USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1229 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 43 GLN : amide:sc= 0 X(o=-3.5,f=-3.6) USER MOD Set 1.2: B 49 ASN : amide:sc= -3.54 X(o=-3.5,f=-3.7!) USER MOD Set 2.1: A 35 THR OG1 : rot 115:sc= 0.381 USER MOD Set 2.2: B 1 MET CE :methyl 152:sc= -3.25 (180deg=-3.77) USER MOD Set 3.1: A 1 MET CE :methyl -112:sc= -2.15 (180deg=-5.31) USER MOD Set 3.2: B 35 THR OG1 : rot 102:sc= 0.806 USER MOD Single : A 1 MET N :NH3+ -178:sc= 0.00718 (180deg=0.00667) USER MOD Single : A 2 ASN : amide:sc= -1.1 K(o=-1.1,f=-11!) USER MOD Single : A 3 LYS NZ :NH3+ -115:sc= -3.27! (180deg=-8.15!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -5.54! C(o=-5.5!,f=-7!) USER MOD Single : A 14 THR OG1 : rot -64:sc= -7.57! USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 SER OG : rot -51:sc= -10.3! USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -139:sc= -4.81! (180deg=-10.1!) USER MOD Single : A 27 SER OG : rot -134:sc= -3.2! USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -50:sc= -4.57! USER MOD Single : A 38 LYS NZ :NH3+ -132:sc= -0.0309 (180deg=-0.34) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.519 USER MOD Single : A 49 ASN : amide:sc= -0.488 K(o=-0.49,f=-1.7) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ -116:sc= 0.797 (180deg=-1.17) USER MOD Single : B 2 ASN : amide:sc= -2.6 K(o=-2.6,f=-6.5!) USER MOD Single : B 3 LYS NZ :NH3+ -124:sc= -2.79! (180deg=-4.46!) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 GLN : amide:sc= -0.0701 X(o=-0.07,f=-0.031) USER MOD Single : B 14 THR OG1 : rot -100:sc= -6.4! USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : B 20 SER OG : rot -167:sc= -12.9! USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl -139:sc= -6.39! (180deg=-10.9!) USER MOD Single : B 27 SER OG : rot 73:sc= 0.513 USER MOD Single : B 30 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.116) USER MOD Single : B 33 THR OG1 : rot 100:sc= -1.04 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0027) USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.422 USER MOD Single : B 51 LYS NZ :NH3+ -113:sc= -0.037 (180deg=-0.948) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 80 LYS NZ :NH3+ 146:sc= -1.86 (180deg=-4.93!) USER MOD Single : B 84 SER OG : rot 180:sc= -2.77! USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.010 3.354 11.167 1.00 0.00 N ATOM 2 CA MET A 1 4.369 4.618 10.699 1.00 0.00 C ATOM 3 C MET A 1 2.855 4.424 10.567 1.00 0.00 C ATOM 4 O MET A 1 2.320 3.395 10.927 1.00 0.00 O ATOM 5 CB MET A 1 5.000 4.900 9.332 1.00 0.00 C ATOM 6 CG MET A 1 5.817 6.191 9.400 1.00 0.00 C ATOM 7 SD MET A 1 7.064 6.184 8.090 1.00 0.00 S ATOM 8 CE MET A 1 6.141 7.193 6.906 1.00 0.00 C ATOM 0 H1 MET A 1 6.032 3.506 11.286 1.00 0.00 H new ATOM 0 H2 MET A 1 4.594 3.070 12.077 1.00 0.00 H new ATOM 0 H3 MET A 1 4.851 2.604 10.465 1.00 0.00 H new ATOM 0 HA MET A 1 4.522 5.443 11.394 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.640 4.068 9.037 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.223 4.989 8.573 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.162 7.055 9.289 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.298 6.279 10.374 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.856 6.581 6.050 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.245 7.587 7.385 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.765 8.020 6.568 1.00 0.00 H new ATOM 20 N ASN A 2 2.164 5.410 10.049 1.00 0.00 N ATOM 21 CA ASN A 2 0.680 5.301 9.885 1.00 0.00 C ATOM 22 C ASN A 2 0.099 6.632 9.425 1.00 0.00 C ATOM 23 O ASN A 2 0.790 7.625 9.356 1.00 0.00 O ATOM 24 CB ASN A 2 0.108 4.915 11.260 1.00 0.00 C ATOM 25 CG ASN A 2 0.847 5.664 12.373 1.00 0.00 C ATOM 26 OD1 ASN A 2 0.924 6.875 12.358 1.00 0.00 O ATOM 27 ND2 ASN A 2 1.396 4.988 13.344 1.00 0.00 N ATOM 0 H ASN A 2 2.567 6.291 9.731 1.00 0.00 H new ATOM 0 HA ASN A 2 0.425 4.555 9.133 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -0.956 5.151 11.298 1.00 0.00 H new ATOM 0 HB3 ASN A 2 0.202 3.840 11.412 1.00 0.00 H new ATOM 0 HD21 ASN A 2 1.890 5.477 14.090 1.00 0.00 H new ATOM 0 HD22 ASN A 2 1.331 3.970 13.357 1.00 0.00 H new ATOM 34 N LYS A 3 -1.174 6.656 9.107 1.00 0.00 N ATOM 35 CA LYS A 3 -1.818 7.928 8.645 1.00 0.00 C ATOM 36 C LYS A 3 -1.363 9.110 9.515 1.00 0.00 C ATOM 37 O LYS A 3 -1.330 10.241 9.073 1.00 0.00 O ATOM 38 CB LYS A 3 -3.325 7.690 8.791 1.00 0.00 C ATOM 39 CG LYS A 3 -3.854 6.956 7.550 1.00 0.00 C ATOM 40 CD LYS A 3 -4.330 7.974 6.505 1.00 0.00 C ATOM 41 CE LYS A 3 -5.830 7.780 6.192 1.00 0.00 C ATOM 42 NZ LYS A 3 -6.523 7.632 7.509 1.00 0.00 N ATOM 0 H LYS A 3 -1.796 5.848 9.147 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.546 8.176 7.619 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -3.525 7.102 9.687 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -3.843 8.641 8.912 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -3.071 6.327 7.127 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.676 6.297 7.829 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -4.159 8.986 6.872 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -3.746 7.864 5.591 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.225 8.633 5.640 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -5.986 6.898 5.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -6.925 6.676 7.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -5.840 7.782 8.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -7.286 8.335 7.581 1.00 0.00 H new ATOM 56 N THR A 4 -0.982 8.848 10.741 1.00 0.00 N ATOM 57 CA THR A 4 -0.497 9.949 11.628 1.00 0.00 C ATOM 58 C THR A 4 0.996 10.167 11.381 1.00 0.00 C ATOM 59 O THR A 4 1.437 11.255 11.049 1.00 0.00 O ATOM 60 CB THR A 4 -0.753 9.457 13.058 1.00 0.00 C ATOM 61 OG1 THR A 4 -2.141 9.547 13.343 1.00 0.00 O ATOM 62 CG2 THR A 4 0.030 10.315 14.055 1.00 0.00 C ATOM 0 H THR A 4 -0.986 7.920 11.165 1.00 0.00 H new ATOM 0 HA THR A 4 -1.000 10.898 11.444 1.00 0.00 H new ATOM 0 HB THR A 4 -0.425 8.421 13.146 1.00 0.00 H new ATOM 0 HG1 THR A 4 -2.309 9.232 14.256 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.158 9.959 15.068 1.00 0.00 H new ATOM 0 HG22 THR A 4 1.096 10.245 13.837 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.290 11.354 13.971 1.00 0.00 H new ATOM 70 N GLU A 5 1.777 9.132 11.516 1.00 0.00 N ATOM 71 CA GLU A 5 3.233 9.278 11.260 1.00 0.00 C ATOM 72 C GLU A 5 3.419 9.726 9.812 1.00 0.00 C ATOM 73 O GLU A 5 4.107 10.689 9.535 1.00 0.00 O ATOM 74 CB GLU A 5 3.840 7.897 11.509 1.00 0.00 C ATOM 75 CG GLU A 5 4.112 7.717 13.006 1.00 0.00 C ATOM 76 CD GLU A 5 5.600 7.433 13.230 1.00 0.00 C ATOM 77 OE1 GLU A 5 6.105 6.509 12.614 1.00 0.00 O ATOM 78 OE2 GLU A 5 6.207 8.144 14.013 1.00 0.00 O ATOM 0 H GLU A 5 1.471 8.198 11.791 1.00 0.00 H new ATOM 0 HA GLU A 5 3.715 10.017 11.900 1.00 0.00 H new ATOM 0 HB2 GLU A 5 3.160 7.121 11.157 1.00 0.00 H new ATOM 0 HB3 GLU A 5 4.767 7.789 10.945 1.00 0.00 H new ATOM 0 HG2 GLU A 5 3.817 8.615 13.549 1.00 0.00 H new ATOM 0 HG3 GLU A 5 3.512 6.896 13.398 1.00 0.00 H new ATOM 85 N LEU A 6 2.773 9.063 8.888 1.00 0.00 N ATOM 86 CA LEU A 6 2.880 9.492 7.463 1.00 0.00 C ATOM 87 C LEU A 6 2.423 10.944 7.353 1.00 0.00 C ATOM 88 O LEU A 6 2.941 11.710 6.564 1.00 0.00 O ATOM 89 CB LEU A 6 1.939 8.577 6.678 1.00 0.00 C ATOM 90 CG LEU A 6 2.716 7.381 6.130 1.00 0.00 C ATOM 91 CD1 LEU A 6 1.734 6.371 5.531 1.00 0.00 C ATOM 92 CD2 LEU A 6 3.685 7.855 5.044 1.00 0.00 C ATOM 0 H LEU A 6 2.181 8.250 9.057 1.00 0.00 H new ATOM 0 HA LEU A 6 3.899 9.424 7.081 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.131 8.232 7.323 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.479 9.130 5.859 1.00 0.00 H new ATOM 0 HG LEU A 6 3.278 6.911 6.937 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.285 5.516 5.139 1.00 0.00 H new ATOM 0 HD12 LEU A 6 1.043 6.034 6.303 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.174 6.843 4.724 1.00 0.00 H new ATOM 0 HD21 LEU A 6 4.239 7.002 4.653 1.00 0.00 H new ATOM 0 HD22 LEU A 6 3.124 8.324 4.236 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.383 8.577 5.469 1.00 0.00 H new ATOM 104 N ILE A 7 1.471 11.338 8.165 1.00 0.00 N ATOM 105 CA ILE A 7 1.009 12.756 8.128 1.00 0.00 C ATOM 106 C ILE A 7 2.238 13.642 8.324 1.00 0.00 C ATOM 107 O ILE A 7 2.534 14.499 7.519 1.00 0.00 O ATOM 108 CB ILE A 7 0.001 12.891 9.292 1.00 0.00 C ATOM 109 CG1 ILE A 7 -1.382 13.222 8.724 1.00 0.00 C ATOM 110 CG2 ILE A 7 0.427 14.007 10.258 1.00 0.00 C ATOM 111 CD1 ILE A 7 -2.311 13.681 9.856 1.00 0.00 C ATOM 0 H ILE A 7 0.999 10.742 8.845 1.00 0.00 H new ATOM 0 HA ILE A 7 0.532 13.048 7.193 1.00 0.00 H new ATOM 0 HB ILE A 7 -0.028 11.948 9.838 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -1.298 14.005 7.970 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -1.801 12.346 8.229 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -0.298 14.083 11.069 1.00 0.00 H new ATOM 0 HG22 ILE A 7 1.409 13.776 10.670 1.00 0.00 H new ATOM 0 HG23 ILE A 7 0.472 14.955 9.722 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -3.294 13.916 9.447 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -2.405 12.885 10.595 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -1.894 14.569 10.331 1.00 0.00 H new ATOM 123 N LYS A 8 2.965 13.402 9.379 1.00 0.00 N ATOM 124 CA LYS A 8 4.195 14.191 9.638 1.00 0.00 C ATOM 125 C LYS A 8 5.248 13.838 8.587 1.00 0.00 C ATOM 126 O LYS A 8 6.087 14.645 8.247 1.00 0.00 O ATOM 127 CB LYS A 8 4.640 13.797 11.061 1.00 0.00 C ATOM 128 CG LYS A 8 5.786 12.775 11.017 1.00 0.00 C ATOM 129 CD LYS A 8 5.829 11.989 12.329 1.00 0.00 C ATOM 130 CE LYS A 8 6.048 10.504 12.025 1.00 0.00 C ATOM 131 NZ LYS A 8 7.507 10.282 12.225 1.00 0.00 N ATOM 0 H LYS A 8 2.756 12.687 10.076 1.00 0.00 H new ATOM 0 HA LYS A 8 4.038 15.268 9.574 1.00 0.00 H new ATOM 0 HB2 LYS A 8 4.961 14.686 11.604 1.00 0.00 H new ATOM 0 HB3 LYS A 8 3.795 13.378 11.607 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.646 12.093 10.178 1.00 0.00 H new ATOM 0 HG3 LYS A 8 6.735 13.286 10.857 1.00 0.00 H new ATOM 0 HD2 LYS A 8 6.632 12.364 12.964 1.00 0.00 H new ATOM 0 HD3 LYS A 8 4.898 12.126 12.878 1.00 0.00 H new ATOM 0 HE2 LYS A 8 5.458 9.874 12.690 1.00 0.00 H new ATOM 0 HE3 LYS A 8 5.748 10.261 11.