0.00 H new ATOM 0 HG21 VAL B 12 0.245 2.557 -11.726 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -0.471 3.948 -12.573 1.00 0.00 H new ATOM 0 HG23 VAL B 12 -0.414 3.922 -10.795 1.00 0.00 H new ATOM 1243 N SER B 13 -2.502 5.711 -12.853 1.00 0.00 N ATOM 1244 CA SER B 13 -2.460 6.558 -14.079 1.00 0.00 C ATOM 1245 C SER B 13 -1.382 6.024 -15.022 1.00 0.00 C ATOM 1246 O SER B 13 -1.570 5.944 -16.219 1.00 0.00 O ATOM 1247 CB SER B 13 -2.132 7.996 -13.681 1.00 0.00 C ATOM 1248 OG SER B 13 -3.087 8.450 -12.730 1.00 0.00 O ATOM 0 H SER B 13 -2.118 6.145 -12.014 1.00 0.00 H new ATOM 0 HA SER B 13 -3.426 6.532 -14.584 1.00 0.00 H new ATOM 0 HB2 SER B 13 -1.128 8.049 -13.259 1.00 0.00 H new ATOM 0 HB3 SER B 13 -2.143 8.640 -14.560 1.00 0.00 H new ATOM 0 HG SER B 13 -2.878 9.372 -12.471 1.00 0.00 H new ATOM 1254 N LYS B 14 -0.254 5.652 -14.488 1.00 0.00 N ATOM 1255 CA LYS B 14 0.835 5.117 -15.354 1.00 0.00 C ATOM 1256 C LYS B 14 1.978 4.593 -14.485 1.00 0.00 C ATOM 1257 O LYS B 14 2.066 4.884 -13.309 1.00 0.00 O ATOM 1258 CB LYS B 14 1.366 6.220 -16.279 1.00 0.00 C ATOM 1259 CG LYS B 14 1.917 7.406 -15.448 1.00 0.00 C ATOM 1260 CD LYS B 14 3.454 7.340 -15.360 1.00 0.00 C ATOM 1261 CE LYS B 14 4.074 7.944 -16.620 1.00 0.00 C ATOM 1262 NZ LYS B 14 5.553 7.822 -16.548 1.00 0.00 N ATOM 0 H LYS B 14 -0.038 5.694 -13.492 1.00 0.00 H new ATOM 0 HA LYS B 14 0.433 4.304 -15.959 1.00 0.00 H new ATOM 0 HB2 LYS B 14 2.153 5.819 -16.918 1.00 0.00 H new ATOM 0 HB3 LYS B 14 0.568 6.568 -16.935 1.00 0.00 H new ATOM 0 HG2 LYS B 14 1.614 8.348 -15.904 1.00 0.00 H new ATOM 0 HG3 LYS B 14 1.489 7.385 -14.446 1.00 0.00 H new ATOM 0 HD2 LYS B 14 3.800 7.881 -14.479 1.00 0.00 H new ATOM 0 HD3 LYS B 14 3.776 6.305 -15.246 1.00 0.00 H new ATOM 0 HE2 LYS B 14 3.698 7.431 -17.505 1.00 0.00 H new ATOM 0 HE3 LYS B 14 3.788 8.992 -16.713 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 5.977 8.232 -17.404 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 5.903 8.330 -15.711 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 5.816 6.818 -16.479 1.00 0.00 H new ATOM 1276 N VAL B 15 2.862 3.824 -15.065 1.00 0.00 N ATOM 1277 CA VAL B 15 4.013 3.272 -14.290 1.00 0.00 C ATOM 1278 C VAL B 15 5.262 4.118 -14.550 1.00 0.00 C ATOM 1279 O VAL B 15 5.641 4.367 -15.679 1.00 0.00 O ATOM 1280 CB VAL B 15 4.258 1.827 -14.728 1.00 0.00 C ATOM 1281 CG1 VAL B 15 5.546 1.303 -14.091 1.00 0.00 C ATOM 1282 CG2 VAL B 15 3.078 0.960 -14.281 1.00 0.00 C ATOM 0 H VAL B 15 2.836 3.553 -16.048 1.00 0.00 H new ATOM 0 HA VAL B 15 3.788 3.296 -13.224 1.00 0.00 H new ATOM 0 HB VAL B 15 4.355 1.788 -15.813 1.00 0.00 H new ATOM 0 HG11 VAL B 15 5.715 0.273 -14.407 1.00 0.00 H new ATOM 0 HG12 VAL B 15 6.386 1.922 -14.406 1.00 0.00 H new ATOM 0 HG13 VAL B 15 5.456 1.340 -13.005 1.00 0.00 H new ATOM 0 HG21 VAL B 15 3.247 -0.071 -14.590 1.00 0.00 H new ATOM 0 HG22 VAL B 15 2.986 1.003 -13.196 1.00 0.00 H new ATOM 0 HG23 VAL B 15 2.161 1.330 -14.738 1.00 0.00 H new ATOM 1292 N GLN B 16 5.903 4.556 -13.504 1.00 0.00 N ATOM 1293 CA GLN B 16 7.133 5.384 -13.657 1.00 0.00 C ATOM 1294 C GLN B 16 8.339 4.462 -13.852 1.00 0.00 C ATOM 1295 O GLN B 16 9.310 4.808 -14.498 1.00 0.00 O ATOM 1296 CB GLN B 16 7.321 6.219 -12.389 1.00 0.00 C ATOM 1297 CG GLN B 16 8.563 7.101 -12.531 1.00 0.00 C ATOM 1298 CD GLN B 16 8.630 8.092 -11.365 1.00 0.00 C ATOM 1299 OE1 GLN B 16 8.590 9.290 -11.570 1.00 0.00 O ATOM 1300 NE2 GLN B 16 8.733 7.646 -10.142 1.00 0.00 N ATOM 0 H GLN B 16 5.625 4.374 -12.539 1.00 0.00 H new ATOM 0 HA GLN B 16 7.041 6.042 -14.521 1.00 0.00 H new ATOM 0 HB2 GLN B 16 6.441 6.839 -12.216 1.00 0.00 H new ATOM 0 HB3 GLN B 16 7.425 5.565 -11.523 1.00 0.00 H new ATOM 0 HG2 GLN B 16 9.460 6.482 -12.547 1.00 0.00 H new ATOM 0 HG3 GLN B 16 8.531 7.640 -13.478 1.00 0.00 H new ATOM 0 HE21 GLN B 16 8.767 6.642 -9.967 1.00 0.00 H new ATOM 0 HE22 GLN B 16 8.780 8.302 -9.362 1.00 0.00 H new ATOM 1309 N SER B 17 8.285 3.288 -13.297 1.00 0.00 N ATOM 1310 CA SER B 17 9.425 2.339 -13.446 1.00 0.00 C ATOM 1311 C SER B 17 9.005 0.963 -12.938 1.00 0.00 C ATOM 1312 O SER B 17 8.111 0.839 -12.124 1.00 0.00 O ATOM 1313 CB SER B 17 10.627 2.827 -12.638 1.00 0.00 C ATOM 1314 OG SER B 17 11.720 1.938 -12.846 1.00 0.00 O ATOM 0 H SER B 17 7.501 2.941 -12.745 1.00 0.00 H new ATOM 0 HA SER B 17 9.702 2.280 -14.498 1.00 0.00 H new ATOM 0 HB2 SER B 17 10.900 3.837 -12.943 1.00 0.00 H new ATOM 0 HB3 SER B 17 10.375 2.872 -11.578 1.00 0.00 H new ATOM 0 HG SER B 17 11.881 1.421 -12.029 1.00 0.00 H new ATOM 1320 N PHE B 18 9.641 -0.075 -13.412 1.00 0.00 N ATOM 1321 CA PHE B 18 9.281 -1.455 -12.966 1.00 0.00 C ATOM 1322 C PHE B 18 10.552 -2.267 -12.720 1.00 0.00 C ATOM 1323 O PHE B 18 11.244 -2.663 -13.641 1.00 0.00 O ATOM 1324 CB PHE B 18 8.416 -2.120 -14.050 1.00 0.00 C ATOM 1325 CG PHE B 18 8.465 -3.636 -13.934 1.00 0.00 C ATOM 1326 CD1 PHE B 18 8.359 -4.255 -12.683 1.00 0.00 C ATOM 1327 CD2 PHE B 18 8.631 -4.417 -15.087 1.00 0.00 C ATOM 1328 CE1 PHE B 18 8.417 -5.649 -12.584 1.00 0.00 C ATOM 1329 CE2 PHE B 18 8.689 -5.810 -14.987 1.00 0.00 C ATOM 1330 CZ PHE B 18 8.581 -6.427 -13.734 1.00 0.00 C ATOM 0 H PHE B 18 10.399 -0.027 -14.093 1.00 0.00 H new ATOM 0 HA PHE B 18 8.717 -1.411 -12.034 1.00 0.00 H new ATOM 0 HB2 PHE B 18 7.385 -1.778 -13.958 1.00 0.00 H new ATOM 0 HB3 PHE B 18 8.766 -1.816 -15.037 1.00 0.00 H new ATOM 0 HD1 PHE B 18 8.232 -3.656 -11.793 1.00 0.00 H new ATOM 0 HD2 PHE B 18 8.714 -3.942 -16.053 1.00 0.00 H new ATOM 0 HE1 PHE B 18 8.335 -6.125 -11.618 1.00 0.00 H new ATOM 0 HE2 PHE B 18 8.817 -6.410 -15.876 1.00 0.00 H new ATOM 0 HZ PHE B 18 8.624 -7.503 -13.656 1.00 0.00 H new ATOM 1340 N ASP B 19 10.842 -2.540 -11.474 1.00 0.00 N ATOM 1341 CA ASP B 19 12.041 -3.360 -11.120 1.00 0.00 C ATOM 1342 C ASP B 19 11.587 -4.419 -10.098 1.00 0.00 C ATOM 1343 O ASP B 19 10.682 -4.175 -9.324 1.00 0.00 O ATOM 1344 CB ASP B 19 13.139 -2.461 -10.516 1.00 0.00 C ATOM 1345 CG ASP B 19 13.063 -1.067 -11.144 1.00 0.00 C ATOM 1346 OD1 ASP B 19 13.351 -0.954 -12.322 1.00 0.00 O ATOM 1347 OD2 ASP B 19 12.720 -0.138 -10.429 1.00 0.00 O ATOM 0 H ASP B 19 10.291 -2.225 -10.675 1.00 0.00 H new ATOM 0 HA ASP B 19 12.457 -3.840 -12.006 1.00 0.00 H new ATOM 0 HB2 ASP B 19 13.013 -2.392 -9.436 1.00 0.00 H new ATOM 0 HB3 ASP B 19 14.121 -2.899 -10.695 1.00 0.00 H new ATOM 1352 N PRO B 20 12.198 -5.579 -10.082 1.00 0.00 N ATOM 1353 CA PRO B 20 11.822 -6.668 -9.128 1.00 0.00 C ATOM 1354 C PRO B 20 12.313 -6.367 -7.704 1.00 0.00 C ATOM 1355 O PRO B 20 11.991 -7.066 -6.763 1.00 0.00 O ATOM 1356 CB PRO B 20 12.522 -7.907 -9.698 1.00 0.00 C ATOM 1357 CG PRO B 20 13.705 -7.374 -10.448 1.00 0.00 C ATOM 1358 CD PRO B 20 13.303 -5.987 -10.966 1.00 0.00 C ATOM 0 HA PRO B 20 10.742 -6.790 -9.041 1.00 0.00 H new ATOM 0 HB2 PRO B 20 12.832 -8.586 -8.903 1.00 0.00 H new ATOM 0 HB3 PRO B 20 11.858 -8.468 -10.356 1.00 0.00 H new ATOM 0 HG2 PRO B 20 14.578 -7.308 -9.799 1.00 0.00 H new ATOM 0 HG3 PRO B 20 13.971 -8.034 -11.273 1.00 0.00 H new ATOM 0 HD2 PRO B 20 14.135 -5.285 -10.913 1.00 0.00 H new ATOM 0 HD3 PRO B 20 12.986 -6.027 -12.008 1.00 0.00 H new ATOM 1366 N LYS B 21 13.096 -5.332 -7.551 1.00 0.00 N ATOM 1367 CA LYS B 21 13.630 -4.956 -6.206 1.00 0.00 C ATOM 1368 C LYS B 21 13.046 -3.600 -5.798 1.00 0.00 C ATOM 1369 O LYS B 21 13.006 -3.243 -4.635 1.00 0.00 O ATOM 1370 CB LYS B 21 15.148 -4.850 -6.299 1.00 0.00 C ATOM 1371 CG LYS B 21 15.730 -4.651 -4.900 1.00 0.00 C ATOM 1372 CD LYS B 21 17.261 -4.534 -4.971 1.00 0.00 C ATOM 1373 CE LYS B 21 17.893 -5.901 -5.257 1.00 0.00 C ATOM 1374 NZ LYS B 21 19.356 -5.842 -4.980 1.00 0.00 N ATOM 0 H LYS B 21 13.393 -4.721 -8.312 1.00 0.00 H new ATOM 0 HA LYS B 21 13.355 -5.707 -5.465 1.00 0.00 H new ATOM 0 HB2 LYS B 21 15.559 -5.752 -6.751 1.00 0.00 H new ATOM 0 HB3 LYS B 21 15.426 -4.016 -6.943 1.00 0.00 H new ATOM 0 HG2 LYS B 21 15.310 -3.752 -4.449 1.00 0.00 H new ATOM 0 HG3 LYS B 21 15.452 -5.489 -4.260 1.00 0.00 H new ATOM 0 HD2 LYS B 21 17.541 -3.827 -5.752 1.00 0.00 H new ATOM 0 HD3 LYS B 21 17.645 -4.139 -4.030 1.00 0.00 H new ATOM 0 HE2 LYS B 21 17.426 -6.666 -4.637 1.00 0.00 H new ATOM 0 HE3 LYS B 21 17.720 -6.183 -6.296 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 19.784 -6.770 -5.174 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 19.796 -5.123 -5.590 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 19.511 -5.592 -3.983 1.00 0.00 H new ATOM 1388 N GLU B 22 12.589 -2.841 -6.751 1.00 0.00 N ATOM 1389 CA GLU B 22 12.001 -1.504 -6.437 1.00 0.00 C ATOM 1390 C GLU B 22 10.995 -1.133 -7.525 1.00 0.00 C ATOM 1391 O GLU B 22 11.342 -0.966 -8.677 1.00 0.00 O ATOM 1392 CB GLU B 22 13.110 -0.449 -6.374 1.00 0.00 C ATOM 1393 CG GLU B 22 12.484 0.931 -6.161 1.00 0.00 C ATOM 1394 CD GLU B 22 13.575 1.945 -5.808 1.00 0.00 C ATOM 1395 OE1 GLU B 22 14.738 1.580 -5.866 1.00 0.00 O ATOM 1396 OE2 GLU B 22 13.227 3.064 -5.469 1.00 0.00 O ATOM 0 H GLU B 22 12.596 -3.087 -7.741 1.00 0.00 H new ATOM 0 HA GLU B 22 11.498 -1.544 -5.471 1.00 0.00 H new ATOM 0 HB2 GLU B 22 13.799 -0.678 -5.561 1.00 0.00 H new ATOM 0 HB3 GLU B 22 13.690 -0.459 -7.297 1.00 0.00 H new ATOM 0 HG2 GLU B 22 11.960 1.246 -7.063 1.00 0.00 H new ATOM 0 HG3 GLU B 22 11.744 0.886 -5.362 1.00 0.00 H new ATOM 1403 N ILE B 23 9.737 -1.017 -7.170 1.00 0.00 N ATOM 1404 CA ILE B 23 8.688 -0.679 -8.186 1.00 0.00 C ATOM 1405 C ILE B 23 8.067 0.674 -7.862 1.00 0.00 C ATOM 1406 O ILE B 23 7.649 0.930 -6.750 1.00 0.00 O ATOM 1407 CB ILE B 23 7.595 -1.749 -8.172 1.00 0.00 C ATOM 1408 CG1 ILE B 23 8.214 -3.099 -8.548 1.00 0.00 C ATOM 1409 CG2 ILE B 23 6.504 -1.379 -9.185 1.00 0.00 C ATOM 1410 CD1 ILE B 23 7.156 -4.199 -8.445 1.00 0.00 C ATOM 0 H ILE B 23 9.391 -1.142 -6.219 1.00 0.00 H new ATOM 0 HA ILE B 23 9.151 -0.638 -9.172 1.00 0.00 H new ATOM 0 HB ILE B 23 7.152 -1.814 -7.178 1.00 0.00 H new ATOM 0 HG12 ILE B 23 8.612 -3.058 -9.562 1.00 0.00 H new ATOM 0 HG13 ILE B 23 9.051 -3.323 -7.886 1.00 0.00 H new ATOM 0 HG21 ILE B 23 5.725 -2.141 -9.175 1.00 0.00 H new ATOM 0 HG22 ILE B 23 6.072 -0.415 -8.918 1.00 0.00 H new ATOM 0 HG23 ILE B 23 6.939 -1.318 -10.182 1.00 0.00 H new ATOM 0 HD11 ILE B 23 7.600 -5.157 -8.713 1.00 0.00 H new ATOM 0 HD12 ILE B 23 6.779 -4.247 -7.423 1.00 0.00 H new ATOM 0 HD13 ILE B 23 6.333 -3.977 -9.125 1.00 0.00 H new ATOM 1422 N LEU B 24 7.992 1.540 -8.838 1.00 0.00 N ATOM 1423 CA LEU B 24 7.388 2.890 -8.624 1.00 0.00 C ATOM 1424 C LEU B 24 6.093 2.982 -9.411 1.00 0.00 C ATOM 1425 O LEU B 24 6.053 2.736 -10.602 1.00 0.00 O ATOM 1426 CB LEU B 24 8.362 3.961 -9.120 1.00 0.00 C ATOM 1427 CG LEU B 24 9.486 4.162 -8.085 1.00 0.00 C ATOM 1428 CD1 LEU B 24 10.740 4.697 -8.779 1.00 0.00 C ATOM 1429 CD2 LEU B 24 9.036 5.173 -7.018 1.00 0.00 C ATOM 0 H LEU B 24 8.327 1.368 -9.786 1.00 0.00 H new ATOM 0 HA LEU B 24 7.186 3.044 -7.564 1.00 0.00 H new ATOM 0 HB2 LEU B 24 8.787 3.664 -10.079 1.00 0.00 H new ATOM 0 HB3 LEU B 24 7.833 4.900 -9.283 1.00 0.00 H new ATOM 0 HG LEU B 24 9.707 3.204 -7.614 1.00 0.00 H new ATOM 0 HD11 LEU B 24 11.531 4.837 -8.043 1.00 0.00 H new ATOM 0 HD12 LEU B 24 11.070 3.984 -9.535 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.514 5.651 -9.255 1.00 0.00 H new ATOM 0 HD21 LEU B 24 9.834 5.312 -6.289 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.809 6.127 -7.494 1.00 0.00 H new ATOM 0 HD23 LEU B 24 8.145 4.798 -6.514 1.00 0.00 H new ATOM 1441 N LEU B 25 5.029 3.333 -8.747 1.00 0.00 N ATOM 1442 CA LEU B 25 3.708 3.450 -9.426 1.00 0.00 C ATOM 1443 C LEU B 25 3.192 4.873 -9.272 1.00 0.00 C ATOM 1444 O LEU B 25 3.086 5.402 -8.182 1.00 0.00 O ATOM 1445 CB LEU B 25 2.731 2.470 -8.780 1.00 0.00 C ATOM 1446 CG LEU B 25 3.306 1.049 -8.860 1.00 0.00 C ATOM 1447 CD1 LEU B 25 2.347 0.077 -8.170 1.00 0.00 C ATOM 1448 CD2 LEU B 25 3.487 0.638 -10.331 1.00 0.00 C ATOM 0 H LEU B 25 5.017 3.547 -7.750 1.00 0.00 H new ATOM 0 HA LEU B 25 3.808 3.217 -10.486 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.557 2.746 -7.740 1.00 0.00 H new ATOM 0 HB3 LEU B 25 1.767 2.513 -9.287 1.00 0.00 H new ATOM 0 HG LEU B 25 4.276 1.024 -8.363 1.00 0.00 H new ATOM 0 HD11 LEU B 25 2.752 -0.934 -8.225 1.00 