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 7.736 9.285 12.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 8.043 10.890 11.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 7.762 10.515 13.206 1.00 0.00 H new ATOM 145 N ALA A 9 5.199 12.641 8.054 1.00 0.00 N ATOM 146 CA ALA A 9 6.187 12.256 7.012 1.00 0.00 C ATOM 147 C ALA A 9 6.058 13.213 5.837 1.00 0.00 C ATOM 148 O ALA A 9 7.027 13.568 5.194 1.00 0.00 O ATOM 149 CB ALA A 9 5.789 10.852 6.592 1.00 0.00 C ATOM 0 H ALA A 9 4.519 11.921 8.297 1.00 0.00 H new ATOM 0 HA ALA A 9 7.217 12.293 7.367 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.473 10.495 5.822 1.00 0.00 H new ATOM 0 HB2 ALA A 9 5.835 10.187 7.455 1.00 0.00 H new ATOM 0 HB3 ALA A 9 4.773 10.865 6.197 1.00 0.00 H new ATOM 155 N ILE A 10 4.861 13.659 5.577 1.00 0.00 N ATOM 156 CA ILE A 10 4.648 14.611 4.486 1.00 0.00 C ATOM 157 C ILE A 10 4.652 15.991 5.107 1.00 0.00 C ATOM 158 O ILE A 10 5.179 16.917 4.555 1.00 0.00 O ATOM 159 CB ILE A 10 3.276 14.229 3.901 1.00 0.00 C ATOM 160 CG1 ILE A 10 3.423 13.901 2.416 1.00 0.00 C ATOM 161 CG2 ILE A 10 2.269 15.374 4.066 1.00 0.00 C ATOM 162 CD1 ILE A 10 3.981 12.484 2.255 1.00 0.00 C ATOM 0 H ILE A 10 4.019 13.393 6.088 1.00 0.00 H new ATOM 0 HA ILE A 10 5.402 14.597 3.699 1.00 0.00 H new ATOM 0 HB ILE A 10 2.907 13.358 4.442 1.00 0.00 H new ATOM 0 HG12 ILE A 10 2.457 13.981 1.918 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.088 14.621 1.938 1.00 0.00 H new ATOM 0 HG21 ILE A 10 1.309 15.077 3.644 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.146 15.601 5.125 1.00 0.00 H new ATOM 0 HG23 ILE A 10 2.636 16.259 3.546 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.085 12.252 1.195 1.00 0.00 H new ATOM 0 HD12 ILE A 10 4.956 12.420 2.738 1.00 0.00 H new ATOM 0 HD13 ILE A 10 3.300 11.770 2.717 1.00 0.00 H new ATOM 174 N ALA A 11 4.102 16.110 6.287 1.00 0.00 N ATOM 175 CA ALA A 11 4.102 17.432 6.978 1.00 0.00 C ATOM 176 C ALA A 11 5.541 17.882 7.191 1.00 0.00 C ATOM 177 O ALA A 11 5.833 19.061 7.250 1.00 0.00 O ATOM 178 CB ALA A 11 3.409 17.185 8.310 1.00 0.00 C ATOM 0 H ALA A 11 3.654 15.351 6.800 1.00 0.00 H new ATOM 0 HA ALA A 11 3.596 18.211 6.407 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.370 18.115 8.878 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.395 16.826 8.132 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.964 16.437 8.876 1.00 0.00 H new ATOM 184 N GLN A 12 6.449 16.948 7.283 1.00 0.00 N ATOM 185 CA GLN A 12 7.873 17.325 7.466 1.00 0.00 C ATOM 186 C GLN A 12 8.535 17.408 6.096 1.00 0.00 C ATOM 187 O GLN A 12 9.319 18.298 5.834 1.00 0.00 O ATOM 188 CB GLN A 12 8.495 16.229 8.346 1.00 0.00 C ATOM 189 CG GLN A 12 8.652 14.923 7.555 1.00 0.00 C ATOM 190 CD GLN A 12 9.981 14.933 6.795 1.00 0.00 C ATOM 191 OE1 GLN A 12 10.712 15.903 6.833 1.00 0.00 O ATOM 192 NE2 GLN A 12 10.326 13.885 6.099 1.00 0.00 N ATOM 0 H GLN A 12 6.264 15.946 7.239 1.00 0.00 H new ATOM 0 HA GLN A 12 8.001 18.296 7.945 1.00 0.00 H new ATOM 0 HB2 GLN A 12 9.468 16.558 8.712 1.00 0.00 H new ATOM 0 HB3 GLN A 12 7.867 16.057 9.220 1.00 0.00 H new ATOM 0 HG2 GLN A 12 8.617 14.070 8.233 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.824 14.809 6.856 1.00 0.00 H new ATOM 0 HE21 GLN A 12 9.713 13.070 6.066 1.00 0.00 H new ATOM 0 HE22 GLN A 12 11.208 13.880 5.588 1.00 0.00 H new ATOM 201 N ASP A 13 8.179 16.529 5.195 1.00 0.00 N ATOM 202 CA ASP A 13 8.753 16.630 3.831 1.00 0.00 C ATOM 203 C ASP A 13 8.155 17.885 3.208 1.00 0.00 C ATOM 204 O ASP A 13 8.768 18.567 2.411 1.00 0.00 O ATOM 205 CB ASP A 13 8.295 15.376 3.097 1.00 0.00 C ATOM 206 CG ASP A 13 9.244 14.219 3.426 1.00 0.00 C ATOM 207 OD1 ASP A 13 10.424 14.477 3.594 1.00 0.00 O ATOM 208 OD2 ASP A 13 8.772 13.097 3.502 1.00 0.00 O ATOM 0 H ASP A 13 7.526 15.760 5.345 1.00 0.00 H new ATOM 0 HA ASP A 13 9.840 16.698 3.802 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.277 15.121 3.391 1.00 0.00 H new ATOM 0 HB3 ASP A 13 8.281 15.555 2.022 1.00 0.00 H new ATOM 213 N THR A 14 6.960 18.207 3.629 1.00 0.00 N ATOM 214 CA THR A 14 6.285 19.430 3.149 1.00 0.00 C ATOM 215 C THR A 14 6.745 20.586 4.029 1.00 0.00 C ATOM 216 O THR A 14 7.567 21.393 3.641 1.00 0.00 O ATOM 217 CB THR A 14 4.783 19.178 3.353 1.00 0.00 C ATOM 218 OG1 THR A 14 4.565 18.653 4.644 1.00 0.00 O ATOM 219 CG2 THR A 14 4.265 18.198 2.296 1.00 0.00 C ATOM 0 H THR A 14 6.420 17.658 4.298 1.00 0.00 H new ATOM 0 HA THR A 14 6.505 19.665 2.108 1.00 0.00 H new ATOM 0 HB THR A 14 4.244 20.120 3.250 1.00 0.00 H new ATOM 0 HG1 THR A 14 4.997 17.776 4.718 1.00 0.00 H new ATOM 0 HG21 THR A 14 3.200 18.026 2.450 1.00 0.00 H new ATOM 0 HG22 THR A 14 4.425 18.616 1.302 1.00 0.00 H new ATOM 0 HG23 THR A 14 4.801 17.253 2.383 1.00 0.00 H new ATOM 227 N GLY A 15 6.227 20.657 5.231 1.00 0.00 N ATOM 228 CA GLY A 15 6.644 21.747 6.163 1.00 0.00 C ATOM 229 C GLY A 15 6.433 23.118 5.512 1.00 0.00 C ATOM 230 O GLY A 15 6.932 24.119 5.986 1.00 0.00 O ATOM 0 H GLY A 15 5.535 20.008 5.605 1.00 0.00 H new ATOM 0 HA2 GLY A 15 6.069 21.684 7.087 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.693 21.623 6.432 1.00 0.00 H new ATOM 234 N LEU A 16 5.678 23.176 4.448 1.00 0.00 N ATOM 235 CA LEU A 16 5.420 24.505 3.794 1.00 0.00 C ATOM 236 C LEU A 16 4.325 25.202 4.569 1.00 0.00 C ATOM 237 O LEU A 16 4.444 26.342 4.974 1.00 0.00 O ATOM 238 CB LEU A 16 4.927 24.246 2.358 1.00 0.00 C ATOM 239 CG LEU A 16 5.646 23.055 1.734 1.00 0.00 C ATOM 240 CD1 LEU A 16 4.764 21.828 1.861 1.00 0.00 C ATOM 241 CD2 LEU A 16 5.900 23.315 0.243 1.00 0.00 C ATOM 0 H LEU A 16 5.231 22.375 4.003 1.00 0.00 H new ATOM 0 HA LEU A 16 6.322 25.116 3.778 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.853 24.061 2.367 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.092 25.134 1.748 1.00 0.00 H new ATOM 0 HG LEU A 16 6.596 22.904 2.246 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.269 20.970 1.418 1.00 0.00 H new ATOM 0 HD12 LEU A 16 4.567 21.629 2.914 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.821 22.002 1.342 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.414 22.458 -0.193 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.949 23.466 -0.267 1.00 0.00 H new ATOM 0 HD23 LEU A 16 6.518 24.206 0.129 1.00 0.00 H new ATOM 253 N THR A 17 3.253 24.506 4.769 1.00 0.00 N ATOM 254 CA THR A 17 2.113 25.079 5.510 1.00 0.00 C ATOM 255 C THR A 17 1.435 23.992 6.343 1.00 0.00 C ATOM 256 O THR A 17 0.462 24.247 7.027 1.00 0.00 O ATOM 257 CB THR A 17 1.177 25.602 4.409 1.00 0.00 C ATOM 258 OG1 THR A 17 0.733 26.908 4.748 1.00 0.00 O ATOM 259 CG2 THR A 17 -0.031 24.678 4.243 1.00 0.00 C ATOM 0 H THR A 17 3.117 23.549 4.445 1.00 0.00 H new ATOM 0 HA THR A 17 2.403 25.865 6.207 1.00 0.00 H new ATOM 0 HB THR A 17 1.725 25.630 3.467 1.00 0.00 H new ATOM 0 HG1 THR A 17 0.137 27.244 4.046 1.00 0.00 H new ATOM 0 HG21 THR A 17 -0.681 25.066 3.459 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.310 23.679 3.971 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.584 24.629 5.181 1.00 0.00 H new ATOM 267 N GLN A 18 1.899 22.766 6.256 1.00 0.00 N ATOM 268 CA GLN A 18 1.216 21.673 6.999 1.00 0.00 C ATOM 269 C GLN A 18 -0.231 21.683 6.551 1.00 0.00 C ATOM 270 O GLN A 18 -1.131 21.340 7.290 1.00 0.00 O ATOM 271 CB GLN A 18 1.345 22.014 8.488 1.00 0.00 C ATOM 272 CG GLN A 18 2.780 22.447 8.787 1.00 0.00 C ATOM 273 CD GLN A 18 3.109 22.160 10.253 1.00 0.00 C ATOM 274 OE1 GLN A 18 2.997 23.030 11.094 1.00 0.00 O ATOM 275 NE2 GLN A 18 3.514 20.968 10.598 1.00 0.00 N ATOM 0 H GLN A 18 2.712 22.483 5.708 1.00 0.00 H new ATOM 0 HA GLN A 18 1.639 20.685 6.818 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.650 22.812 8.751 1.00 0.00 H new ATOM 0 HB3 GLN A 18 1.081 21.148 9.095 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.474 21.914 8.137 1.00 0.00 H new ATOM 0 HG3 GLN A 18 2.901 23.510 8.578 1.00 0.00 H new ATOM 0 HE21 GLN A 18 3.608 20.237 9.893 1.00 0.00 H new ATOM 0 HE22 GLN A 18 3.736 20.767 11.573 1.00 0.00 H new ATOM 284 N VAL A 19 -0.430 22.098 5.317 1.00 0.00 N ATOM 285 CA VAL A 19 -1.792 22.183 4.721 1.00 0.00 C ATOM 286 C VAL A 19 -2.822 21.816 5.788 1.00 0.00 C ATOM 287 O VAL A 19 -3.163 22.624 6.631 1.00 0.00 O ATOM 288 CB VAL A 19 -1.734 21.222 3.491 1.00 0.00 C ATOM 289 CG1 VAL A 19 -0.858 20.000 3.786 1.00 0.00 C ATOM 290 CG2 VAL A 19 -3.117 20.739 3.046 1.00 0.00 C ATOM 0 H VAL A 19 0.320 22.387 4.689 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.094 23.174 4.383 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.300 21.807 2.680 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.836 19.349 2.912 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.155 20.327 4.021 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.269 19.454 4.635 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.012 20.075 2.188 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.595 20.201 3.865 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -3.730 21.596 2.768 1.00 0.00 H new ATOM 300 N SER A 20 -3.263 20.615 5.804 1.00 0.00 N ATOM 301 CA SER A 20 -4.200 20.168 6.837 1.00 0.00 C ATOM 302 C SER A 20 -3.711 18.821 7.318 1.00 0.00 C ATOM 303 O SER A 20 -4.488 18.027 7.771 1.00 0.00 O ATOM 304 CB SER A 20 -5.561 20.067 6.165 1.00 0.00 C ATOM 305 OG SER A 20 -5.691 18.791 5.566 1.00 0.00 O ATOM 0 H SER A 20 -3.006 19.900 5.123 1.00 0.00 H new ATOM 0 HA SER A 20 -4.271 20.841 7.692 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.354 20.221 6.897 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.667 20.848 5.412 1.00 0.00 H new ATOM 0 HG SER A 20 -4.908 18.612 5.004 1.00 0.00 H new ATOM 311 N VAL A 21 -2.429 18.542 7.164 1.00 0.00 N ATOM 312 CA VAL A 21 -1.842 17.223 7.554 1.00 0.00 C ATOM 313 C VAL A 21 -2.877 16.358 8.238 1.00 0.00 C ATOM 314 O VAL A 21 -3.059 15.194 7.934 1.00 0.00 O ATOM 315 CB VAL A 21 -0.692 17.560 8.506 1.00 0.00 C ATOM 316 CG1 VAL A 21 0.425 18.261 7.731 1.00 0.00 C ATOM 317 CG2 VAL A 21 -1.180 18.474 9.634 1.00 0.00 C ATOM 0 H VAL A 21 -1.753 19.198 6.772 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.496 16.659 6.688 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.315 16.634 8.941 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.244 18.501 8.410 1.00 0.00 H new ATOM 