0.00 H new ATOM 0 HD12 LEU B 25 2.227 0.364 -7.125 1.00 0.00 H new ATOM 0 HD13 LEU B 25 1.378 0.107 -8.668 1.00 0.00 H new ATOM 0 HD21 LEU B 25 3.895 -0.371 -10.379 1.00 0.00 H new ATOM 0 HD22 LEU B 25 2.522 0.664 -10.837 1.00 0.00 H new ATOM 0 HD23 LEU B 25 4.172 1.330 -10.821 1.00 0.00 H new ATOM 1460 N GLU B 26 2.867 5.498 -10.367 1.00 0.00 N ATOM 1461 CA GLU B 26 2.339 6.891 -10.318 1.00 0.00 C ATOM 1462 C GLU B 26 0.818 6.826 -10.325 1.00 0.00 C ATOM 1463 O GLU B 26 0.202 6.459 -11.310 1.00 0.00 O ATOM 1464 CB GLU B 26 2.848 7.669 -11.531 1.00 0.00 C ATOM 1465 CG GLU B 26 2.150 9.029 -11.605 1.00 0.00 C ATOM 1466 CD GLU B 26 2.856 9.917 -12.633 1.00 0.00 C ATOM 1467 OE1 GLU B 26 4.062 9.783 -12.773 1.00 0.00 O ATOM 1468 OE2 GLU B 26 2.179 10.701 -13.274 1.00 0.00 O ATOM 0 H GLU B 26 2.945 5.101 -11.303 1.00 0.00 H new ATOM 0 HA GLU B 26 2.678 7.400 -9.415 1.00 0.00 H new ATOM 0 HB2 GLU B 26 3.927 7.807 -11.459 1.00 0.00 H new ATOM 0 HB3 GLU B 26 2.659 7.103 -12.443 1.00 0.00 H new ATOM 0 HG2 GLU B 26 1.104 8.897 -11.882 1.00 0.00 H new ATOM 0 HG3 GLU B 26 2.163 9.509 -10.626 1.00 0.00 H new ATOM 1475 N THR B 27 0.210 7.168 -9.218 1.00 0.00 N ATOM 1476 CA THR B 27 -1.279 7.117 -9.113 1.00 0.00 C ATOM 1477 C THR B 27 -1.839 8.524 -8.950 1.00 0.00 C ATOM 1478 O THR B 27 -1.189 9.405 -8.425 1.00 0.00 O ATOM 1479 CB THR B 27 -1.672 6.267 -7.901 1.00 0.00 C ATOM 1480 OG1 THR B 27 -3.015 6.564 -7.538 1.00 0.00 O ATOM 1481 CG2 THR B 27 -0.744 6.569 -6.718 1.00 0.00 C ATOM 0 H THR B 27 0.687 7.484 -8.374 1.00 0.00 H new ATOM 0 HA THR B 27 -1.688 6.675 -10.022 1.00 0.00 H new ATOM 0 HB THR B 27 -1.582 5.212 -8.159 1.00 0.00 H new ATOM 0 HG1 THR B 27 -3.061 6.749 -6.577 1.00 0.00 H new ATOM 0 HG21 THR B 27 -1.034 5.958 -5.863 1.00 0.00 H new ATOM 0 HG22 THR B 27 0.285 6.340 -6.995 1.00 0.00 H new ATOM 0 HG23 THR B 27 -0.823 7.624 -6.454 1.00 0.00 H new ATOM 1489 N ILE B 28 -3.054 8.719 -9.405 1.00 0.00 N ATOM 1490 CA ILE B 28 -3.736 10.052 -9.316 1.00 0.00 C ATOM 1491 C ILE B 28 -2.721 11.196 -9.481 1.00 0.00 C ATOM 1492 O ILE B 28 -2.530 11.717 -10.564 1.00 0.00 O ATOM 1493 CB ILE B 28 -4.446 10.186 -7.963 1.00 0.00 C ATOM 1494 CG1 ILE B 28 -5.357 8.977 -7.750 1.00 0.00 C ATOM 1495 CG2 ILE B 28 -5.308 11.455 -7.963 1.00 0.00 C ATOM 1496 CD1 ILE B 28 -5.905 8.991 -6.322 1.00 0.00 C ATOM 0 H ILE B 28 -3.616 7.991 -9.846 1.00 0.00 H new ATOM 0 HA ILE B 28 -4.469 10.117 -10.120 1.00 0.00 H new ATOM 0 HB ILE B 28 -3.702 10.241 -7.168 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -6.179 8.998 -8.466 1.00 0.00 H new ATOM 0 HG13 ILE B 28 -4.803 8.056 -7.928 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -5.813 11.552 -7.002 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -4.674 12.326 -8.129 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -6.050 11.391 -8.758 1.00 0.00 H new ATOM 0 HD11 ILE B 28 -6.554 8.128 -6.173 1.00 0.00 H new ATOM 0 HD12 ILE B 28 -5.077 8.949 -5.614 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -6.475 9.906 -6.160 1.00 0.00 H new ATOM 1508 N GLN B 29 -2.076 11.594 -8.417 1.00 0.00 N ATOM 1509 CA GLN B 29 -1.078 12.702 -8.495 1.00 0.00 C ATOM 1510 C GLN B 29 0.149 12.352 -7.642 1.00 0.00 C ATOM 1511 O GLN B 29 1.191 12.972 -7.750 1.00 0.00 O ATOM 1512 CB GLN B 29 -1.722 13.990 -7.960 1.00 0.00 C ATOM 1513 CG GLN B 29 -2.367 13.722 -6.593 1.00 0.00 C ATOM 1514 CD GLN B 29 -2.920 15.034 -6.022 1.00 0.00 C ATOM 1515 OE1 GLN B 29 -2.389 16.094 -6.284 1.00 0.00 O ATOM 1516 NE2 GLN B 29 -3.973 15.006 -5.248 1.00 0.00 N ATOM 0 H GLN B 29 -2.199 11.195 -7.487 1.00 0.00 H new ATOM 0 HA GLN B 29 -0.766 12.844 -9.530 1.00 0.00 H new ATOM 0 HB2 GLN B 29 -0.969 14.773 -7.870 1.00 0.00 H new ATOM 0 HB3 GLN B 29 -2.474 14.350 -8.662 1.00 0.00 H new ATOM 0 HG2 GLN B 29 -3.169 12.991 -6.694 1.00 0.00 H new ATOM 0 HG3 GLN B 29 -1.632 13.297 -5.909 1.00 0.00 H new ATOM 0 HE21 GLN B 29 -4.420 14.116 -5.027 1.00 0.00 H new ATOM 0 HE22 GLN B 29 -4.348 15.874 -4.865 1.00 0.00 H new ATOM 1525 N GLY B 30 0.035 11.372 -6.784 1.00 0.00 N ATOM 1526 CA GLY B 30 1.192 10.993 -5.909 1.00 0.00 C ATOM 1527 C GLY B 30 1.931 9.784 -6.480 1.00 0.00 C ATOM 1528 O GLY B 30 1.439 9.080 -7.339 1.00 0.00 O ATOM 0 H GLY B 30 -0.809 10.815 -6.649 1.00 0.00 H new ATOM 0 HA2 GLY B 30 1.878 11.835 -5.820 1.00 0.00 H new ATOM 0 HA3 GLY B 30 0.835 10.766 -4.905 1.00 0.00 H new ATOM 1532 N VAL B 31 3.124 9.530 -5.991 1.00 0.00 N ATOM 1533 CA VAL B 31 3.926 8.362 -6.475 1.00 0.00 C ATOM 1534 C VAL B 31 4.259 7.462 -5.293 1.00 0.00 C ATOM 1535 O VAL B 31 4.694 7.919 -4.250 1.00 0.00 O ATOM 1536 CB VAL B 31 5.220 8.855 -7.119 1.00 0.00 C ATOM 1537 CG1 VAL B 31 6.144 7.662 -7.399 1.00 0.00 C ATOM 1538 CG2 VAL B 31 4.884 9.564 -8.430 1.00 0.00 C ATOM 0 H VAL B 31 3.579 10.089 -5.270 1.00 0.00 H new ATOM 0 HA VAL B 31 3.349 7.805 -7.213 1.00 0.00 H new ATOM 0 HB VAL B 31 5.726 9.547 -6.446 1.00 0.00 H new ATOM 0 HG11 VAL B 31 7.067 8.016 -7.859 1.00 0.00 H new ATOM 0 HG12 VAL B 31 6.377 7.154 -6.463 1.00 0.00 H new ATOM 0 HG13 VAL B 31 5.646 6.967 -8.075 1.00 0.00 H new ATOM 0 HG21 VAL B 31 5.802 9.920 -8.897 1.00 0.00 H new ATOM 0 HG22 VAL B 31 4.381 8.868 -9.102 1.00 0.00 H new ATOM 0 HG23 VAL B 31 4.228 10.411 -8.228 1.00 0.00 H new ATOM 1548 N LEU B 32 4.058 6.179 -5.452 1.00 0.00 N ATOM 1549 CA LEU B 32 4.355 5.212 -4.353 1.00 0.00 C ATOM 1550 C LEU B 32 5.483 4.272 -4.777 1.00 0.00 C ATOM 1551 O LEU B 32 5.521 3.793 -5.895 1.00 0.00 O ATOM 1552 CB LEU B 32 3.101 4.390 -4.042 1.00 0.00 C ATOM 1553 CG LEU B 32 3.377 3.436 -2.866 1.00 0.00 C ATOM 1554 CD1 LEU B 32 3.767 4.235 -1.610 1.00 0.00 C ATOM 1555 CD2 LEU B 32 2.122 2.601 -2.586 1.00 0.00 C ATOM 0 H LEU B 32 3.696 5.756 -6.307 1.00 0.00 H new ATOM 0 HA LEU B 32 4.662 5.765 -3.465 1.00 0.00 H new ATOM 0 HB2 LEU B 32 2.272 5.054 -3.796 1.00 0.00 H new ATOM 0 HB3 LEU B 32 2.802 3.820 -4.922 1.00 0.00 H new ATOM 0 HG LEU B 32 4.204 2.776 -3.127 1.00 0.00 H new ATOM 0 HD11 LEU B 32 3.959 3.547 -0.786 1.00 0.00 H new ATOM 0 HD12 LEU B 32 4.666 4.817 -1.814 1.00 0.00 H new ATOM 