0 HG12 VAL A 21 0.789 17.603 6.942 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.040 19.180 7.289 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.349 18.703 10.301 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.571 19.399 9.210 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.968 17.971 10.195 1.00 0.00 H new ATOM 327 N SER A 22 -3.598 16.967 9.108 1.00 0.00 N ATOM 328 CA SER A 22 -4.683 16.243 9.829 1.00 0.00 C ATOM 329 C SER A 22 -5.839 15.954 8.873 1.00 0.00 C ATOM 330 O SER A 22 -6.417 14.884 8.881 1.00 0.00 O ATOM 331 CB SER A 22 -5.126 17.191 10.942 1.00 0.00 C ATOM 332 OG SER A 22 -4.002 17.533 11.742 1.00 0.00 O ATOM 0 H SER A 22 -3.491 17.949 9.364 1.00 0.00 H new ATOM 0 HA SER A 22 -4.350 15.285 10.227 1.00 0.00 H new ATOM 0 HB2 SER A 22 -5.570 18.090 10.515 1.00 0.00 H new ATOM 0 HB3 SER A 22 -5.893 16.718 11.555 1.00 0.00 H new ATOM 0 HG SER A 22 -4.282 18.143 12.456 1.00 0.00 H new ATOM 338 N LYS A 23 -6.180 16.905 8.050 1.00 0.00 N ATOM 339 CA LYS A 23 -7.288 16.706 7.098 1.00 0.00 C ATOM 340 C LYS A 23 -6.807 16.032 5.811 1.00 0.00 C ATOM 341 O LYS A 23 -7.547 15.271 5.224 1.00 0.00 O ATOM 342 CB LYS A 23 -7.825 18.106 6.819 1.00 0.00 C ATOM 343 CG LYS A 23 -9.280 18.196 7.266 1.00 0.00 C ATOM 344 CD LYS A 23 -9.826 19.602 6.984 1.00 0.00 C ATOM 345 CE LYS A 23 -9.477 20.022 5.551 1.00 0.00 C ATOM 346 NZ LYS A 23 -10.498 21.045 5.189 1.00 0.00 N ATOM 0 H LYS A 23 -5.729 17.819 8.002 1.00 0.00 H new ATOM 0 HA LYS A 23 -8.055 16.047 7.505 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -7.226 18.848 7.347 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.747 18.331 5.755 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.878 17.452 6.740 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -9.357 17.973 8.330 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -10.907 19.616 7.123 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -9.404 20.314 7.693 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -8.469 20.433 5.495 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -9.512 19.171 4.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.325 21.381 4.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.447 20.623 5.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -10.436 21.846 5.849 1.00 0.00 H new ATOM 360 N MET A 24 -5.588 16.262 5.350 1.00 0.00 N ATOM 361 CA MET A 24 -5.193 15.551 4.097 1.00 0.00 C ATOM 362 C MET A 24 -5.139 14.059 4.395 1.00 0.00 C ATOM 363 O MET A 24 -5.359 13.254 3.520 1.00 0.00 O ATOM 364 CB MET A 24 -3.823 16.043 3.571 1.00 0.00 C ATOM 365 CG MET A 24 -3.190 17.138 4.430 1.00 0.00 C ATOM 366 SD MET A 24 -1.401 16.934 4.357 1.00 0.00 S ATOM 367 CE MET A 24 -1.413 15.291 5.108 1.00 0.00 C ATOM 0 H MET A 24 -4.890 16.878 5.766 1.00 0.00 H new ATOM 0 HA MET A 24 -5.928 15.759 3.319 1.00 0.00 H new ATOM 0 HB2 MET A 24 -3.139 15.196 3.517 1.00 0.00 H new ATOM 0 HB3 MET A 24 -3.947 16.417 2.555 1.00 0.00 H new ATOM 0 HG2 MET A 24 -3.477 18.124 4.064 1.00 0.00 H new ATOM 0 HG3 MET A 24 -3.541 17.066 5.460 1.00 0.00 H new ATOM 0 HE1 MET A 24 -0.586 15.207 5.813 1.00 0.00 H new ATOM 0 HE2 MET A 24 -2.355 15.138 5.634 1.00 0.00 H new ATOM 0 HE3 MET A 24 -1.305 14.535 4.331 1.00 0.00 H new ATOM 377 N LEU A 25 -4.889 13.666 5.629 1.00 0.00 N ATOM 378 CA LEU A 25 -4.889 12.213 5.920 1.00 0.00 C ATOM 379 C LEU A 25 -6.346 11.766 6.018 1.00 0.00 C ATOM 380 O LEU A 25 -6.756 10.815 5.381 1.00 0.00 O ATOM 381 CB LEU A 25 -4.109 12.047 7.238 1.00 0.00 C ATOM 382 CG LEU A 25 -5.029 11.697 8.416 1.00 0.00 C ATOM 383 CD1 LEU A 25 -5.789 10.391 8.139 1.00 0.00 C ATOM 384 CD2 LEU A 25 -4.185 11.504 9.679 1.00 0.00 C ATOM 0 H LEU A 25 -4.691 14.280 6.419 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.415 11.599 5.154 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.360 11.264 7.119 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.573 12.970 7.460 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.742 12.511 8.550 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -6.436 10.160 8.985 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.395 10.506 7.240 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.076 9.579 7.995 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.836 11.255 10.517 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.473 10.694 9.520 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.645 12.425 9.900 1.00 0.00 H new ATOM 396 N ALA A 26 -7.145 12.466 6.786 1.00 0.00 N ATOM 397 CA ALA A 26 -8.581 12.093 6.881 1.00 0.00 C ATOM 398 C ALA A 26 -9.161 12.137 5.472 1.00 0.00 C ATOM 399 O ALA A 26 -10.054 11.391 5.121 1.00 0.00 O ATOM 400 CB ALA A 26 -9.224 13.160 7.770 1.00 0.00 C ATOM 0 H ALA A 26 -6.864 13.272 7.345 1.00 0.00 H new ATOM 0 HA ALA A 26 -8.749 11.099 7.295 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -10.287 12.947 7.883 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -8.746 13.154 8.750 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -9.098 14.141 7.311 1.00 0.00 H new ATOM 406 N SER A 27 -8.609 12.991 4.652 1.00 0.00 N ATOM 407 CA SER A 27 -9.072 13.083 3.245 1.00 0.00 C ATOM 408 C SER A 27 -8.366 12.001 2.442 1.00 0.00 C ATOM 409 O SER A 27 -8.944 11.366 1.591 1.00 0.00 O ATOM 410 CB SER A 27 -8.646 14.469 2.763 1.00 0.00 C ATOM 411 OG SER A 27 -8.452 14.435 1.356 1.00 0.00 O ATOM 0 H SER A 27 -7.854 13.630 4.901 1.00 0.00 H new ATOM 0 HA SER A 27 -10.148 12.947 3.138 1.00 0.00 H new ATOM 0 HB2 SER A 27 -9.407 15.206 3.020 1.00 0.00 H new ATOM 0 HB3 SER A 27 -7.726 14.774 3.262 1.00 0.00 H new ATOM 0 HG SER A 27 -7.612 14.886 1.131 1.00 0.00 H new ATOM 417 N PHE A 28 -7.111 11.782 2.735 1.00 0.00 N ATOM 418 CA PHE A 28 -6.330 10.734 2.023 1.00 0.00 C ATOM 419 C PHE A 28 -7.085 9.411 2.107 1.00 0.00 C ATOM 420 O PHE A 28 -7.317 8.771 1.112 1.00 0.00 O ATOM 421 CB PHE A 28 -5.006 10.712 2.777 1.00 0.00 C ATOM 422 CG PHE A 28 -4.197 9.485 2.469 1.00 0.00 C ATOM 423 CD1 PHE A 28 -3.264 9.509 1.431 1.00 0.00 C ATOM 424 CD2 PHE A 28 -4.325 8.351 3.270 1.00 0.00 C ATOM 425 CE1 PHE A 28 -2.466 8.395 1.188 1.00 0.00 C ATOM 426 CE2 PHE A 28 -3.521 7.242 3.039 1.00 0.00 C ATOM 427 CZ PHE A 28 -2.587 7.261 1.993 1.00 0.00 C ATOM 0 H PHE A 28 -6.589 12.293 3.447 1.00 0.00 H new ATOM 0 HA PHE A 28 -6.174 10.918 0.960 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -4.428 11.600 2.519 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -5.200 10.758 3.849 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -3.161 10.391 0.817 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -5.050 8.335 4.071 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.753 8.408 0.377 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -3.615 6.366 3.664 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.962 6.399 1.811 1.00 0.00 H new ATOM 437 N GLU A 29 -7.540 9.022 3.263 1.00 0.00 N ATOM 438 CA GLU A 29 -8.342 7.779 3.321 1.00 0.00 C ATOM 439 C GLU A 29 -9.627 8.058 2.577 1.00 0.00 C ATOM 440 O GLU A 29 -10.142 7.248 1.837 1.00 0.00 O ATOM 441 CB GLU A 29 -8.641 7.528 4.791 1.00 0.00 C ATOM 442 CG GLU A 29 -8.356 6.066 5.091 1.00 0.00 C ATOM 443 CD GLU A 29 -9.557 5.435 5.799 1.00 0.00 C ATOM 444 OE1 GLU A 29 -10.114 6.083 6.671 1.00 0.00 O ATOM 445 OE2 GLU A 29 -9.900 4.315 5.458 1.00 0.00 O ATOM 0 H GLU A 29 -7.394 9.501 4.151 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.836 6.918 2.885 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.026 8.172 5.419 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -9.681 7.766 5.013 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -8.146 5.530 4.165 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.468 5.981 5.717 1.00 0.00 H new ATOM 452 N LYS A 30 -10.125 9.240 2.755 1.00 0.00 N ATOM 453 CA LYS A 30 -11.360 9.627 2.048 1.00 0.00 C ATOM 454 C LYS A 30 -11.107 9.555 0.546 1.00 0.00 C ATOM 455 O LYS A 30 -12.010 9.448 -0.228 1.00 0.00 O ATOM 456 CB LYS A 30 -11.668 11.060 2.479 1.00 0.00 C ATOM 457 CG LYS A 30 -13.136 11.368 2.181 1.00 0.00 C ATOM 458 CD LYS A 30 -13.499 12.741 2.749 1.00 0.00 C ATOM 459 CE LYS A 30 -15.000 12.791 3.044 1.00 0.00 C ATOM 460 NZ LYS A 30 -15.184 13.994 3.902 1.00 0.00 N ATOM 0 H LYS A 30 -9.727 9.956 3.362 1.00 0.00 H new ATOM 0 HA LYS A 30 -12.198 8.970 2.282 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -11.466 11.184 3.543 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -11.022 11.759 1.948 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -13.310 11.351 1.105 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -13.775 10.602 2.620 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.932 12.931 3.660 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -13.231 13.523 2.038 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -15.581 12.869 2.125 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -15.332 11.887 3.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -16.190 14.096 4.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.625 13.888 4.