0 HD13 LEU B 32 2.953 4.907 -1.339 1.00 0.00 H new ATOM 0 HD21 LEU B 32 2.314 1.924 -1.754 1.00 0.00 H new ATOM 0 HD22 LEU B 32 1.294 3.263 -2.332 1.00 0.00 H new ATOM 0 HD23 LEU B 32 1.865 2.022 -3.473 1.00 0.00 H new ATOM 1567 N SER B 33 6.405 4.005 -3.883 1.00 0.00 N ATOM 1568 CA SER B 33 7.545 3.091 -4.200 1.00 0.00 C ATOM 1569 C SER B 33 7.519 1.902 -3.236 1.00 0.00 C ATOM 1570 O SER B 33 7.279 2.055 -2.050 1.00 0.00 O ATOM 1571 CB SER B 33 8.863 3.857 -4.054 1.00 0.00 C ATOM 1572 OG SER B 33 9.809 3.330 -4.975 1.00 0.00 O ATOM 0 H SER B 33 6.415 4.386 -2.937 1.00 0.00 H new ATOM 0 HA SER B 33 7.456 2.725 -5.223 1.00 0.00 H new ATOM 0 HB2 SER B 33 8.704 4.919 -4.243 1.00 0.00 H new ATOM 0 HB3 SER B 33 9.240 3.768 -3.035 1.00 0.00 H new ATOM 0 HG SER B 33 10.634 3.857 -4.934 1.00 0.00 H new ATOM 1578 N ILE B 34 7.762 0.719 -3.739 1.00 0.00 N ATOM 1579 CA ILE B 34 7.750 -0.504 -2.879 1.00 0.00 C ATOM 1580 C ILE B 34 9.150 -1.106 -2.834 1.00 0.00 C ATOM 1581 O ILE B 34 9.793 -1.294 -3.851 1.00 0.00 O ATOM 1582 CB ILE B 34 6.767 -1.523 -3.461 1.00 0.00 C ATOM 1583 CG1 ILE B 34 5.338 -0.915 -3.497 1.00 0.00 C ATOM 1584 CG2 ILE B 34 6.777 -2.782 -2.583 1.00 0.00 C ATOM 1585 CD1 ILE B 34 5.067 -0.281 -4.865 1.00 0.00 C ATOM 0 H ILE B 34 7.971 0.546 -4.722 1.00 0.00 H new ATOM 0 HA ILE B 34 7.440 -0.239 -1.868 1.00 0.00 H new ATOM 0 HB ILE B 34 7.064 -1.782 -4.477 1.00 0.00 H new ATOM 0 HG12 ILE B 34 4.600 -1.691 -3.295 1.00 0.00 H new ATOM 0 HG13 ILE B 34 5.234 -0.165 -2.713 1.00 0.00 H new ATOM 0 HG21 ILE B 34 6.080 -3.515 -2.989 1.00 0.00 H new ATOM 0 HG22 ILE B 34 7.781 -3.207 -2.567 1.00 0.00 H new ATOM 0 HG23 ILE B 34 6.478 -2.520 -1.568 1.00 0.00 H new ATOM 0 HD11 ILE B 34 4.062 0.142 -4.878 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.795 0.509 -5.051 1.00 0.00 H new ATOM 0 HD13 ILE B 34 5.150 -1.041 -5.641 1.00 0.00 H new ATOM 1597 N LYS B 35 9.625 -1.400 -1.650 1.00 0.00 N ATOM 1598 CA LYS B 35 10.990 -1.988 -1.493 1.00 0.00 C ATOM 1599 C LYS B 35 10.916 -3.247 -0.632 1.00 0.00 C ATOM 1600 O LYS B 35 10.185 -3.311 0.343 1.00 0.00 O ATOM 1601 CB LYS B 35 11.897 -0.971 -0.807 1.00 0.00 C ATOM 1602 CG LYS B 35 12.161 0.202 -1.751 1.00 0.00 C ATOM 1603 CD LYS B 35 13.058 1.223 -1.048 1.00 0.00 C ATOM 1604 CE LYS B 35 13.301 2.414 -1.974 1.00 0.00 C ATOM 1605 NZ LYS B 35 14.112 1.973 -3.146 1.00 0.00 N ATOM 0 H LYS B 35 9.119 -1.256 -0.776 1.00 0.00 H new ATOM 0 HA LYS B 35 11.387 -2.243 -2.476 1.00 0.00 H new ATOM 0 HB2 LYS B 35 11.430 -0.614 0.111 1.00 0.00 H new ATOM 0 HB3 LYS B 35 12.838 -1.442 -0.524 1.00 0.00 H new ATOM 0 HG2 LYS B 35 12.639 -0.152 -2.664 1.00 0.00 H new ATOM 0 HG3 LYS B 35 11.220 0.668 -2.043 1.00 0.00 H new ATOM 0 HD2 LYS B 35 12.589 1.558 -0.123 1.00 0.00 H new ATOM 0 HD3 LYS B 35 14.007 0.762 -0.775 1.00 0.00 H new ATOM 0 HE2 LYS B 35 12.350 2.827 -2.311 1.00 0.00 H new ATOM 0 HE3 LYS B 35 13.820 3.207 -1.436 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 14.150 2.738 -3.850 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 15.077 1.742 -2.833 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 13.676 1.131 -3.573 1.00 0.00 H new ATOM 1619 N GLY B 36 11.675 -4.245 -0.984 1.00 0.00 N ATOM 1620 CA GLY B 36 11.665 -5.508 -0.202 1.00 0.00 C ATOM 1621 C GLY B 36 12.442 -6.576 -0.966 1.00 0.00 C ATOM 1622 O GLY B 36 13.476 -6.310 -1.547 1.00 0.00 O ATOM 0 H GLY B 36 12.306 -4.239 -1.786 1.00 0.00 H new ATOM 0 HA2 GLY B 36 12.113 -5.346 0.778 1.00 0.00 H new ATOM 0 HA3 GLY B 36 10.640 -5.838 -0.033 1.00 0.00 H new ATOM 1626 N GLU B 37 11.943 -7.788 -0.971 1.00 0.00 N ATOM 1627 CA GLU B 37 12.631 -8.906 -1.694 1.00 0.00 C ATOM 1628 C GLU B 37 11.713 -9.423 -2.804 1.00 0.00 C ATOM 1629 O GLU B 37 10.526 -9.603 -2.615 1.00 0.00 O ATOM 1630 CB GLU B 37 12.950 -10.051 -0.695 1.00 0.00 C ATOM 1631 CG GLU B 37 12.821 -11.446 -1.371 1.00 0.00 C ATOM 1632 CD GLU B 37 13.698 -12.476 -0.669 1.00 0.00 C ATOM 1633 OE1 GLU B 37 14.864 -12.187 -0.470 1.00 0.00 O ATOM 1634 OE2 GLU B 37 13.194 -13.543 -0.357 1.00 0.00 O ATOM 0 H GLU B 37 11.078 -8.054 -0.500 1.00 0.00 H new ATOM 0 HA GLU B 37 13.563 -8.547 -2.131 1.00 0.00 H new ATOM 0 HB2 GLU B 37 13.960 -9.926 -0.306 1.00 0.00 H new ATOM 0 HB3 GLU B 37 12.271 -9.993 0.156 1.00 0.00 H new ATOM 0 HG2 GLU B 37 11.781 -11.771 -1.346 1.00 0.00 H new ATOM 0 HG3 GLU B 37 13.108 -11.374 -2.420 1.00 0.00 H new ATOM 1641 N LYS B 38 12.291 -9.692 -3.946 1.00 0.00 N ATOM 1642 CA LYS B 38 11.517 -10.235 -5.101 1.00 0.00 C ATOM 1643 C LYS B 38 10.116 -9.619 -5.153 1.00 0.00 C ATOM 1644 O LYS B 38 9.182 -10.090 -4.534 1.00 0.00 O ATOM 1645 CB LYS B 38 11.421 -11.757 -4.980 1.00 0.00 C ATOM 1646 CG LYS B 38 12.786 -12.380 -5.315 1.00 0.00 C ATOM 1647 CD LYS B 38 12.677 -13.910 -5.366 1.00 0.00 C ATOM 1648 CE LYS B 38 12.741 -14.500 -3.953 1.00 0.00 C ATOM 1649 NZ LYS B 38 14.018 -14.096 -3.305 1.00 0.00 N ATOM 0 H LYS B 38 13.285 -9.555 -4.129 1.00 0.00 H new ATOM 0 HA LYS B 38 12.035 -9.977 -6.025 1.00 0.00 H new ATOM 0 HB2 LYS B 38 11.120 -12.035 -3.970 1.00 0.00 H new ATOM 0 HB3 LYS B 38 10.657 -12.140 -5.657 1.00 0.00 H new ATOM 0 HG2 LYS B 38 13.140 -12.002 -6.274 1.00 0.00 H new ATOM 0 HG3 LYS B 38 13.521 -12.086 -4.566 1.00 0.00 H new ATOM 0 HD2 LYS B 38 11.741 -14.198 -5.845 1.00 0.00 H new ATOM 0 HD3 LYS B 38 13.485 -14.318 -5.974 1.00 0.00 H new ATOM 0 HE2 LYS B 38 11.894 -14.150 -3.362 1.00 0.00 H new ATOM 0 HE3 LYS B 38 12.671 -15.587 -3.998 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 14.134 -14.616 -2.412 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 14.813 -14.315 -3.938 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 14.001 -13.074 -3.111 1.00 0.00 H new ATOM 1663 N LEU B 39 9.972 -8.560 -5.899 1.00 0.00 N ATOM 1664 CA LEU B 39 8.656 -7.881 -6.026 1.00 0.00 C ATOM 1665 C LEU B 39 8.021 -8.325 -7.343 1.00 0.00 C ATOM 1666 O LEU B 39 7.951 -7.579 -8.302 1.00 0.00 O ATOM 1667 CB LEU B 39 8.881 -6.365 -6.015 1.00 0.00 C ATOM 1668 CG LEU B 39 9.017 -5.871 -4.566 1.00 0.00 C ATOM 1669 CD1 LEU B 39 10.107 -6.673 -3.842 1.00 0.00 C ATOM 1670 CD2 LEU B 39 9.388 -4.384 -4.567 1.00 0.00 C ATOM 0 H LEU B 39 10.726 -8.130 -6.435 1.00 0.00 H new ATOM 0 HA LEU B 39 7.994 -8.141 -5.200 1.00 0.00 H new ATOM 0 HB2 LEU B 39 9.780 -6.117 -6.580 1.00 0.00 H new ATOM 0 HB3 LEU B 39 8.048 -5.861 -6.505 1.00 0.00 H new ATOM 0 HG LEU B 39 8.068 -6.010 -4.048 1.00 0.00 H new ATOM 0 HD11 LEU B 39 10.199 -6.318 -2.815 1.00 0.00 H new ATOM 0 HD12 LEU B 39 9.839 -7.730 -3.838 1.00 0.00 H new ATOM 0 HD13 LEU B 39 11.058 -6.542 -4.358 1.00 0.00 H new ATOM 0 HD21 LEU B 39 9.485 -4.032 -3.540 1.00 0.00 H new ATOM 0 HD22 LEU B 39 10.335 -4.246 -5.089 1.00 0.00 H new ATOM 0 HD23 LEU B 39 8.608 -3.815 -5.073 1.00 0.00 H new ATOM 1682 N GLY B 40 7.584 -9.553 -7.397 1.00 0.00 N ATOM 1683 CA GLY B 40 6.980 -10.086 -8.657 1.00 0.00 C ATOM 1684 C GLY B 40 5.581 -9.517 -8.873 1.00 0.00 C ATOM 1685 O GLY B 40 4.978 -8.947 -7.985 1.00 0.00 O ATOM 0 H GLY B 40 7.618 -10.215 -6.621 1.00 0.00 H new ATOM 0 HA2 GLY B 40 7.615 -9.832 -9.505 1.00 0.00 H new ATOM 0 HA3 GLY B 40 6.931 -11.174 -8.610 1.00 0.00 H new ATOM 1689 N LEU B 46 -4.435 -8.798 -17.385 1.00 0.00 N ATOM 1690 CA LEU B 46 -4.538 -7.313 -17.473 1.00 0.00 C ATOM 1691 C LEU B 46 -5.941 -6.931 -17.966 1.00 0.00 C ATOM 1692 O LEU B 46 -6.117 -6.407 -19.051 1.00 0.00 O ATOM 1693 CB LEU B 46 -3.478 -6.778 -18.441 1.00 0.00 C ATOM 1694 CG LEU B 46 -3.407 -5.243 -18.343 1.00 0.00 C ATOM 1695 CD1 LEU B 46 -2.619 -4.816 -17.091 1.00 0.00 C ATOM 1696 CD2 LEU B 46 -2.715 -4.681 -19.590 1.00 0.00 C ATOM 0 HA LEU B 46 -4.370 -6.875 -16.489 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -2.506 -7.212 -18.206 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -3.721 -7.075 -19.461 1.00 0.00 H new ATOM 0 HG LEU B 46 -4.422 -4.852 -18.272 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -2.580 -3.728 -17.039 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -3.113 -5.204 -16.200 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -1.605 -5.213 -17.146 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -2.665 -3.594 -19.520 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -1.706 -5.087 -19.660 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -3.281 -4.962 -20.478 1.00 0.00 H new ATOM 1708 N LYS B 47 -6.936 -7.198 -17.169 1.00 0.00 N ATOM 1709 CA LYS B 47 -8.337 -6.869 -17.560 1.00 0.00 C ATOM 1710 C LYS B 47 -8.656 -5.406 -17.219 1.00 0.00 C ATOM 1711 O LYS B 47 -8.603 -4.529 -18.058 1.00 0.00 O ATOM 1712 CB LYS B 47 -9.294 -7.778 -16.781 1.00 0.00 C ATOM 1713 CG LYS B 47 -10.743 -7.474 -17.185 1.00 0.00 C ATOM 1714 CD LYS B 47 -11.691 -8.430 -16.457 1.00 0.00 C ATOM 1715 CE LYS B 47 -13.131 -8.146 -16.887 1.00 0.00 C ATOM 1716 NZ LYS B 47 -13.558 -6.813 -16.372 1.00 0.00 N ATOM 0 H LYS B 47 -6.839 -7.635 -16.253 1.00 0.00 H new ATOM 0 HA LYS B 47 -8.453 -7.019 -18.633 1.00 0.00 H new ATOM 0 HB2 LYS B 47 -9.062 -8.824 -16.983 1.00 0.00 H new ATOM 0 HB3 LYS B 47 -9.165 -7.624 -15.710 1.00 0.00 H new ATOM 0 HG2 LYS B 47 -10.991 -6.442 -16.938 1.00 0.00 H new ATOM 0 HG3 LYS B 47 -10.860 -7.581 -18.263 1.00 0.00 H new ATOM 0 HD2 LYS B 47 -11.429 -9.463 -16.686 1.00 0.00 H new ATOM 0 HD3 LYS B 47 -11.591 -8.307 -15.379 1.00 0.00 H new ATOM 0 HE2 LYS B 47 -13.207 -8.167 -17.974 1.00 0.00 H new ATOM 0 HE3 LYS B 47 -13.794 -8.923 -16.506 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 -14.594 -6.736 -16.424 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 -13.253 -6.709 -15.383 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 -13.126 -6.063 -16.949 1.00 0.00 H new ATOM 1730 N ALA B 48 -8.999 -5.144 -15.990 1.00 0.00 N ATOM 1731 CA ALA B 48 -9.336 -3.750 -15.580 1.00 0.00 C ATOM 1732 C ALA B 48 -8.041 -2.954 -15.383 1.00 0.00 C ATOM 1733 O ALA B 48 -8.049 -1.814 -14.958 1.00 0.00 O ATOM 1734 CB ALA B 48 -10.133 -3.795 -14.272 1.00 0.00 C ATOM 0 H ALA B 48 -9.061 -5.839 -15.246 1.00 0.00 H new ATOM 0 HA ALA B 48 -9.936 -3.266 -16.350 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -10.384 -2.780 -13.964 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -11.049 -4.365 -14.424 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -9.533 -4.272 -13.497 1.00 0.00 H new ATOM 1740 N GLY B 49 -6.926 -3.551 -15.695 1.00 0.00 N ATOM 1741 CA GLY B 49 -5.622 -2.845 -15.530 1.00 0.00 C ATOM 1742 C GLY B 49 -5.184 -2.926 -14.064 1.00 0.00 C ATOM 1743 O GLY B 49 -4.538 -2.036 -13.544 1.00 0.00 O ATOM 0 H GLY B 49 -6.859 -4.502 -16.059 1.00 0.00 H new ATOM 0 HA2 GLY B 49 -4.867 -3.297 -16.173 1.00 0.00 H new ATOM 0 HA3 GLY B 49 -5.718 -1.803 -15.836 1.00 0.00 H new ATOM 1747 N GLN B 50 -5.544 -3.980 -13.393 1.00 0.00 N ATOM 1748 CA GLN B 50 -5.167 -4.123 -11.957 1.00 0.00 C ATOM 1749 C GLN B 50 -3.739 -4.649 -11.838 1.00 0.00 C ATOM 1750 O GLN B 50 -3.262 -5.389 -12.678 1.00 0.00 O ATOM 1751 CB GLN B 50 -6.125 -5.104 -11.281 1.00 0.00 C ATOM 1752 CG GLN B 50 -7.513 -4.467 -11.189 1.00 0.00 C ATOM 1753 CD GLN B 50 -8.499 -5.466 -10.581 1.00 0.00 C ATOM 1754 OE1 GLN B 50 -8.119 -6.548 -10.177 1.00 0.00 O ATOM 1755 NE2 GLN B 50 -9.763 -5.148 -10.498 1.00 0.00 N ATOM 0 H GLN B 50 -6.086 -4.754 -13.776 1.00 0.00 H new ATOM 0 HA GLN B 50 -5.228 -3.148 -11.473 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -6.175 -6.033 -11.849 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -5.762 -5.359 -10.285 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -7.470 -3.566 -10.578 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -7.851 -4.164 -12.180 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -10.084 -4.241 -10.836 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -10.429 -5.807 -10.095 1.00 0.00 H new ATOM 1764 N VAL B 51 -3.044 -4.262 -10.793 1.00 0.00 N ATOM 1765 CA VAL B 51 -1.632 -4.724 -10.598 1.00 0.00 C ATOM 1766 C VAL B 51 -1.469 -5.313 -9.199 1.00 0.00 C ATOM 1767 O VAL B 51 -1.910 -4.751 -8.213 1.00 0.00 O ATOM 1768 CB VAL B 51 -0.685 -3.540 -10.768 1.00 0.00 C ATOM 1769 CG1 VAL B 51 0.730 -3.940 -10.334 1.00 0.00 C ATOM 1770 CG2 VAL B 51 -0.670 -3.117 -12.237 1.00 0.00 C ATOM 0 