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -14.866 14.840 3.387 1.00 0.00 H new ATOM 474 N ILE A 31 -9.883 9.575 0.116 1.00 0.00 N ATOM 475 CA ILE A 31 -9.636 9.474 -1.346 1.00 0.00 C ATOM 476 C ILE A 31 -8.951 8.160 -1.664 1.00 0.00 C ATOM 477 O ILE A 31 -9.063 7.633 -2.746 1.00 0.00 O ATOM 478 CB ILE A 31 -8.796 10.667 -1.747 1.00 0.00 C ATOM 479 CG1 ILE A 31 -7.715 10.983 -0.725 1.00 0.00 C ATOM 480 CG2 ILE A 31 -9.723 11.866 -1.921 1.00 0.00 C ATOM 481 CD1 ILE A 31 -6.353 10.690 -1.355 1.00 0.00 C ATOM 0 H ILE A 31 -9.052 9.656 0.702 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.568 9.486 -1.910 1.00 0.00 H new ATOM 0 HB ILE A 31 -8.283 10.434 -2.680 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.775 12.028 -0.421 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.855 10.381 0.173 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -9.138 12.739 -2.211 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -10.458 11.648 -2.696 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -10.236 12.069 -0.981 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.564 10.911 -0.636 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -6.302 9.639 -1.638 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.221 11.311 -2.241 1.00 0.00 H new ATOM 493 N ILE A 32 -8.294 7.599 -0.711 1.00 0.00 N ATOM 494 CA ILE A 32 -7.665 6.280 -0.941 1.00 0.00 C ATOM 495 C ILE A 32 -8.749 5.247 -0.741 1.00 0.00 C ATOM 496 O ILE A 32 -8.976 4.381 -1.564 1.00 0.00 O ATOM 497 CB ILE A 32 -6.572 6.113 0.114 1.00 0.00 C ATOM 498 CG1 ILE A 32 -5.593 7.300 0.039 1.00 0.00 C ATOM 499 CG2 ILE A 32 -5.834 4.796 -0.160 1.00 0.00 C ATOM 500 CD1 ILE A 32 -4.289 6.887 -0.648 1.00 0.00 C ATOM 0 H ILE A 32 -8.161 7.992 0.221 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.230 6.180 -1.936 1.00 0.00 H new ATOM 0 HB ILE A 32 -7.009 6.090 1.112 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -6.053 8.123 -0.509 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -5.380 7.666 1.044 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -5.049 4.658 0.583 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -6.538 3.966 -0.103 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.390 4.828 -1.155 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.613 7.741 -0.690 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.820 6.081 -0.084 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -4.504 6.545 -1.660 1.00 0.00 H new ATOM 512 N THR A 33 -9.438 5.364 0.351 1.00 0.00 N ATOM 513 CA THR A 33 -10.533 4.444 0.646 1.00 0.00 C ATOM 514 C THR A 33 -11.760 4.829 -0.177 1.00 0.00 C ATOM 515 O THR A 33 -12.491 3.988 -0.664 1.00 0.00 O ATOM 516 CB THR A 33 -10.800 4.648 2.129 1.00 0.00 C ATOM 517 OG1 THR A 33 -9.649 5.192 2.757 1.00 0.00 O ATOM 518 CG2 THR A 33 -11.113 3.315 2.748 1.00 0.00 C ATOM 0 H THR A 33 -9.276 6.078 1.061 1.00 0.00 H new ATOM 0 HA THR A 33 -10.299 3.407 0.407 1.00 0.00 H new ATOM 0 HB THR A 33 -11.637 5.334 2.259 1.00 0.00 H new ATOM 0 HG1 THR A 33 -8.862 4.660 2.515 1.00 0.00 H new ATOM 0 HG21 THR A 33 -11.307 3.445 3.813 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.994 2.889 2.268 1.00 0.00 H new ATOM 0 HG23 THR A 33 -10.265 2.643 2.613 1.00 0.00 H new ATOM 526 N GLU A 34 -12.005 6.099 -0.330 1.00 0.00 N ATOM 527 CA GLU A 34 -13.189 6.520 -1.111 1.00 0.00 C ATOM 528 C GLU A 34 -12.964 6.312 -2.611 1.00 0.00 C ATOM 529 O GLU A 34 -13.907 6.084 -3.339 1.00 0.00 O ATOM 530 CB GLU A 34 -13.343 7.984 -0.768 1.00 0.00 C ATOM 531 CG GLU A 34 -13.684 8.096 0.730 1.00 0.00 C ATOM 532 CD GLU A 34 -15.117 7.616 0.966 1.00 0.00 C ATOM 533 OE1 GLU A 34 -16.001 8.084 0.267 1.00 0.00 O ATOM 534 OE2 GLU A 34 -15.305 6.789 1.843 1.00 0.00 O ATOM 0 H GLU A 34 -11.438 6.856 0.051 1.00 0.00 H new ATOM 0 HA GLU A 34 -14.082 5.941 -0.873 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -12.423 8.525 -0.990 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -14.131 8.435 -1.372 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -12.988 7.498 1.318 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -13.576 9.129 1.062 1.00 0.00 H new ATOM 541 N THR A 35 -11.740 6.369 -3.098 1.00 0.00 N ATOM 542 CA THR A 35 -11.552 6.144 -4.564 1.00 0.00 C ATOM 543 C THR A 35 -11.624 4.656 -4.860 1.00 0.00 C ATOM 544 O THR A 35 -12.262 4.251 -5.811 1.00 0.00 O ATOM 545 CB THR A 35 -10.194 6.736 -4.939 1.00 0.00 C ATOM 546 OG1 THR A 35 -10.183 8.120 -4.614 1.00 0.00 O ATOM 547 CG2 THR A 35 -9.972 6.576 -6.441 1.00 0.00 C ATOM 0 H THR A 35 -10.893 6.555 -2.561 1.00 0.00 H new ATOM 0 HA THR A 35 -12.332 6.626 -5.153 1.00 0.00 H new ATOM 0 HB THR A 35 -9.405 6.220 -4.392 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.527 8.284 -3.905 1.00 0.00 H new ATOM 0 HG21 THR A 35 -9.004 6.997 -6.713 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.993 5.518 -6.701 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.760 7.099 -6.983 1.00 0.00 H new ATOM 555 N VAL A 36 -11.018 3.821 -4.051 1.00 0.00 N ATOM 556 CA VAL A 36 -11.135 2.354 -4.318 1.00 0.00 C ATOM 557 C VAL A 36 -12.615 2.025 -4.398 1.00 0.00 C ATOM 558 O VAL A 36 -13.061 1.287 -5.253 1.00 0.00 O ATOM 559 CB VAL A 36 -10.478 1.642 -3.135 1.00 0.00 C ATOM 560 CG1 VAL A 36 -11.052 2.153 -1.825 1.00 0.00 C ATOM 561 CG2 VAL A 36 -10.717 0.133 -3.242 1.00 0.00 C ATOM 0 H VAL A 36 -10.461 4.082 -3.237 1.00 0.00 H new ATOM 0 HA VAL A 36 -10.653 2.046 -5.246 1.00 0.00 H new ATOM 0 HB VAL A 36 -9.407 1.846 -3.156 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -10.574 1.637 -0.992 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -10.869 3.224 -1.741 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -12.125 1.965 -1.800 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -10.247 -0.371 -2.397 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -11.788 -0.067 -3.234 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -10.286 -0.239 -4.171 1.00 0.00 H new ATOM 571 N ALA A 37 -13.379 2.608 -3.520 1.00 0.00 N ATOM 572 CA ALA A 37 -14.850 2.373 -3.546 1.00 0.00 C ATOM 573 C ALA A 37 -15.502 3.224 -4.648 1.00 0.00 C ATOM 574 O ALA A 37 -16.684 3.125 -4.895 1.00 0.00 O ATOM 575 CB ALA A 37 -15.370 2.762 -2.167 1.00 0.00 C ATOM 0 H ALA A 37 -13.051 3.236 -2.786 1.00 0.00 H new ATOM 0 HA ALA A 37 -15.089 1.333 -3.767 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -16.449 2.609 -2.128 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -14.889 2.144 -1.409 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -15.145 3.811 -1.976 1.00 0.00 H new ATOM 581 N LYS A 38 -14.737 4.033 -5.335 1.00 0.00 N ATOM 582 CA LYS A 38 -15.316 4.840 -6.448 1.00 0.00 C ATOM 583 C LYS A 38 -14.717 4.364 -7.771 1.00 0.00 C ATOM 584 O LYS A 38 -15.027 4.878 -8.828 1.00 0.00 O ATOM 585 CB LYS A 38 -14.927 6.292 -6.165 1.00 0.00 C ATOM 586 CG LYS A 38 -16.173 7.094 -5.771 1.00 0.00 C ATOM 587 CD LYS A 38 -15.896 7.892 -4.493 1.00 0.00 C ATOM 588 CE LYS A 38 -16.655 7.263 -3.321 1.00 0.00 C ATOM 589 NZ LYS A 38 -18.083 7.621 -3.552 1.00 0.00 N ATOM 0 H LYS A 38 -13.739 4.169 -5.173 1.00 0.00 H new ATOM 0 HA LYS A 38 -16.399 4.739 -6.517 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -14.189 6.331 -5.364 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -14.463 6.733 -7.047 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -16.452 7.770 -6.579 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -17.015 6.420 -5.614 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -14.826 7.902 -4.283 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -16.205 8.929 -4.625 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -16.518 6.182 -3.296 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -16.300 7.651 -2.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -18.494 7.994 -2.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -18.143 8.344 -4.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -18.610 6.774 -3.848 1.00 0.00 H new ATOM 603 N GLY A 39 -13.867 3.370 -7.716 1.00 0.00 N ATOM 604 CA GLY A 39 -13.254 2.841 -8.960 1.00 0.00 C ATOM 605 C GLY A 39 -11.788 3.283 -9.047 1.00 0.00 C ATOM 606 O GLY A 39 -11.278 3.574 -10.111 1.00 0.00 O ATOM 0 H GLY A 39 -13.574 2.904 -6.857 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.316 1.753 -8.973 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -13.804 3.202 -9.829 1.00 0.00 H new ATOM 610 N ASP A 40 -11.116 3.349 -7.928 1.00 0.00 N ATOM 611 CA ASP A 40 -9.683 3.789 -7.912 1.00 0.00 C ATOM 612 C ASP A 40 -8.836 3.097 -8.980 1.00 0.00 C ATOM 613 O ASP A 40 -9.201 2.091 -9.555 1.00 0.00 O ATOM 614 CB ASP A 40 -9.161 3.396 -6.530 1.00 0.00 C ATOM 615 CG ASP A 40 -7.733 3.906 -6.333 1.00 0.00 C ATOM 616 OD1 ASP A 40 -6.824 3.291 -6.866 1.00 0.00 O ATOM 617 OD2 ASP A 40 -7.571 4.896 -5.640 1.00 0.00 O ATOM 0 H ASP A 40 -11.500 3.115 -7.013 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.619 4.857 -8.119 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -9.811 3.809 -5.758 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -9.185 2.312 -6.420 1.00 0.00 H new ATOM 622 N LYS A 41 -7.682 3.653 -9.205 1.00 0.00 N ATOM 623 CA LYS A 41 -6.710 3.106 -10.184 1.00 0.00 C ATOM 624 C LYS A 41 -5.439 3.943 -10.052 1.00 0.00 C ATOM 625 O LYS A 41 -4.997 4.586 -10.984 1.00 0.00 O ATOM 626 CB LYS A 41 -7.357 3.297 -11.560 1.00 0.00 C ATOM 627 CG LYS A 41 -7.687 1.931 -12.165 1.00 0.00 C ATOM 628 CD LYS A 41 -8.483 2.125 -13.456 1.00 0.00 C ATOM 629 CE LYS A 41 -9.423 0.935 -13.659 1.00 0.00 C ATOM 630 NZ LYS A 41 -10.473 1.429 -14.594 1.00 0.00 N ATOM 0 H LYS A 41 -7.362 4.497 -8.731 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.463 2.056 -10.031 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.264 3.894 -11.467 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -6.682 3.844 -12.218 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -6.769 1.381 -12.370 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.263 1.337 -11.456 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -9.056 3.051 -13.407 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -7.804 2.215 -14.304 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -8.892 0.080 -14.077 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -9.857 0.609 -12.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -11.156 0.668 -14.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -10.966 2.239 -14.