H VAL B 51 -3.397 -3.643 -10.063 1.00 0.00 H new ATOM 0 HA VAL B 51 -1.397 -5.489 -11.337 1.00 0.00 H new ATOM 0 HB VAL B 51 -1.026 -2.710 -10.149 1.00 0.00 H new ATOM 0 HG11 VAL B 51 1.402 -3.091 -10.457 1.00 0.00 H new ATOM 0 HG12 VAL B 51 0.717 -4.244 -9.287 1.00 0.00 H new ATOM 0 HG13 VAL B 51 1.078 -4.770 -10.948 1.00 0.00 H new ATOM 0 HG21 VAL B 51 0.005 -2.271 -12.365 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -0.329 -3.950 -12.852 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -1.676 -2.828 -12.543 1.00 0.00 H new ATOM 1780 N GLU B 52 -0.821 -6.445 -9.111 1.00 0.00 N ATOM 1781 CA GLU B 52 -0.593 -7.109 -7.791 1.00 0.00 C ATOM 1782 C GLU B 52 0.906 -7.258 -7.560 1.00 0.00 C ATOM 1783 O GLU B 52 1.675 -7.430 -8.483 1.00 0.00 O ATOM 1784 CB GLU B 52 -1.254 -8.496 -7.797 1.00 0.00 C ATOM 1785 CG GLU B 52 -2.762 -8.370 -7.529 1.00 0.00 C ATOM 1786 CD GLU B 52 -3.472 -7.884 -8.795 1.00 0.00 C ATOM 1787 OE1 GLU B 52 -3.269 -8.490 -9.835 1.00 0.00 O ATOM 1788 OE2 GLU B 52 -4.211 -6.918 -8.702 1.00 0.00 O ATOM 0 H GLU B 52 -0.434 -6.946 -9.910 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.028 -6.506 -6.994 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -1.088 -8.981 -8.759 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -0.794 -9.129 -7.038 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -3.168 -9.333 -7.220 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -2.939 -7.672 -6.711 1.00 0.00 H new ATOM 1795 N VAL B 53 1.330 -7.178 -6.324 1.00 0.00 N ATOM 1796 CA VAL B 53 2.785 -7.308 -5.997 1.00 0.00 C ATOM 1797 C VAL B 53 2.968 -8.382 -4.930 1.00 0.00 C ATOM 1798 O VAL B 53 2.248 -8.430 -3.950 1.00 0.00 O ATOM 1799 CB VAL B 53 3.313 -5.970 -5.478 1.00 0.00 C ATOM 1800 CG1 VAL B 53 4.718 -6.158 -4.892 1.00 0.00 C ATOM 1801 CG2 VAL B 53 3.374 -4.976 -6.638 1.00 0.00 C ATOM 0 H VAL B 53 0.724 -7.026 -5.518 1.00 0.00 H new ATOM 0 HA VAL B 53 3.338 -7.589 -6.893 1.00 0.00 H new ATOM 0 HB VAL B 53 2.650 -5.593 -4.700 1.00 0.00 H new ATOM 0 HG11 VAL B 53 5.090 -5.202 -4.524 1.00 0.00 H new ATOM 0 HG12 VAL B 53 4.677 -6.872 -4.070 1.00 0.00 H new ATOM 0 HG13 VAL B 53 5.388 -6.534 -5.666 1.00 0.00 H new ATOM 0 HG21 VAL B 53 3.750 -4.018 -6.277 1.00 0.00 H new ATOM 0 HG22 VAL B 53 4.040 -5.359 -7.411 1.00 0.00 H new ATOM 0 HG23 VAL B 53 2.376 -4.841 -7.054 1.00 0.00 H new ATOM 1811 N GLU B 54 3.934 -9.243 -5.112 1.00 0.00 N ATOM 1812 CA GLU B 54 4.195 -10.331 -4.120 1.00 0.00 C ATOM 1813 C GLU B 54 5.612 -10.198 -3.570 1.00 0.00 C ATOM 1814 O GLU B 54 6.585 -10.142 -4.310 1.00 0.00 O ATOM 1815 CB GLU B 54 4.034 -11.694 -4.807 1.00 0.00 C ATOM 1816 CG GLU B 54 4.926 -11.767 -6.050 1.00 0.00 C ATOM 1817 CD GLU B 54 4.518 -12.977 -6.895 1.00 0.00 C ATOM 1818 OE1 GLU B 54 4.128 -13.977 -6.316 1.00 0.00 O ATOM 1819 OE2 GLU B 54 4.595 -12.880 -8.111 1.00 0.00 O ATOM 0 H GLU B 54 4.562 -9.240 -5.916 1.00 0.00 H new ATOM 0 HA GLU B 54 3.484 -10.251 -3.298 1.00 0.00 H new ATOM 0 HB2 GLU B 54 4.298 -12.493 -4.114 1.00 0.00 H new ATOM 0 HB3 GLU B 54 2.992 -11.847 -5.088 1.00 0.00 H new ATOM 0 HG2 GLU B 54 4.831 -10.852 -6.634 1.00 0.00 H new ATOM 0 HG3 GLU B 54 5.972 -11.850 -5.756 1.00 0.00 H new ATOM 1826 N GLY B 55 5.735 -10.146 -2.268 1.00 0.00 N ATOM 1827 CA GLY B 55 7.085 -10.023 -1.646 1.00 0.00 C ATOM 1828 C GLY B 55 6.962 -9.446 -0.233 1.00 0.00 C ATOM 1829 O GLY B 55 5.909 -9.010 0.188 1.00 0.00 O ATOM 0 H GLY B 55 4.957 -10.184 -1.609 1.00 0.00 H new ATOM 0 HA2 GLY B 55 7.567 -11.000 -1.608 1.00 0.00 H new ATOM 0 HA3 GLY B 55 7.718 -9.379 -2.256 1.00 0.00 H new ATOM 1833 N LEU B 56 8.043 -9.444 0.506 1.00 0.00 N ATOM 1834 CA LEU B 56 8.013 -8.903 1.898 1.00 0.00 C ATOM 1835 C LEU B 56 8.370 -7.417 1.857 1.00 0.00 C ATOM 1836 O LEU B 56 9.488 -7.040 1.564 1.00 0.00 O ATOM 1837 CB LEU B 56 9.023 -9.669 2.778 1.00 0.00 C ATOM 1838 CG LEU B 56 10.274 -10.062 1.960 1.00 0.00 C ATOM 1839 CD1 LEU B 56 11.510 -10.061 2.872 1.00 0.00 C ATOM 1840 CD2 LEU B 56 10.108 -11.473 1.354 1.00 0.00 C ATOM 0 H LEU B 56 8.951 -9.796 0.202 1.00 0.00 H new ATOM 0 HA LEU B 56 7.017 -9.027 2.324 1.00 0.00 H new ATOM 0 HB2 LEU B 56 9.317 -9.050 3.626 1.00 0.00 H new ATOM 0 HB3 LEU B 56 8.553 -10.564 3.185 1.00 0.00 H new ATOM 0 HG LEU B 56 10.398 -9.337 1.156 1.00 0.00 H new ATOM 0 HD11 LEU B 56 12.390 -10.339 2.292 1.00 0.00 H new ATOM 0 HD12 LEU B 56 11.651 -9.065 3.292 1.00 0.00 H new ATOM 0 HD13 LEU B 56 11.367 -10.779 3.680 1.00 0.00 H new ATOM 0 HD21 LEU B 56 10.999 -11.731 0.782 1.00 0.00 H new ATOM 0 HD22 LEU B 56 9.969 -12.199 2.155 1.00 0.00 H new ATOM 0 HD23 LEU B 56 9.239 -11.487 0.697 1.00 0.00 H new ATOM 1852 N ILE B 57 7.426 -6.570 2.153 1.00 0.00 N ATOM 1853 CA ILE B 57 7.699 -5.109 2.131 1.00 0.00 C ATOM 1854 C ILE B 57 8.535 -4.727 3.349 1.00 0.00 C ATOM 1855 O ILE B 57 8.082 -4.777 4.479 1.00 0.00 O ATOM 1856 CB ILE B 57 6.366 -4.360 2.149 1.00 0.00 C ATOM 1857 CG1 ILE B 57 5.605 -4.662 0.854 1.00 0.00 C ATOM 1858 CG2 ILE B 57 6.609 -2.855 2.260 1.00 0.00 C ATOM 1859 CD1 ILE B 57 4.170 -4.136 0.960 1.00 0.00 C ATOM 0 H ILE B 57 6.473 -6.829 2.410 1.00 0.00 H new ATOM 0 HA ILE B 57 8.253 -4.844 1.231 1.00 0.00 H new ATOM 0 HB ILE B 57 5.781 -4.686 3.009 1.00 0.00 H new ATOM 0 HG12 ILE B 57 6.111 -4.197 0.008 1.00 0.00 H new ATOM 0 HG13 ILE B 57 5.596 -5.736 0.669 1.00 0.00 H new ATOM 0 HG21 ILE B 57 5.653 -2.332 2.272 1.00 0.00 H new ATOM 0 HG22 ILE B 57 7.151 -2.641 3.181 1.00 0.00 H new ATOM 0 HG23 ILE B 57 7.197 -2.517 1.406 1.00 0.00 H new ATOM 0 HD11 ILE B 57 3.634 -4.353 0.036 1.00 0.00 H new ATOM 0 HD12 ILE B 57 3.665 -4.621 1.796 1.00 0.00 H new ATOM 0 HD13 ILE B 57 4.189 -3.059 1.124 1.00 0.00 H new ATOM 1871 N ASP B 58 9.758 -4.338 3.120 1.00 0.00 N ATOM 1872 CA ASP B 58 10.658 -3.932 4.238 1.00 0.00 C ATOM 1873 C ASP B 58 10.721 -2.407 4.297 1.00 0.00 C ATOM 1874 O ASP B 58 11.218 -1.828 5.244 1.00 0.00 O ATOM 1875 CB ASP B 58 12.055 -4.498 3.976 1.00 0.00 C ATOM 1876 CG ASP B 58 12.017 -6.027 4.078 1.00 0.00 C ATOM 1877 OD1 ASP B 58 11.368 -6.523 4.983 1.00 0.00 O ATOM 1878 OD2 