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -10.031 1.726 -15.487 1.00 0.00 H new ATOM 644 N VAL A 42 -4.877 3.969 -8.869 1.00 0.00 N ATOM 645 CA VAL A 42 -3.665 4.800 -8.632 1.00 0.00 C ATOM 646 C VAL A 42 -2.386 3.987 -8.831 1.00 0.00 C ATOM 647 O VAL A 42 -2.238 2.897 -8.316 1.00 0.00 O ATOM 648 CB VAL A 42 -3.772 5.280 -7.175 1.00 0.00 C ATOM 649 CG1 VAL A 42 -5.129 5.946 -6.927 1.00 0.00 C ATOM 650 CG2 VAL A 42 -3.615 4.099 -6.213 1.00 0.00 C ATOM 0 H VAL A 42 -5.209 3.448 -8.057 1.00 0.00 H new ATOM 0 HA VAL A 42 -3.615 5.631 -9.335 1.00 0.00 H new ATOM 0 HB VAL A 42 -2.976 6.003 -6.999 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -5.187 6.279 -5.891 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.240 6.803 -7.591 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.927 5.230 -7.123 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -3.693 4.454 -5.185 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.400 3.367 -6.405 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.641 3.634 -6.363 1.00 0.00 H new ATOM 660 N GLN A 43 -1.455 4.533 -9.560 1.00 0.00 N ATOM 661 CA GLN A 43 -0.169 3.834 -9.789 1.00 0.00 C ATOM 662 C GLN A 43 0.954 4.698 -9.205 1.00 0.00 C ATOM 663 O GLN A 43 1.353 5.690 -9.784 1.00 0.00 O ATOM 664 CB GLN A 43 -0.071 3.699 -11.318 1.00 0.00 C ATOM 665 CG GLN A 43 1.358 3.962 -11.797 1.00 0.00 C ATOM 666 CD GLN A 43 1.593 3.243 -13.127 1.00 0.00 C ATOM 667 OE1 GLN A 43 0.680 3.082 -13.913 1.00 0.00 O ATOM 668 NE2 GLN A 43 2.787 2.802 -13.415 1.00 0.00 N ATOM 0 H GLN A 43 -1.535 5.445 -10.011 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.095 2.855 -9.315 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.382 2.699 -11.620 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -0.754 4.402 -11.794 1.00 0.00 H new ATOM 0 HG2 GLN A 43 1.521 5.033 -11.917 1.00 0.00 H new ATOM 0 HG3 GLN A 43 2.072 3.613 -11.052 1.00 0.00 H new ATOM 0 HE21 GLN A 43 3.553 2.937 -12.756 1.00 0.00 H new ATOM 0 HE22 GLN A 43 2.954 2.322 -14.300 1.00 0.00 H new ATOM 677 N LEU A 44 1.453 4.344 -8.053 1.00 0.00 N ATOM 678 CA LEU A 44 2.529 5.162 -7.435 1.00 0.00 C ATOM 679 C LEU A 44 3.827 5.004 -8.221 1.00 0.00 C ATOM 680 O LEU A 44 4.498 3.998 -8.121 1.00 0.00 O ATOM 681 CB LEU A 44 2.677 4.622 -6.013 1.00 0.00 C ATOM 682 CG LEU A 44 1.475 5.078 -5.188 1.00 0.00 C ATOM 683 CD1 LEU A 44 1.461 4.359 -3.839 1.00 0.00 C ATOM 684 CD2 LEU A 44 1.574 6.583 -4.959 1.00 0.00 C ATOM 0 H LEU A 44 1.162 3.527 -7.516 1.00 0.00 H new ATOM 0 HA LEU A 44 2.293 6.226 -7.434 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.735 3.534 -6.026 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.602 4.985 -5.565 1.00 0.00 H new ATOM 0 HG LEU A 44 0.557 4.841 -5.725 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.600 4.691 -3.259 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.396 3.283 -4.001 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.377 4.589 -3.294 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.720 6.918 -4.371 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.496 6.810 -4.423 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.577 7.098 -5.920 1.00 0.00 H new ATOM 696 N THR A 45 4.178 6.003 -9.000 1.00 0.00 N ATOM 697 CA THR A 45 5.436 5.957 -9.819 1.00 0.00 C ATOM 698 C THR A 45 5.740 4.522 -10.286 1.00 0.00 C ATOM 699 O THR A 45 5.264 4.090 -11.318 1.00 0.00 O ATOM 700 CB THR A 45 6.554 6.514 -8.911 1.00 0.00 C ATOM 701 OG1 THR A 45 7.803 5.958 -9.302 1.00 0.00 O ATOM 702 CG2 THR A 45 6.288 6.178 -7.439 1.00 0.00 C ATOM 0 H THR A 45 3.637 6.862 -9.105 1.00 0.00 H new ATOM 0 HA THR A 45 5.344 6.550 -10.729 1.00 0.00 H new ATOM 0 HB THR A 45 6.575 7.598 -9.020 1.00 0.00 H new ATOM 0 HG1 THR A 45 8.513 6.312 -8.727 1.00 0.00 H new ATOM 0 HG21 THR A 45 7.091 6.582 -6.823 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.339 6.616 -7.132 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.245 5.096 -7.315 1.00 0.00 H new ATOM 710 N GLY A 46 6.519 3.781 -9.541 1.00 0.00 N ATOM 711 CA GLY A 46 6.832 2.385 -9.951 1.00 0.00 C ATOM 712 C GLY A 46 7.059 1.527 -8.707 1.00 0.00 C ATOM 713 O GLY A 46 7.877 0.629 -8.707 1.00 0.00 O ATOM 0 H GLY A 46 6.950 4.084 -8.668 1.00 0.00 H new ATOM 0 HA2 GLY A 46 6.013 1.976 -10.543 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.720 2.371 -10.583 1.00 0.00 H new ATOM 717 N PHE A 47 6.345 1.793 -7.640 1.00 0.00 N ATOM 718 CA PHE A 47 6.540 0.979 -6.407 1.00 0.00 C ATOM 719 C PHE A 47 5.195 0.542 -5.797 1.00 0.00 C ATOM 720 O PHE A 47 5.120 -0.481 -5.143 1.00 0.00 O ATOM 721 CB PHE A 47 7.380 1.864 -5.469 1.00 0.00 C ATOM 722 CG PHE A 47 6.510 2.770 -4.642 1.00 0.00 C ATOM 723 CD1 PHE A 47 5.846 2.271 -3.527 1.00 0.00 C ATOM 724 CD2 PHE A 47 6.379 4.112 -4.990 1.00 0.00 C ATOM 725 CE1 PHE A 47 5.045 3.112 -2.760 1.00 0.00 C ATOM 726 CE2 PHE A 47 5.576 4.958 -4.222 1.00 0.00 C ATOM 727 CZ PHE A 47 4.909 4.457 -3.107 1.00 0.00 C ATOM 0 H PHE A 47 5.644 2.531 -7.572 1.00 0.00 H new ATOM 0 HA PHE A 47 7.054 0.039 -6.607 1.00 0.00 H new ATOM 0 HB2 PHE A 47 7.979 1.234 -4.812 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.075 2.463 -6.057 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.952 1.231 -3.256 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.899 4.499 -5.854 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.528 2.723 -1.895 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.473 5.999 -4.492 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.287 5.109 -2.511 1.00 0.00 H new ATOM 737 N LEU A 48 4.128 1.271 -6.021 1.00 0.00 N ATOM 738 CA LEU A 48 2.811 0.832 -5.463 1.00 0.00 C ATOM 739 C LEU A 48 1.688 1.069 -6.480 1.00 0.00 C ATOM 740 O LEU A 48 1.254 2.182 -6.694 1.00 0.00 O ATOM 741 CB LEU A 48 2.575 1.672 -4.206 1.00 0.00 C ATOM 742 CG LEU A 48 3.020 0.932 -2.930 1.00 0.00 C ATOM 743 CD1 LEU A 48 2.394 1.614 -1.716 1.00 0.00 C ATOM 744 CD2 LEU A 48 2.581 -0.540 -2.952 1.00 0.00 C ATOM 0 H LEU A 48 4.111 2.138 -6.558 1.00 0.00 H new ATOM 0 HA LEU A 48 2.818 -0.234 -5.234 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.120 2.612 -4.290 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.517 1.923 -4.130 1.00 0.00 H new ATOM 0 HG LEU A 48 4.108 0.966 -2.878 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.704 1.097 -0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.723 2.652 -1.672 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.308 1.581 -1.800 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.911 -1.032 -2.037 1.00 0.00 H new ATOM 0 HD22 LEU A 48 1.495 -0.595 -3.021 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.025 -1.039 -3.813 1.00 0.00 H new ATOM 756 N ASN A 49 1.212 0.025 -7.107 1.00 0.00 N ATOM 757 CA ASN A 49 0.115 0.186 -8.110 1.00 0.00 C ATOM 758 C ASN A 49 -1.217 -0.320 -7.543 1.00 0.00 C ATOM 759 O ASN A 49 -1.676 -1.393 -7.881 1.00 0.00 O ATOM 760 CB ASN A 49 0.548 -0.670 -9.301 1.00 0.00 C ATOM 761 CG ASN A 49 0.040 -0.037 -10.598 1.00 0.00 C ATOM 762 OD1 ASN A 49 0.759 0.692 -11.253 1.00 0.00 O ATOM 763 ND2 ASN A 49 -1.176 -0.286 -10.999 1.00 0.00 N ATOM 0 H ASN A 49 1.535 -0.933 -6.969 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.040 1.230 -8.384 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.635 -0.753 -9.326 1.00 0.00 H new ATOM 0 HB3 ASN A 49 0.153 -1.681 -9.198 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -1.524 0.131 -11.862 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -1.779 -0.898 -10.449 1.00 0.00 H new ATOM 770 N ILE A 50 -1.844 0.446 -6.686 1.00 0.00 N ATOM 771 CA ILE A 50 -3.149 0.002 -6.101 1.00 0.00 C ATOM 772 C ILE A 50 -4.206 -0.107 -7.208 1.00 0.00 C ATOM 773 O ILE A 50 -4.643 0.889 -7.751 1.00 0.00 O ATOM 774 CB ILE A 50 -3.522 1.097 -5.082 1.00 0.00 C ATOM 775 CG1 ILE A 50 -2.970 0.740 -3.694 1.00 0.00 C ATOM 776 CG2 ILE A 50 -5.046 1.246 -4.988 1.00 0.00 C ATOM 777 CD1 ILE A 50 -3.566 -0.587 -3.214 1.00 0.00 C ATOM 0 H ILE A 50 -1.512 1.356 -6.366 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.087 -0.978 -5.628 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.086 2.037 -5.420 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.883 0.666 -3.735 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.209 1.532 -2.985 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.292 2.023 -4.264 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.446 1.520 -5.964 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.485 0.301 -4.669 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -3.167 -0.830 -2.229 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -4.651 -0.498 -3.155 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.305 -1.378 -3.916 1.00 0.00 H new ATOM 789 N LYS A 51 -4.621 -1.302 -7.552 1.00 0.00 N ATOM 790 CA LYS A 51 -5.648 -1.439 -8.628 1.00 0.00 C ATOM 791 C LYS A 51 -6.781 -2.376 -8.155 1.00 0.00 C ATOM 792 O LYS A 51 -6.538 -3.521 -7.837 1.00 0.00 O ATOM 793 CB LYS A 51 -4.856 -2.009 -9.824 1.00 0.00 C ATOM 794 CG LYS A 51 -5.553 -3.228 -10.438 1.00 0.00 C ATOM 795 CD LYS A 51 -6.867 -2.794 -11.092 1.00 0.00 C ATOM 796 CE LYS A 51 -7.100 -3.613 -12.365 1.00 0.00 C ATOM 797 NZ LYS A 51 -6.515 -2.793 -13.462 1.00 0.00 N ATOM 0 H LYS A 51 -4.297 -2.177 -7.140 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.142 -0.504 -8.894 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -4.739 -1.236 -10.584 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -3.855 -2.289 -9.497 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.904 -3.696 -11.178 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.748 -3.974 -9.668 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -7.695 -2.937 -10.398 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -6.832 -1.731 -11.332 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.618 -4.588 -12.301 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -8.162 -3.793 -12.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -6.636 -3.289 -14.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -6.998 -1.873 -13.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -5.502 -2.644 -13.281 1.00 0.00 H new ATOM 811 N PRO A 52 -7.987 -1.851 -8.106 1.00 0.00 N ATOM 812 CA PRO A 52 -9.145 -2.658 -7.650 1.00 0.00 C ATOM 813 C PRO A 52 -9.662 -3.579 -8.749 1.00 0.00 C ATOM 814 O PRO A 52 -9.758 -3.215 -9.905 1.00 0.00 O ATOM 815 CB PRO A 52 -10.193 -1.619 -7.290 1.00 0.00 C ATOM 816 CG PRO A 52 -9.857 -0.418 -8.110 1.00 0.00 C ATOM 817 CD PRO A 52 -8.385 -0.482 -8.453 1.00 0.00 C ATOM 0 HA PRO A 52 -8.884 -3.313 -6.819 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.197 -1.979 -7.514 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.168 -1.388 -6.225 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -10.459 -0.396 -9.018 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.080 0.495 -7.558 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.214 -0.274 -9.509 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -7.813 0.253 -7.887 1.00 0.00 H new ATOM 825 N VAL A 53 -10.004 -4.774 -8.372 1.00 0.00 N ATOM 826 CA VAL A 53 -10.531 -5.764 -9.351 1.00 0.00 C ATOM 827 C VAL A 53 -11.610 -6.633 -8.701 1.00 0.00 C ATOM 828 O VAL A 53 -11.362 -7.339 -7.746 1.00 0.00 O ATOM 829 CB VAL A 53 -9.325 -6.604 -9.752 1.00 0.00 C ATOM 830 CG1 VAL A 53 -8.271 -5.697 -10.396 1.00 0.00 C ATOM 831 CG2 VAL A 53 -8.729 -7.275 -8.509 1.00 0.00 C ATOM 0 H VAL A 53 -9.941 -5.114 -7.413 1.00 0.00 H new ATOM 0 HA VAL A 53 -10.995 -5.286 -10.214 1.00 0.00 H new ATOM 0 HB VAL A 53 -9.635 -7.371 -10.462 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.405 -6.293 -10.685 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.694 -5.219 -11.280 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.963 -4.933 -9.682 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.866 -7.875 -8.798 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.417 -6.511 -7.797 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -9.479 -7.917 -8.047 1.00 0.00 H new ATOM 841 N ALA A 54 -12.808 -6.563 -9.209 1.00 0.00 N ATOM 842 CA ALA A 54 -13.940 -7.353 -8.624 1.00 0.00 C ATOM 843 C ALA A 54 -13.516 -8.781 -8.263 1.00 0.00 C ATOM 844 O ALA A 54 -13.097 -9.553 -9.103 1.00 0.00 O ATOM 845 CB ALA A 54 -15.028 -7.372 -9.697 1.00 0.00 C ATOM 0 H ALA A 54 -13.059 -5.988 -10.013 1.00 0.00 H new ATOM 0 HA ALA A 54 -14.287 -6.901 -7.695 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -15.888 -7.935 -9.334 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -15.333 -6.350 -9.924 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -14.640 -7.844 -10.600 1.00 0.00 H new ATOM 1164 N VAL A 75 -14.430 -6.058 -4.300 1.00 0.00 N ATOM 1165 CA VAL A 75 -13.405 -5.906 -5.379 1.00 0.00 C ATOM 1166 C VAL A 75 -12.031 -6.312 -4.842 1.00 0.00 C ATOM 1167 O VAL A 75 -11.891 -6.697 -3.697 1.00 0.00 O ATOM 1168 CB VAL A 75 -13.445 -4.418 -5.797 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -12.188 -3.672 -5.331 1.00 0.00 C ATOM 1170 CG2 VAL A 75 -13.533 -4.319 -7.323 1.00 0.00 C ATOM 0 HA VAL A 75 -13.606 -6.545 -6.239 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.318 -3.962 -5.329 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -12.248 -2.629 -5.641 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.116 -3.724 -4.245 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -11.306 -4.132 -5.776 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -13.561 -3.270 -7.619 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -12.662 -4.798 -7.770 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -14.439 -4.818 -7.668 1.00 0.00 H new ATOM 1180 N GLY A 76 -11.023 -6.231 -5.657 1.00 0.00 N ATOM 1181 CA GLY A 76 -9.665 -6.617 -5.192 1.00 0.00 C ATOM 1182 C GLY A 76 -8.703 -5.451 -5.396 1.00 0.00 C ATOM 1183 O GLY A 76 -8.029 -5.366 -6.403 1.00 0.00 O ATOM 0 H GLY A 76 -11.079 -5.915 -6.625 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -9.696 -6.896 -4.139 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -9.316 -7.490 -5.743 1.00 0.00 H new ATOM 1187 N VAL A 77 -8.627 -4.557 -4.444 1.00 0.00 N ATOM 1188 CA VAL A 77 -7.689 -3.403 -4.578 1.00 0.00 C ATOM 1189 C VAL A 77 -6.262 -3.933 -4.591 1.00 0.00 C ATOM 1190 O VAL A 77 -5.505 -3.746 -3.657 1.00 0.00 O ATOM 1191 CB VAL A 77 -7.943 -2.524 -3.344 1.00 0.00 C ATOM 1192 CG1 VAL A 77 -7.813 -3.363 -2.071 1.00 0.00 C ATOM 1193 CG2 VAL A 77 -6.924 -1.380 -3.299 1.00 0.00 C ATOM 0 H VAL A 77 -9.172 -4.576 -3.582 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.838 -2.834 -5.495 1.00 0.00 H new ATOM 0 HB VAL A 77 -8.950 -2.112 -3.408 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.994 -2.733 -1.200 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -8.543 -4.172 -2.092 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.809 -3.782 -2.013 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.110 -0.761 -2.421 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -5.916 -1.792 -3.245 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.020 -0.772 -4.199 1.00 0.00 H new ATOM 1203 N SER A 78 -5.896 -4.619 -5.636 1.00 0.00 N ATOM 1204 CA SER A 78 -4.529 -5.192 -5.697 1.00 0.00 C ATOM 1205 C SER A 78 -3.476 -4.089 -5.748 1.00 0.00 C ATOM 1206 O SER A 78 -3.778 -2.919 -5.842 1.00 0.00 O ATOM 1207 CB SER A 78 -4.502 -6.015 -6.984 1.00 0.00 C ATOM 1208 OG SER A 78 -4.823 -7.367 -6.683 1.00 0.00 O ATOM 0 H SER A 78 -6.485 -4.806 -6.448 1.00 0.00 H new ATOM 0 HA SER A 78 -4.304 -5.794 -4.817 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.215 -5.611 -7.703 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.516 -5.957 -7.446 1.00 0.00 H new ATOM 0 HG SER A 78 -4.808 -7.898 -7.507 1.00 0.00 H new ATOM 1214 N VAL A 79 -2.241 -4.487 -5.691 1.00 0.00 N ATOM 1215 CA VAL A 79 -1.088 -3.541 -5.735 1.00 0.00 C ATOM 1216 C VAL A 79 0.187 -4.360 -5.513 1.00 0.00 C ATOM 1217 O VAL A 79 0.144 -5.576 -5.513 1.00 0.00 O ATOM 1218 CB VAL A 79 -1.317 -2.550 -4.583 1.00 0.00 C ATOM 1219 CG1 VAL A 79 -0.964 -3.200 -3.246 1.00 0.00 C ATOM 1220 CG2 VAL A 79 -0.448 -1.309 -4.789 1.00 0.00 C ATOM 0 H VAL A 79 -1.969 -5.467 -5.613 1.00 0.00 H new ATOM 0 HA VAL A 79 -0.997 -3.005 -6.680 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.369 -2.263 -4.573 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.131 -2.486 -2.439 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -1.592 -4.077 -3.091 1.00 0.00 H new ATOM 0 HG13 VAL A 79 0.084 -3.501 -3.253 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -0.613 -0.609 -3.970 1.00 0.00 H new ATOM 0 HG22 VAL A 79 0.602 -1.600 -4.811 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -0.712 -0.832 -5.733 1.00 0.00 H new ATOM 1230 N LYS A 80 1.309 -3.732 -5.274 1.00 0.00 N ATOM 1231 CA LYS A 80 2.534 -4.525 -5.001 1.00 0.00 C ATOM 1232 C LYS A 80 3.699 -3.620 -4.576 1.00 0.00 C ATOM 1233 O LYS A 80 3.621 -2.412 -4.661 1.00 0.00 O ATOM 1234 CB LYS A 80 2.855 -5.212 -6.336 1.00 0.00 C ATOM 1235 CG LYS A 80 3.118 -4.154 -7.412 1.00 0.00 C ATOM 1236 CD LYS A 80 2.790 -4.734 -8.790 1.00 0.00 C ATOM 1237 CE LYS A 80 3.042 -3.672 -9.863 1.00 0.00 C ATOM 1238 NZ LYS A 80 3.521 -4.434 -11.050 1.00 0.00 N ATOM 0 H LYS A 80 1.426 -2.719 -5.257 1.00 0.00 H new ATOM 0 HA LYS A 80 2.384 -5.234 -4.187 1.00 0.00 H new ATOM 0 HB2 LYS A 80 3.728 -5.855 -6.224 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.024 -5.851 -6.636 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.509 -3.270 -7.224 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.160 -3.837 -7.378 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.405 -5.613 -8.982 1.00 0.00 H new ATOM 0 HD3 LYS A 80 1.750 -5.059 -8.822 1.00 0.00 H new ATOM 0 HE2 LYS A 80 2.132 -3.117 -10.091 1.00 0.00 H new ATOM 0 HE3 LYS A 80 3.785 -2.946 -9.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 3.716 -3.775 -11.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.392 -4.947 -10.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 2.790 -5.113 -11.345 1.00 0.00 H new ATOM 1252 N PRO A 81 4.754 -4.268 -4.170 1.00 0.00 N ATOM 1253 CA PRO A 81 5.991 -3.589 -3.755 1.00 0.00 C ATOM 1254 C PRO A 81 6.938 -3.485 -4.946 1.00 0.00 C ATOM 1255 O PRO A 81 7.777 -4.340 -5.157 1.00 0.00 O ATOM 1256 CB PRO A 81 6.570 -4.542 -2.717 1.00 0.00 C ATOM 1257 CG PRO A 81 6.023 -5.896 -3.068 1.00 0.00 C ATOM 1258 CD PRO A 81 4.875 -5.704 -4.030 1.00 0.00 C ATOM 0 HA PRO A 81 5.832 -2.579 -3.377 1.00 0.00 H new ATOM 0 HB2 PRO A 81 7.660 -4.539 -2.746 1.00 0.00 H new ATOM 0 HB3 PRO A 81 6.277 -4.249 -1.709 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.799 -6.514 -3.520 1.00 0.00 H new ATOM 0 HG3 PRO A 81 5.685 -6.414 -2.171 1.00 0.00 H new ATOM 0 HD2 PRO A 81 5.077 -6.180 -4.989 1.00 0.00 H new ATOM 0 HD3 PRO A 81 3.956 -6.144 -3.643 1.00 0.00 H new ATOM 1266 N GLY A 82 6.814 -2.457 -5.727 1.00 0.00 N ATOM 1267 CA GLY A 82 7.714 -2.316 -6.907 1.00 0.00 C ATOM 1268 C GLY A 82 9.162 -2.289 -6.421 1.00 0.00 C ATOM 1269 O GLY A 82 9.432 -1.994 -5.272 1.00 0.00 O ATOM 0 H GLY A 82 6.133 -1.708 -5.605 1.00 0.00 H new ATOM 0 HA2 GLY A 82 7.563 -3.145 -7.598 1.00 0.00 H new ATOM 0 HA3 GLY A 82 7.482 -1.401 -7.452 1.00 0.00 H new ATOM 1273 N GLU A 83 10.095 -2.607 -7.274 1.00 0.00 N ATOM 1274 CA GLU A 83 11.525 -2.614 -6.848 1.00 0.00 C ATOM 1275 C GLU A 83 11.929 -1.261 -6.252 1.00 0.00 C ATOM 1276 O GLU A 83 12.924 -1.157 -5.570 1.00 0.00 O ATOM 1277 CB GLU A 83 12.325 -2.907 -8.113 1.00 0.00 C ATOM 1278 CG GLU A 83 12.062 -1.822 -9.160 1.00 0.00 C ATOM 1279 CD GLU A 83 12.922 -2.084 -10.397 1.00 0.00 C ATOM 1280 OE1 GLU A 83 12.918 -3.209 -10.870 1.00 0.00 O ATOM 1281 OE2 GLU A 83 13.572 -1.157 -10.850 1.00 0.00 O ATOM 0 H GLU A 83 9.931 -2.863 -8.248 1.00 0.00 H new ATOM 0 HA GLU A 83 11.707 -3.357 -6.072 1.00 0.00 H new ATOM 0 HB2 GLU A 83 13.389 -2.949 -7.879 1.00 0.00 H new ATOM 0 HB3 GLU A 83 12.048 -3.883 -8.511 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.007 -1.814 -9.433 1.00 0.00 H new ATOM 0 HG3 GLU A 83 12.291 -0.840 -8.746 1.00 0.00 H new ATOM 1288 N SER A 84 11.169 -0.224 -6.492 1.00 0.00 N ATOM 1289 CA SER A 84 11.532 1.104 -5.913 1.00 0.00 C ATOM 1290 C SER A 84 11.663 0.975 -4.392 1.00 0.00 C ATOM 1291 O SER A 84 12.512 1.588 -3.775 1.00 0.00 O ATOM 1292 CB SER A 84 10.383 2.039 -6.283 1.00 0.00 C ATOM 1293 OG SER A 84 10.888 3.119 -7.059 1.00 0.00 O ATOM 0 H SER A 84 10.321 -0.238 -7.058 1.00 0.00 H new ATOM 0 HA SER A 84 12.482 1.481 -6.292 1.00 0.00 H new ATOM 0 HB2 SER A 84 9.623 1.496 -6.845 1.00 0.00 H new ATOM 0 HB3 SER A 84 9.902 2.418 -5.381 1.00 0.00 H new ATOM 0 HG SER A 84 10.153 3.721 -7.300 1.00 0.00 H new ATOM 1299 N LEU A 85 10.837 0.159 -3.792 1.00 0.00 N ATOM 1300 CA LEU A 85 10.918 -0.040 -2.314 1.00 0.00 C ATOM 1301 C LEU A 85 12.021 -1.045 -2.011 1.00 0.00 C ATOM 1302 O LEU A 85 12.741 -0.929 -1.038 1.00 0.00 O ATOM 1303 CB LEU A 85 9.566 -0.631 -1.892 1.00 0.00 C ATOM 1304 CG LEU A 85 8.408 0.154 -2.519 1.00 0.00 C ATOM 1305 CD1 LEU A 85 7.576 -0.786 -3.402 1.00 0.00 C ATOM 1306 CD2 LEU A 85 7.518 0.736 -1.412 1.00 0.00 C ATOM 0 H LEU A 85 10.109 -0.379 -4.262 1.00 0.00 H new ATOM 0 HA LEU A 85 11.133 0.890 -1.788 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.510 -1.676 -2.197 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.479 -0.611 -0.806 1.00 0.00 H new ATOM 0 HG LEU A 85 8.808 0.967 -3.124 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.752 -0.230 -3.849 1.00 0.00 H new ATOM 0 HD12 LEU A 85 8.206 -1.197 -4.190 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.178 -1.599 -2.794 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.696 1.293 -1.861 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.117 -0.075 -0.804 1.00 0.00 H new ATOM 0 HD23 LEU A 85 8.108 1.403 -0.784 1.00 0.00 H new ATOM 1318 N LYS A 86 12.145 -2.041 -2.842 1.00 0.00 N ATOM 1319 CA LYS A 86 13.188 -3.079 -2.618 1.00 0.00 C ATOM 1320 C LYS A 86 14.555 -2.539 -2.980 1.00 0.00 C ATOM 1321 O LYS A 86 15.557 -2.911 -2.402 1.00 0.00 O ATOM 1322 CB LYS A 86 12.810 -4.226 -3.555 1.00 0.00 C ATOM 1323 CG LYS A 86 12.946 -5.563 -2.826 1.00 0.00 C ATOM 1324 CD LYS A 86 12.764 -6.706 -3.828 1.00 0.00 C ATOM 1325 CE LYS A 86 13.635 -7.894 -3.414 1.00 0.00 C ATOM 1326 NZ LYS A 86 12.749 -9.084 -3.546 1.00 0.00 N ATOM 0 H LYS A 86 11.566 -2.181 -3.670 1.00 0.00 H new ATOM 0 HA LYS A 86 13.235 -3.395 -1.576 1.00 0.00 H new ATOM 0 HB2 LYS A 86 11.787 -4.097 -3.907 1.00 0.00 H new ATOM 0 HB3 LYS A 86 13.453 -4.215 -4.435 1.00 0.00 H new ATOM 0 HG2 LYS A 86 13.924 -5.633 -2.350 1.00 0.00 H new ATOM 0 HG3 LYS A 86 12.201 -5.636 -2.034 1.00 0.00 H new ATOM 0 HD2 LYS A 86 11.717 -7.006 -3.867 1.00 0.00 H new ATOM 0 HD3 LYS A 86 13.038 -6.373 -4.829 1.00 0.00 H new ATOM 0 HE2 LYS A 86 14.513 -7.982 -4.054 1.00 0.00 H new ATOM 0 HE3 LYS A 86 13.996 -7.782 -2.