ASP B 58 12.635 -6.673 3.246 1.00 0.00 O ATOM 0 H ASP B 58 10.179 -4.283 2.193 1.00 0.00 H new ATOM 0 HA ASP B 58 10.281 -4.315 5.186 1.00 0.00 H new ATOM 0 HB2 ASP B 58 12.400 -4.198 2.987 1.00 0.00 H new ATOM 0 HB3 ASP B 58 12.764 -4.093 4.698 1.00 0.00 H new ATOM 1883 N ALA B 59 10.219 -1.738 3.295 1.00 0.00 N ATOM 1884 CA ALA B 59 10.264 -0.247 3.326 1.00 0.00 C ATOM 1885 C ALA B 59 9.312 0.346 2.284 1.00 0.00 C ATOM 1886 O ALA B 59 9.159 -0.162 1.192 1.00 0.00 O ATOM 1887 CB ALA B 59 11.694 0.242 3.049 1.00 0.00 C ATOM 0 H ALA B 59 9.786 -2.150 2.468 1.00 0.00 H new ATOM 0 HA ALA B 59 9.951 0.083 4.317 1.00 0.00 H new ATOM 0 HB1 ALA B 59 11.717 1.331 3.074 1.00 0.00 H new ATOM 0 HB2 ALA B 59 12.367 -0.153 3.810 1.00 0.00 H new ATOM 0 HB3 ALA B 59 12.013 -0.106 2.067 1.00 0.00 H new ATOM 1893 N LEU B 60 8.685 1.440 2.625 1.00 0.00 N ATOM 1894 CA LEU B 60 7.744 2.125 1.691 1.00 0.00 C ATOM 1895 C LEU B 60 8.154 3.580 1.574 1.00 0.00 C ATOM 1896 O LEU B 60 8.622 4.175 2.524 1.00 0.00 O ATOM 1897 CB LEU B 60 6.317 2.031 2.247 1.00 0.00 C ATOM 1898 CG LEU B 60 5.690 0.683 1.855 1.00 0.00 C ATOM 1899 CD1 LEU B 60 4.498 0.382 2.767 1.00 0.00 C ATOM 1900 CD2 LEU B 60 5.200 0.731 0.396 1.00 0.00 C ATOM 0 H LEU B 60 8.788 1.897 3.531 1.00 0.00 H new ATOM 0 HA LEU B 60 7.775 1.652 0.710 1.00 0.00 H new ATOM 0 HB2 LEU B 60 6.333 2.133 3.332 1.00 0.00 H new ATOM 0 HB3 LEU B 60 5.712 2.850 1.859 1.00 0.00 H new ATOM 0 HG LEU B 60 6.445 -0.096 1.961 1.00 0.00 H new ATOM 0 HD11 LEU B 60 4.057 -0.574 2.486 1.00 0.00 H new ATOM 0 HD12 LEU B 60 4.835 0.335 3.803 1.00 0.00 H new ATOM 0 HD13 LEU B 60 3.752 1.170 2.663 1.00 0.00 H new ATOM 0 HD21 LEU B 60 4.758 -0.229 0.129 1.00 0.00 H new ATOM 0 HD22 LEU B 60 4.453 1.517 0.289 1.00 0.00 H new ATOM 0 HD23 LEU B 60 6.042 0.939 -0.264 1.00 0.00 H new ATOM 1912 N VAL B 61 8.003 4.161 0.410 1.00 0.00 N ATOM 1913 CA VAL B 61 8.401 5.589 0.238 1.00 0.00 C ATOM 1914 C VAL B 61 7.324 6.358 -0.537 1.00 0.00 C ATOM 1915 O VAL B 61 6.925 5.974 -1.620 1.00 0.00 O ATOM 1916 CB VAL B 61 9.714 5.647 -0.543 1.00 0.00 C ATOM 1917 CG1 VAL B 61 10.412 6.983 -0.276 1.00 0.00 C ATOM 1918 CG2 VAL B 61 10.611 4.491 -0.100 1.00 0.00 C ATOM 0 H VAL B 61 7.624 3.711 -0.423 1.00 0.00 H new ATOM 0 HA VAL B 61 8.521 6.044 1.221 1.00 0.00 H new ATOM 0 HB VAL B 61 9.513 5.561 -1.611 1.00 0.00 H new ATOM 0 HG11 VAL B 61 11.348 7.022 -0.834 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.766 7.801 -0.594 1.00 0.00 H new ATOM 0 HG13 VAL B 61 10.620 7.078 0.790 1.00 0.00 H new ATOM 0 HG21 VAL B 61 11.550 4.526 -0.653 1.00 0.00 H new ATOM 0 HG22 VAL B 61 10.815 4.577 0.967 1.00 0.00 H new ATOM 0 HG23 VAL B 61 10.109 3.544 -0.298 1.00 0.00 H new ATOM 1928 N TYR B 62 6.883 7.465 -0.011 1.00 0.00 N ATOM 1929 CA TYR B 62 5.871 8.303 -0.716 1.00 0.00 C ATOM 1930 C TYR B 62 6.284 9.771 -0.493 1.00 0.00 C ATOM 1931 O TYR B 62 6.685 10.126 0.597 1.00 0.00 O ATOM 1932 CB TYR B 62 4.478 8.036 -0.125 1.00 0.00 C ATOM 1933 CG TYR B 62 3.457 8.916 -0.805 1.00 0.00 C ATOM 1934 CD1 TYR B 62 2.828 8.489 -1.979 1.00 0.00 C ATOM 1935 CD2 TYR B 62 3.154 10.169 -0.267 1.00 0.00 C ATOM 1936 CE1 TYR B 62 1.886 9.313 -2.609 1.00 0.00 C ATOM 1937 CE2 TYR B 62 2.220 10.996 -0.895 1.00 0.00 C ATOM 1938 CZ TYR B 62 1.587 10.571 -2.070 1.00 0.00 C ATOM 1939 OH TYR B 62 0.662 11.386 -2.693 1.00 0.00 O ATOM 0 H TYR B 62 7.185 7.831 0.892 1.00 0.00 H new ATOM 0 HA TYR B 62 5.828 8.073 -1.781 1.00 0.00 H new ATOM 0 HB2 TYR B 62 4.212 6.987 -0.256 1.00 0.00 H new ATOM 0 HB3 TYR B 62 4.484 8.232 0.947 1.00 0.00 H new ATOM 0 HD1 TYR B 62 3.068 7.524 -2.400 1.00 0.00 H new ATOM 0 HD2 TYR B 62 3.643 10.499 0.637 1.00 0.00 H new ATOM 0 HE1 TYR B 62 1.391 8.979 -3.509 1.00 0.00 H new ATOM 0 HE2 TYR B 62 1.986 11.963 -0.475 1.00 0.00 H new ATOM 0 HH TYR B 62 -0.052 11.613 -2.061 1.00 0.00 H new ATOM 1949 N PRO B 63 6.224 10.620 -1.496 1.00 0.00 N ATOM 1950 CA PRO B 63 6.635 12.053 -1.360 1.00 0.00 C ATOM 1951 C PRO B 63 6.269 12.641 0.007 1.00 0.00 C ATOM 1952 O PRO B 63 7.018 13.401 0.593 1.00 0.00 O ATOM 1953 CB PRO B 63 5.837 12.739 -2.477 1.00 0.00 C ATOM 1954 CG PRO B 63 5.694 11.700 -3.555 1.00 0.00 C ATOM 1955 CD PRO B 63 5.771 10.324 -2.865 1.00 0.00 C ATOM 0 HA PRO B 63 7.714 12.185 -1.437 1.00 0.00 H new ATOM 0 HB2 PRO B 63 4.863 13.071 -2.118 1.00 0.00 H new ATOM 0 HB3 PRO B 63 6.358 13.622 -2.848 1.00 0.00 H new ATOM 0 HG2 PRO B 63 4.746 11.816 -4.080 1.00 0.00 H new ATOM 0 HG3 PRO B 63 6.484 11.804 -4.298 1.00 0.00 H new ATOM 0 HD2 PRO B 63 4.801 9.827 -2.863 1.00 0.00 H new ATOM 0 HD3 PRO B 63 6.468 9.661 -3.379 1.00 0.00 H new ATOM 1963 N LEU B 64 5.116 12.294 0.505 1.00 0.00 N ATOM 1964 CA LEU B 64 4.660 12.811 1.826 1.00 0.00 C ATOM 1965 C LEU B 64 4.580 14.340 1.771 1.00 0.00 C ATOM 1966 O LEU B 64 4.180 14.983 2.717 1.00 0.00 O ATOM 1967 CB LEU B 64 5.617 12.318 2.941 1.00 0.00 C ATOM 1968 CG LEU B 64 5.410 13.141 4.236 1.00 0.00 C ATOM 1969 CD1 LEU B 64 5.811 12.297 5.465 1.00 0.00 C ATOM 1970 CD2 LEU B 64 6.250 14.454 4.200 1.00 0.00 C ATOM 0 H LEU B 64 4.459 11.664 0.045 1.00 0.00 H new ATOM 0 HA LEU B 64 3.665 12.431 2.058 1.00 0.00 H new ATOM 0 HB2 LEU B 64 5.438 11.262 3.142 1.00 0.00 H new ATOM 0 HB3 LEU B 64 6.651 12.408 2.607 1.00 0.00 H new ATOM 0 HG LEU B 64 4.356 13.408 4.308 1.00 0.00 H new ATOM 0 HD11 LEU B 64 5.663 12.882 6.372 1.00 0.00 H new ATOM 0 HD12 LEU B 64 5.194 11.400 5.507 1.00 0.00 H new ATOM 0 HD13 LEU B 64 6.860 12.012 5.384 1.00 0.00 H new ATOM 0 HD21 LEU B 64 6.088 15.015 5.120 1.00 0.00 H new ATOM 0 HD22 LEU B 64 7.308 14.207 4.107 1.00 0.00 H new ATOM 0 HD23 LEU B 64 5.943 15.059 3.347 1.00 0.00 H new ATOM 1982 N GLU B 65 4.941 14.912 0.655 1.00 0.00 N ATOM 1983 CA GLU B 65 4.875 16.392 0.485 1.00 0.00 C ATOM 1984 C GLU B 65 5.978 17.072 1.296 1.00 0.00 C ATOM 1985 O GLU B 65 6.147 16.839 2.476 1.00 0.00 O ATOM 1986 CB GLU B 65 3.497 16.936 0.900 1.00 0.00 C ATOM 1987 CG GLU B 65 2.380 16.122 0.225 1.00 0.00 C ATOM 1988 CD GLU B 65 2.166 16.621 -1.210 1.00 0.00 C ATOM 1989 OE1 GLU B 65 3.148 16.825 -1.901 1.00 0.00 O ATOM 1990 OE2 GLU B 65 1.019 16.800 -1.585 1.00 0.00 O ATOM 0 H GLU B 65 5.285 14.407 -0.161 1.00 0.00 H new ATOM 0 HA GLU B 65 5.025 16.616 -0.571 1.00 0.00 H new ATOM 0 HB2 GLU B 65 3.389 16.886 1.984 1.00 0.00 H new ATOM 0 HB3 GLU B 65 3.413 17.986 0.619 1.00 0.00 H new ATOM 0 HG2 GLU B 65 2.643 15.064 0.216 1.00 0.00 H new ATOM 0 HG3 GLU B 65 1.455 16.216 0.794 1.00 0.00 H new ATOM 1997 N HIS B 66 6.732 17.917 0.651 1.00 0.00 N ATOM 1998 CA HIS B 66 7.844 18.627 1.340 1.00 0.00 C ATOM 1999 C HIS B 66 7.293 19.544 2.436 1.00 0.00 C ATOM 2000 O HIS B 66 6.150 19.955 2.414 1.00 0.00 O ATOM 2001 CB HIS B 66 8.611 19.466 0.315 1.00 0.00 C ATOM 2002 CG HIS B 66 8.781 18.679 -0.956 1.00 0.00 C ATOM 2003 ND1 HIS B 66 7.711 18.383 -1.790 1.00 0.00 N ATOM 2004 CD2 HIS B 66 9.887 18.129 -1.555 1.00 0.00 C ATOM 2005 CE1 HIS B 66 8.192 17.682 -2.835 1.00 0.00 C ATOM 2006 NE2 HIS B 66 9.510 17.502 -2.737 1.00 0.00 N ATOM 0 H HIS B 66 6.623 18.148 -0.336 1.00 0.00 H new ATOM 0 HA HIS B 66 8.508 17.893 1.797 1.00 0.00 H new ATOM 0 HB2 HIS B 66 8.073 20.392 0.112 1.00 0.00 H new ATOM 0 HB3 HIS B 66 9.586 19.745 0.715 1.00 0.00 H new ATOM 0 HD2 HIS B 66 10.894 18.176 -1.168 1.00 0.00 H new ATOM 0 HE1 HIS B 66 7.587 17.312 -3.649 1.00 0.00 H new ATOM 0 HE2 HIS B 66 10.115 17.007 -3.393 1.00 0.00 H new ATOM 2014 N HIS B 67 8.114 19.876 3.394 1.00 0.00 N ATOM 2015 CA HIS B 67 7.665 20.778 4.488 1.00 0.00 C ATOM 2016 C HIS B 67 7.759 22.225 3.996 1.00 0.00 C ATOM 2017 O HIS B 67 8.818 22.705 3.633 1.00 0.00 O ATOM 2018 CB HIS B 67 8.561 20.561 5.712 1.00 0.00 C ATOM 2019 CG HIS B 67 8.319 19.178 6.270 1.00 0.00 C ATOM 2020 ND1 HIS B 67 7.295 18.913 7.170 1.00 0.00 N ATOM 2021 CD2 HIS B 67 8.951 17.975 6.059 1.00 0.00 C ATOM 2022 CE1 HIS B 67 7.341 17.600 7.464 1.00 0.00 C ATOM 2023 NE2 HIS B 67 8.329 16.984 6.816 1.00 0.00 N ATOM 0 H HIS B 67 9.081 19.559 3.465 1.00 0.00 H new ATOM 0 HA HIS B 67 6.634 20.564 4.769 1.00 0.00 H new ATOM 0 HB2 HIS B 67 9.609 20.675 5.435 1.00 0.00 H new ATOM 0 HB3 HIS B 67 8.348 21.314 6.471 1.00 0.00 H new ATOM 0 HD2 HIS B 67 9.798 17.822 5.407 1.00 0.00 H new ATOM 0 HE1 HIS B 67 6.660 17.106 8.142 1.00 0.00 H new ATOM 0 HE2 HIS B 67 8.578 15.996 6.864 1.00 0.00 H new ATOM 2031 N HIS B 68 6.655 22.925 3.967 1.00 0.00 N ATOM 2032 CA HIS B 68 6.673 24.338 3.485 1.00 0.00 C ATOM 2033 C HIS B 68 7.693 25.142 4.296 1.00 0.00 C ATOM 2034 O HIS B 68 8.038 26.260 3.961 1.00 0.00 O ATOM 2035 CB HIS B 68 5.269 24.943 3.641 1.00 0.00 C ATOM 2036 CG HIS B 68 4.973 25.216 5.093 1.00 0.00 C ATOM 2037 ND1 HIS B 68 4.495 24.236 5.953 1.00 0.00 N ATOM 2038 CD2 HIS B 68 5.072 26.359 5.848 1.00 0.00 C ATOM 2039 CE1 HIS B 68 4.326 24.802 7.164 1.00 0.00 C ATOM 2040 NE2 HIS B 68 4.665 26.093 7.151 1.00 0.00 N ATOM 0 H HIS B 68 5.740 22.579 4.257 1.00 0.00 H new ATOM 0 HA HIS B 68 6.959 24.368 2.434 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.199 25.868 3.069 1.00 0.00 H new ATOM 0 HB3 HIS B 68 4.524 24.259 3.234 1.00 0.00 H new ATOM 0 HD2 HIS B 68 5.414 27.317 5.485 1.00 0.00 H new ATOM 0 HE1 HIS B 68 3.962 24.277 8.035 1.00 0.00 H new ATOM 0 HE2 HIS B 68 4.632 26.747 7.933 1.00 0.00 H new ATOM 2048 N HIS B 69 8.180 24.576 5.355 1.00 0.00 N ATOM 2049 CA HIS B 69 9.182 25.288 6.193 1.00 0.00 C ATOM 2050 C HIS B 69 10.365 25.716 5.327 1.00 0.00 C ATOM 2051 O HIS B 69 10.422 26.821 4.822 1.00 0.00 O ATOM 2052 CB HIS B 69 9.677 24.333 7.284 1.00 0.00 C ATOM 2053 CG HIS B 69 10.809 24.971 8.046 1.00 0.00 C ATOM 2054 ND1 HIS B 69 11.858 24.231 8.576 1.00 0.00 N ATOM 2055 CD2 HIS B 69 11.075 26.279 8.365 1.00 0.00 C ATOM 2056 CE1 HIS B 69 12.696 25.091 9.182 1.00 0.00 C ATOM 2057 NE2 HIS B 69 12.263 26.349 9.082 1.00 0.00 N ATOM 0 H HIS B 69 7.928 23.643 5.682 1.00 0.00 H new ATOM 0 HA HIS B 69 8.726 26.171 6.642 1.00 0.00 H new ATOM 0 HB2 HIS B 69 8.861 24.089 7.964 1.00 0.00 H new ATOM 0 HB3 HIS B 69 10.010 23.397 6.837 1.00 0.00 H new ATOM 0 HD2 HIS B 69 10.456 27.124 8.100 1.00 0.00 H new ATOM 0 HE1 HIS B 69 13.605 24.800 9.686 1.00 0.00 H new ATOM 0 HE2 HIS B 69 12.710 27.187 9.454 1.00 0.00 H new ATOM 2065 N HIS B 70 11.319 24.841 5.167 1.00 0.00 N ATOM 2066 CA HIS B 70 12.530 25.164 4.350 1.00 0.00 C ATOM 2067 C HIS B 70 13.010 26.583 4.673 1.00 0.00 C ATOM 2068 O HIS B 70 13.715 27.211 3.910 1.00 0.00 O ATOM 2069 CB HIS B 70 12.193 25.043 2.856 1.00 0.00 C ATOM 2070 CG HIS B 70 13.427 24.640 2.084 1.00 0.00 C ATOM 2071 ND1 HIS B 70 14.667 24.507 2.698 1.00 0.00 N ATOM 2072 CD2 HIS B 70 13.629 24.324 0.761 1.00 0.00 C ATOM 2073 CE1 HIS B 70 15.548 24.125 1.758 1.00 0.00 C ATOM 2074 NE2 HIS B 70 14.966 24.000 0.563 1.00 0.00 N ATOM 0 H HIS B 70 11.314 23.904 5.571 1.00 0.00 H new ATOM 0 HA HIS B 70 13.327 24.461 4.590 1.00 0.00 H new ATOM 0 HB2 HIS B 70 11.405 24.305 2.710 1.00 0.00 H new ATOM 0 HB3 HIS B 70 11.813 25.993 2.481 1.00 0.00 H new ATOM 0 HD2 HIS B 70 12.867 24.327 -0.005 1.00 0.00 H new ATOM 0 HE1 HIS B 70 16.596 23.942 1.946 1.00 0.00 H new ATOM 0 HE2 HIS B 70 15.410 23.724 -0.313 1.00 0.00 H new ATOM 2082 N HIS B 71 12.609 27.083 5.797 1.00 0.00 N ATOM 2083 CA HIS B 71 13.009 28.460 6.213 1.00 0.00 C ATOM 2084 C HIS B 71 12.870 29.429 5.025 1.00 0.00 C ATOM 2085 O HIS B 71 13.399 30.527 5.116 1.00 0.00 O ATOM 2086 CB HIS B 71 14.465 28.436 6.749 1.00 0.00 C ATOM 2087 CG HIS B 71 15.445 28.773 5.652 1.00 0.00 C ATOM 2088 ND1 HIS B 71 15.865 30.074 5.418 1.00 0.00 N ATOM 2089 CD2 HIS B 71 16.060 28.001 4.698 1.00 0.00 C ATOM 2090 CE1 HIS B 71 16.694 30.046 4.360 1.00 0.00 C ATOM 2091 NE2 HIS B 71 16.844 28.809 3.885 1.00 0.00 N ATOM 2092 OXT HIS B 71 12.247 29.056 4.044 1.00 0.00 O ATOM 0 H HIS B 71 12.010 26.594 6.462 1.00 0.00 H new ATOM 0 HA HIS B 71 12.353 28.809 7.010 1.00 0.00 H new ATOM 0 HB2 HIS B 71 14.568 29.149 7.567 1.00 0.00 H new ATOM 0 HB3 HIS B 71 14.692 27.450 7.155 1.00 0.00 H new ATOM 0 HD2 HIS B 71 15.951 26.931 4.596 1.00 0.00 H new ATOM 0 HE1 HIS B 71 17.179 30.918 3.946 1.00 0.00 H new ATOM 0 HE2 HIS B 71 17.415 28.518 3.091 1.00 0.00 H new TER 2100 HIS B 71