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 13.276 -9.940 -3.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 11.926 -8.975 -2.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 12.426 -9.169 -4.531 1.00 0.00 H new ATOM 1340 N LYS A 87 14.602 -1.656 -3.923 1.00 0.00 N ATOM 1341 CA LYS A 87 15.902 -1.079 -4.313 1.00 0.00 C ATOM 1342 C LYS A 87 16.276 -0.038 -3.277 1.00 0.00 C ATOM 1343 O LYS A 87 17.430 0.121 -2.910 1.00 0.00 O ATOM 1344 CB LYS A 87 15.676 -0.441 -5.685 1.00 0.00 C ATOM 1345 CG LYS A 87 16.997 0.124 -6.209 1.00 0.00 C ATOM 1346 CD LYS A 87 16.713 1.264 -7.189 1.00 0.00 C ATOM 1347 CE LYS A 87 16.713 2.597 -6.438 1.00 0.00 C ATOM 1348 NZ LYS A 87 16.705 3.639 -7.501 1.00 0.00 N ATOM 0 H LYS A 87 13.795 -1.308 -4.441 1.00 0.00 H new ATOM 0 HA LYS A 87 16.707 -1.812 -4.366 1.00 0.00 H new ATOM 0 HB2 LYS A 87 15.283 -1.181 -6.382 1.00 0.00 H new ATOM 0 HB3 LYS A 87 14.933 0.353 -5.611 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.604 0.486 -5.379 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.569 -0.661 -6.704 1.00 0.00 H new ATOM 0 HD2 LYS A 87 17.468 1.278 -7.975 1.00 0.00 H new ATOM 0 HD3 LYS A 87 15.750 1.108 -7.675 1.00 0.00 H new ATOM 0 HE2 LYS A 87 15.840 2.686 -5.792 1.00 0.00 H new ATOM 0 HE3 LYS A 87 17.592 2.691 -5.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 16.705 4.582 -7.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 17.551 3.534 -8.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 15.853 3.530 -8.088 1.00 0.00 H new ATOM 1362 N ALA A 88 15.293 0.641 -2.760 1.00 0.00 N ATOM 1363 CA ALA A 88 15.576 1.640 -1.713 1.00 0.00 C ATOM 1364 C ALA A 88 15.952 0.886 -0.442 1.00 0.00 C ATOM 1365 O ALA A 88 16.759 1.333 0.347 1.00 0.00 O ATOM 1366 CB ALA A 88 14.270 2.418 -1.541 1.00 0.00 C ATOM 0 H ALA A 88 14.312 0.543 -3.020 1.00 0.00 H new ATOM 0 HA ALA A 88 16.394 2.319 -1.954 1.00 0.00 H new ATOM 0 HB1 ALA A 88 14.400 3.183 -0.776 1.00 0.00 H new ATOM 0 HB2 ALA A 88 14.002 2.892 -2.485 1.00 0.00 H new ATOM 0 HB3 ALA A 88 13.476 1.734 -1.239 1.00 0.00 H new ATOM 1372 N ALA A 89 15.378 -0.277 -0.251 1.00 0.00 N ATOM 1373 CA ALA A 89 15.697 -1.076 0.968 1.00 0.00 C ATOM 1374 C ALA A 89 17.087 -1.674 0.862 1.00 0.00 C ATOM 1375 O ALA A 89 17.922 -1.460 1.720 1.00 0.00 O ATOM 1376 CB ALA A 89 14.627 -2.164 1.040 1.00 0.00 C ATOM 0 H ALA A 89 14.704 -0.705 -0.886 1.00 0.00 H new ATOM 0 HA ALA A 89 15.695 -0.463 1.869 1.00 0.00 H new ATOM 0 HB1 ALA A 89 14.802 -2.789 1.915 1.00 0.00 H new ATOM 0 HB2 ALA A 89 13.643 -1.702 1.115 1.00 0.00 H new ATOM 0 HB3 ALA A 89 14.672 -2.778 0.141 1.00 0.00 H new ATOM 1382 N GLU A 90 17.367 -2.389 -0.191 1.00 0.00 N ATOM 1383 CA GLU A 90 18.739 -2.947 -0.340 1.00 0.00 C ATOM 1384 C GLU A 90 19.736 -1.791 -0.213 1.00 0.00 C ATOM 1385 O GLU A 90 20.899 -1.979 0.084 1.00 0.00 O ATOM 1386 CB GLU A 90 18.787 -3.566 -1.741 1.00 0.00 C ATOM 1387 CG GLU A 90 18.584 -2.481 -2.799 1.00 0.00 C ATOM 1388 CD GLU A 90 18.768 -3.087 -4.191 1.00 0.00 C ATOM 1389 OE1 GLU A 90 18.379 -4.229 -4.375 1.00 0.00 O ATOM 1390 OE2 GLU A 90 19.293 -2.399 -5.051 1.00 0.00 O ATOM 0 H GLU A 90 16.716 -2.609 -0.945 1.00 0.00 H new ATOM 0 HA GLU A 90 18.986 -3.695 0.414 1.00 0.00 H new ATOM 0 HB2 GLU A 90 19.745 -4.062 -1.896 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.014 -4.329 -1.837 1.00 0.00 H new ATOM 0 HG2 GLU A 90 17.587 -2.050 -2.707 1.00 0.00 H new ATOM 0 HG3 GLU A 90 19.297 -1.671 -2.646 1.00 0.00 H new ATOM 1397 N GLY A 91 19.267 -0.586 -0.444 1.00 0.00 N ATOM 1398 CA GLY A 91 20.150 0.597 -0.354 1.00 0.00 C ATOM 1399 C GLY A 91 20.297 1.109 1.091 1.00 0.00 C ATOM 1400 O GLY A 91 21.310 1.701 1.408 1.00 0.00 O ATOM 0 H GLY A 91 18.299 -0.381 -0.693 1.00 0.00 H new ATOM 0 HA2 GLY A 91 21.134 0.344 -0.749 1.00 0.00 H new ATOM 0 HA3 GLY A 91 19.750 1.394 -0.981 1.00 0.00 H new ATOM 1404 N LEU A 92 19.327 0.944 1.988 1.00 0.00 N ATOM 1405 CA LEU A 92 19.559 1.515 3.355 1.00 0.00 C ATOM 1406 C LEU A 92 20.056 0.453 4.338 1.00 0.00 C ATOM 1407 O LEU A 92 21.214 0.445 4.711 1.00 0.00 O ATOM 1408 CB LEU A 92 18.222 2.102 3.818 1.00 0.00 C ATOM 1409 CG LEU A 92 17.498 2.817 2.663 1.00 0.00 C ATOM 1410 CD1 LEU A 92 16.528 3.849 3.239 1.00 0.00 C ATOM 1411 CD2 LEU A 92 18.498 3.544 1.752 1.00 0.00 C ATOM 0 H LEU A 92 18.439 0.466 1.837 1.00 0.00 H new ATOM 0 HA LEU A 92 20.335 2.279 3.318 1.00 0.00 H new ATOM 0 HB2 LEU A 92 17.589 1.306 4.210 1.00 0.00 H new ATOM 0 HB3 LEU A 92 18.393 2.804 4.634 1.00 0.00 H new ATOM 0 HG LEU A 92 16.964 2.068 2.078 1.00 0.00 H new ATOM 0 HD11 LEU A 92 16.013 4.358 2.425 1.00 0.00 H new ATOM 0 HD12 LEU A 92 15.797 3.347 3.873 1.00 0.00 H new ATOM 0 HD13 LEU A 92 17.082 4.578 3.830 1.00 0.00 H new ATOM 0 HD21 LEU A 92 17.960 4.041 0.944 1.00 0.00 H new ATOM 0 HD22 LEU A 92 19.046 4.286 2.333 1.00 0.00 H new ATOM 0 HD23 LEU A 92 19.198 2.822 1.331 1.00 0.00 H new ATOM 1423 N LYS A 93 19.201 -0.423 4.779 1.00 0.00 N ATOM 1424 CA LYS A 93 19.654 -1.456 5.759 1.00 0.00 C ATOM 1425 C LYS A 93 18.908 -2.775 5.563 1.00 0.00 C ATOM 1426 O LYS A 93 18.521 -3.424 6.516 1.00 0.00 O ATOM 1427 CB LYS A 93 19.336 -0.861 7.132 1.00 0.00 C ATOM 1428 CG LYS A 93 20.599 -0.228 7.724 1.00 0.00 C ATOM 1429 CD LYS A 93 20.543 1.291 7.546 1.00 0.00 C ATOM 1430 CE LYS A 93 21.198 1.972 8.749 1.00 0.00 C ATOM 1431 NZ LYS A 93 21.335 3.401 8.354 1.00 0.00 N ATOM 0 H LYS A 93 18.218 -0.473 4.510 1.00 0.00 H new ATOM 0 HA LYS A 93 20.713 -1.686 5.639 1.00 0.00 H new ATOM 0 HB2 LYS A 93 18.550 -0.111 7.041 1.00 0.00 H new ATOM 0 HB3 LYS A 93 18.960 -1.638 7.798 1.00 0.00 H new ATOM 0 HG2 LYS A 93 20.682 -0.478 8.782 1.00 0.00 H new ATOM 0 HG3 LYS A 93 21.485 -0.630 7.232 1.00 0.00 H new ATOM 0 HD2 LYS A 93 21.056 1.579 6.628 1.00 0.00 H new ATOM 0 HD3 LYS A 93 19.508 1.618 7.449 1.00 0.00 H new ATOM 0 HE2 LYS A 93 20.585 1.867 9.644 1.00 0.00 H new ATOM 0 HE3 LYS A 93 22.169 1.529 8.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 21.777 3.935 9.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 21.929 3.471 7.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 20.395 3.797 8.153 1.00 0.00 H new ATOM 1445 N TYR A 94 18.723 -3.190 4.342 1.00 0.00 N ATOM 1446 CA TYR A 94 18.023 -4.484 4.102 1.00 0.00 C ATOM 1447 C TYR A 94 18.826 -5.611 4.763 1.00 0.00 C ATOM 1448 O TYR A 94 18.294 -6.433 5.486 1.00 0.00 O ATOM 1449 CB TYR A 94 17.973 -4.629 2.569 1.00 0.00 C ATOM 1450 CG TYR A 94 18.493 -5.983 2.140 1.00 0.00 C ATOM 1451 CD1 TYR A 94 17.833 -7.149 2.546 1.00 0.00 C ATOM 1452 CD2 TYR A 94 19.642 -6.068 1.346 1.00 0.00 C ATOM 1453 CE1 TYR A 94 18.324 -8.402 2.159 1.00 0.00 C ATOM 1454 CE2 TYR A 94 20.132 -7.321 0.957 1.00 0.00 C ATOM 1455 CZ TYR A 94 19.474 -8.488 1.365 1.00 0.00 C ATOM 1456 OH TYR A 94 19.960 -9.722 0.984 1.00 0.00 O ATOM 0 H TYR A 94 19.024 -2.693 3.503 1.00 0.00 H new ATOM 0 HA TYR A 94 17.019 -4.525 4.523 1.00 0.00 H new ATOM 0 HB2 TYR A 94 16.948 -4.501 2.220 1.00 0.00 H new ATOM 0 HB3 TYR A 94 18.568 -3.842 2.105 1.00 0.00 H new ATOM 0 HD1 TYR A 94 16.945 -7.082 3.158 1.00 0.00 H new ATOM 0 HD2 TYR A 94 20.151 -5.168 1.033 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.816 -9.302 2.473 1.00 0.00 H new ATOM 0 HE2 TYR A 94 21.017 -7.387 0.342 1.00 0.00 H new ATOM 0 HH TYR A 94 20.763 -9.602 0.435 1.00 0.00 H new ATOM 1466 N GLU A 95 20.108 -5.638 4.527 1.00 0.00 N ATOM 1467 CA GLU A 95 20.961 -6.692 5.144 1.00 0.00 C ATOM 1468 C GLU A 95 20.988 -6.497 6.659 1.00 0.00 C ATOM 1469 O GLU A 95 20.990 -7.445 7.419 1.00 0.00 O ATOM 1470 CB GLU A 95 22.355 -6.497 4.542 1.00 0.00 C ATOM 1471 CG GLU A 95 22.902 -5.118 4.924 1.00 0.00 C ATOM 1472 CD GLU A 95 24.060 -4.752 3.992 1.00 0.00 C ATOM 1473 OE1 GLU A 95 24.866 -5.623 3.714 1.00 0.00 O ATOM 1474 OE2 GLU A 95 24.118 -3.607 3.575 1.00 0.00 O ATOM 0 H GLU A 95 20.603 -4.974 3.932 1.00 0.00 H new ATOM 0 HA GLU A 95 20.589 -7.698 4.951 1.00 0.00 H new ATOM 0 HB2 GLU A 95 23.027 -7.276 4.901 1.00 0.00 H new ATOM 0 HB3 GLU A 95 22.308 -6.591 3.457 1.00 0.00 H new ATOM 0 HG2 GLU A 95 22.113 -4.369 4.852 1.00 0.00 H new ATOM 0 HG3 GLU A 95 23.242 -5.124 5.959 1.00 0.00 H new ATOM 1547 N MET B 1 -6.340 7.029 -10.595 1.00 0.00 N ATOM 1548 CA MET B 1 -5.559 8.199 -10.097 1.00 0.00 C ATOM 1549 C MET B 1 -4.057 7.922 -10.215 1.00 0.00 C ATOM 1550 O MET B 1 -3.631 7.089 -10.990 1.00 0.00 O ATOM 1551 CB MET B 1 -5.974 8.363 -8.633 1.00 0.00 C ATOM 1552 CG MET B 1 -6.860 9.602 -8.489 1.00 0.00 C ATOM 1553 SD MET B 1 -8.140 9.294 -7.246 1.00 0.00 S ATOM 1554 CE MET B 1 -7.037 9.156 -5.819 1.00 0.00 C ATOM 0 H1 MET B 1 -6.888 7.309 -11.434 1.00 0.00 H new ATOM 0 H2 MET B 1 -5.688 6.259 -10.848 1.00 0.00 H new ATOM 0 H3 MET B 1 -6.989 6.703 -9.851 1.00 0.00 H new ATOM 0 HA MET B 1 -5.755 9.104 -10.673 1.00 0.00 H new ATOM 0 HB2 MET B 1 -6.512 7.477 -8.295 1.00 0.00 H new ATOM 0 HB3 MET B 1 -5.090 8.459 -8.002 1.00 0.00 H new ATOM 0 HG2 MET B 1 -6.256 10.461 -8.198 1.00 0.00 H new ATOM 0 HG3 MET B 1 -7.320 9.845 -9.447 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.570 9.456 -4.917 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.702 8.124 -5.716 1.00 0.00 H new ATOM 0 HE3 MET B 1 -6.173 9.805 -5.963 1.00 0.00 H new ATOM 1566 N ASN B 2 -3.253 8.623 -9.459 1.00 0.00 N ATOM 1567 CA ASN B 2 -1.776 8.419 -9.527 1.00 0.00 C ATOM 1568 C ASN B 2 -1.075 9.388 -8.578 1.00 0.00 C ATOM 1569 O ASN B 2 -1.708 10.209 -7.946 1.00 0.00 O ATOM 1570 CB ASN B 2 -1.391 8.729 -10.980 1.00 0.00 C ATOM 1571 CG ASN B 2 -0.806 7.480 -11.644 1.00 0.00 C ATOM 1572 OD1 ASN B 2 0.345 7.151 -11.439 1.00 0.00 O ATOM 1573 ND2 ASN B 2 -1.554 6.769 -12.443 1.00 0.00 N ATOM 0 H ASN B 2 -3.559 9.333 -8.793 1.00 0.00 H new ATOM 0 HA ASN B 2 -1.486 7.409 -9.237 1.00 0.00 H new ATOM 0 HB2 ASN B 2 -2.267 9.068 -11.533 1.00 0.00 H new ATOM 0 HB3 ASN B 2 -0.663 9.540 -11.007 1.00 0.00 H new ATOM 0 HD21 ASN B 2 -1.172 5.938 -12.894 1.00 0.00 H new ATOM 0 HD22 ASN B 2 -2.521 7.044 -12.616 1.00 0.00 H new ATOM 1580 N LYS B 3 0.229 9.315 -8.490 1.00 0.00 N ATOM 1581 CA LYS B 3 0.966 10.257 -7.594 1.00 0.00 C ATOM 1582 C LYS B 3 0.526 11.694 -7.910 1.00 0.00 C ATOM 1583 O LYS B 3 0.604 12.578 -7.081 1.00 0.00 O ATOM 1584 CB LYS B 3 2.450 10.051 -7.918 1.00 0.00 C ATOM 1585 CG LYS B 3 3.024 8.924 -7.044 1.00 0.00 C ATOM 1586 CD LYS B 3 4.480 9.255 -6.658 1.00 0.00 C ATOM 1587 CE LYS B 3 4.681 9.216 -5.126 1.00 0.00 C ATOM 1588 NZ LYS B 3 3.448 9.815 -4.524 1.00 0.00 N ATOM 0 H LYS B 3 0.812 8.648 -8.996 1.00 0.00 H new ATOM 0 HA LYS B 3 0.770 10.079 -6.537 1.00 0.00 H new ATOM 0 HB2 LYS B 3 2.570 9.802 -8.972 1.00 0.00 H new ATOM 0 HB3 LYS B 3 3.001 10.975 -7.744 1.00 0.00 H new ATOM 0 HG2 LYS B 3 2.418 8.803 -6.146 1.00 0.00 H new ATOM 0 HG3 LYS B 3 2.987 7.978 -7.584 1.00 0.00 H new ATOM 0 HD2 LYS B 3 5.155 8.543 -7.133 1.00 0.00 H new ATOM 0 HD3 LYS B 3 4.742 10.243 -7.036 1.00 0.00 H new ATOM 0 HE2 LYS B 3 4.825 8.193 -4.779 1.00 0.00 H new ATOM 0 HE3 LYS B 3 5.568 9.779 -4.836 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 3.713 10.611 -3.909 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 2.822 10.156 -5.281 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 2.951 9.095 -3.962 1.00 0.00 H new ATOM 1602 N THR B 4 0.038 11.917 -9.107 1.00 0.00 N ATOM 1603 CA THR B 4 -0.440 13.278 -9.496 1.00 0.00 C ATOM 1604 C THR B 4 -1.924 13.414 -9.157 1.00 0.00 C ATOM 1605 O THR B 4 -2.342 14.330 -8.471 1.00 0.00 O ATOM 1606 CB THR B 4 -0.236 13.350 -11.011 1.00 0.00 C ATOM 1607 OG1 THR B 4 1.154 13.352 -11.301 1.00 0.00 O ATOM 1608 CG2 THR B 4 -0.880 14.626 -11.561 1.00 0.00 C ATOM 0 H THR B 4 -0.049 11.208 -9.835 1.00 0.00 H new ATOM 0 HA THR B 4 0.092 14.074 -8.975 1.00 0.00 H new ATOM 0 HB THR B 4 -0.703 12.484 -11.480 1.00 0.00 H new ATOM 0 HG1 THR B 4 1.286 13.396 -12.271 1.00 0.00 H new ATOM 0 HG21 THR B 4 -0.732 14.672 -12.640 1.00 0.00 H new ATOM 0 HG22 THR B 4 -1.948 14.619 -11.341 1.00 0.00 H new ATOM 0 HG23 THR B 4 -0.419 15.496 -11.094 1.00 0.00 H new ATOM 1616 N GLU B 5 -2.725 12.501 -9.630 1.00 0.00 N ATOM 1617 CA GLU B 5 -4.178 12.577 -9.325 1.00 0.00 C ATOM 1618 C GLU B 5 -4.356 12.533 -7.810 1.00 0.00 C ATOM 1619 O GLU B 5 -5.025 13.368 -7.234 1.00 0.00 O ATOM 1620 CB GLU B 5 -4.823 11.367 -10.005 1.00 0.00 C ATOM 1621 CG GLU B 5 -4.486 11.362 -11.501 1.00 0.00 C ATOM 1622 CD GLU B 5 -5.050 12.621 -12.163 1.00 0.00 C ATOM 1623 OE1 GLU B 5 -4.363 13.630 -12.154 1.00 0.00 O ATOM 1624 OE2 GLU B 5 -6.160 12.557 -12.666 1.00 0.00 O ATOM 0 H GLU B 5 -2.439 11.712 -10.210 1.00 0.00 H new ATOM 0 HA GLU B 5 -4.641 13.495 -9.687 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -4.468 10.447 -9.541 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -5.904 11.396 -9.868 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -3.406 11.320 -11.640 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -4.903 10.473 -11.974 1.00 0.00 H new ATOM 1631 N LEU B 6 -3.728 11.590 -7.149 1.00 0.00 N ATOM 1632 CA LEU B 6 -3.838 11.546 -5.659 1.00 0.00 C ATOM 1633 C LEU B 6 -3.422 12.911 -5.100 1.00 0.00 C ATOM 1634 O LEU B 6 -4.014 13.429 -4.161 1.00 0.00 O ATOM 1635 CB LEU B 6 -2.876 10.449 -5.203 1.00 0.00 C ATOM 1636 CG LEU B 6 -3.532 9.081 -5.401 1.00 0.00 C ATOM 1637 CD1 LEU B 6 -2.452 7.999 -5.472 1.00 0.00 C ATOM 1638 CD2 LEU B 6 -4.466 8.790 -4.223 1.00 0.00 C ATOM 0 H LEU B 6 -3.153 10.860 -7.570 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.850 11.336 -5.312 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -1.948 10.505 -5.772 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -2.616 10.591 -4.154 1.00 0.00 H new ATOM 0 HG LEU B 6 -4.103 9.084 -6.329 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -2.921 7.025 -5.613 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -1.785 8.205 -6.309 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.880 7.995 -4.544 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.934 7.816 -4.362 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.893 8.788 -3.296 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -5.237 9.559 -4.171 1.00 0.00 H new ATOM 1650 N ILE B 7 -2.432 13.526 -5.706 1.00 0.00 N ATOM 1651 CA ILE B 7 -2.009 14.880 -5.251 1.00 0.00 C ATOM 1652 C ILE B 7 -3.261 15.755 -5.201 1.00 0.00 C ATOM 1653 O ILE B 7 -3.565 16.373 -4.204 1.00 0.00 O ATOM 1654 CB ILE B 7 -1.000 15.373 -6.316 1.00 0.00 C ATOM 1655 CG1 ILE B 7 0.344 15.680 -5.656 1.00 0.00 C ATOM 1656 CG2 ILE B 7 -1.507 16.647 -7.003 1.00 0.00 C ATOM 1657 CD1 ILE B 7 1.260 16.382 -6.669 1.00 0.00 C ATOM 0 H ILE B 7 -1.904 13.147 -6.492 1.00 0.00 H new ATOM 0 HA ILE B 7 -1.546 14.898 -4.265 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.886 14.584 -7.059 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.196 16.314 -4.782 1.00 0.00 H new ATOM 0 HG13 ILE B 7 0.809 14.758 -5.306 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -0.780 16.973 -7.747 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -2.460 16.442 -7.492 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -1.642 17.432 -6.259 1.00 0.00 H new ATOM 0 HD11 ILE B 7 2.219 16.602 -6.201 1.00 0.00 H new ATOM 0 HD12 ILE B 7 1.417 15.731 -7.529 1.00 0.00 H new ATOM 0 HD13 ILE B 7 0.795 17.312 -6.997 1.00 0.00 H new ATOM 1669 N LYS B 8 -4.000 15.767 -6.277 1.00 0.00 N ATOM 1670 CA LYS B 8 -5.255 16.559 -6.321 1.00 0.00 C ATOM 1671 C LYS B 8 -6.244 15.980 -5.312 1.00 0.00 C ATOM 1672 O LYS B 8 -7.059 16.688 -4.756 1.00 0.00 O ATOM 1673 CB LYS B 8 -5.769 16.429 -7.767 1.00 0.00 C ATOM 1674 CG LYS B 8 -7.038 15.567 -7.816 1.00 0.00 C ATOM 1675 CD LYS B 8 -7.412 15.286 -9.274 1.00 0.00 C ATOM 1676 CE LYS B 8 -7.023 13.849 -9.636 1.00 0.00 C ATOM 1677 NZ LYS B 8 -8.298 13.194 -10.043 1.00 0.00 N ATOM 0 H LYS B 8 -3.783 15.256 -7.133 1.00 0.00 H new ATOM 0 HA LYS B 8 -5.112 17.608 -6.060 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -5.979 17.418 -8.174 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -4.997 15.984 -8.394 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -6.874 14.629 -7.285 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -7.858 16.079 -7.312 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -8.482 15.432 -9.420 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -6.902 15.989 -9.933 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -6.294 13.830 -10.446 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -6.570 13.337 -8.787 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -8.112 12.205 -10.306 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -8.971 13.221 -9.250 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -8.703 13.698 -10.858 1.00 0.00 H new ATOM 1691 N ALA B 9 -6.168 14.697 -5.054 1.00 0.00 N ATOM 1692 CA ALA B 9 -7.096 14.092 -4.060 1.00 0.00 C ATOM 1693 C ALA B 9 -6.994 14.876 -2.759 1.00 0.00 C ATOM 1694 O ALA B 9 -7.977 15.132 -2.096 1.00 0.00 O ATOM 1695 CB ALA B 9 -6.604 12.665 -3.863 1.00 0.00 C ATOM 0 H ALA B 9 -5.508 14.051 -5.487 1.00 0.00 H new ATOM 0 HA ALA B 9 -8.136 14.108 -4.384 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -7.243 12.156 -3.141 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -6.638 12.134 -4.814 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -5.579 12.681 -3.493 1.00 0.00 H new ATOM 1701 N ILE B 10 -5.804 15.294 -2.411 1.00 0.00 N ATOM 1702 CA ILE B 10 -5.639 16.098 -1.182 1.00 0.00 C ATOM 1703 C ILE B 10 -5.605 17.562 -1.601 1.00 0.00 C ATOM 1704 O ILE B 10 -6.092 18.434 -0.921 1.00 0.00 O ATOM 1705 CB ILE B 10 -4.294 15.634 -0.581 1.00 0.00 C ATOM 1706 CG1 ILE B 10 -4.542 14.777 0.662 1.00 0.00 C ATOM 1707 CG2 ILE B 10 -3.427 16.838 -0.191 1.00 0.00 C ATOM 1708 CD1 ILE B 10 -5.336 13.528 0.278 1.00 0.00 C ATOM 0 H ILE B 10 -4.945 15.109 -2.930 1.00 0.00 H new ATOM 0 HA ILE B 10 -6.437 15.979 -0.449 1.00 0.00 H new ATOM 0 HB ILE B 10 -3.772 15.048 -1.337 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -3.592 14.491 1.114 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -5.089 15.352 1.409 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -2.485 16.487 0.230 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -3.226 17.443 -1.075 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -3.953 17.441 0.550 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -5.510 12.920 1.166 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -6.293 13.823 -0.153 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -4.772 12.949 -0.453 1.00 0.00 H new ATOM 1720 N ALA B 11 -5.062 17.838 -2.743 1.00 0.00 N ATOM 1721 CA ALA B 11 -5.039 19.248 -3.194 1.00 0.00 C ATOM 1722 C ALA B 11 -6.475 19.717 -3.456 1.00 0.00 C ATOM 1723 O ALA B 11 -6.738 20.894 -3.606 1.00 0.00 O ATOM 1724 CB ALA B 11 -4.211 19.244 -4.477 1.00 0.00 C ATOM 0 H ALA B 11 -4.638 17.161 -3.377 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.611 19.926 -2.456 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -4.148 20.258 -4.873 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -3.208 18.876 -4.262 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -4.685 18.595 -5.214 1.00 0.00 H new ATOM 1730 N GLN B 12 -7.411 18.798 -3.495 1.00 0.00 N ATOM 1731 CA GLN B 12 -8.829 19.183 -3.726 1.00 0.00 C ATOM 1732 C GLN B 12 -9.647 18.896 -2.469 1.00 0.00 C ATOM 1733 O GLN B 12 -10.450 19.707 -2.051 1.00 0.00 O ATOM 1734 CB GLN B 12 -9.307 18.325 -4.898 1.00 0.00 C ATOM 1735 CG GLN B 12 -8.444 18.610 -6.129 1.00 0.00 C ATOM 1736 CD GLN B 12 -8.809 19.982 -6.701 1.00 0.00 C ATOM 1737 OE1 GLN B 12 -7.978 20.866 -6.765 1.00 0.00 O ATOM 1738 NE2 GLN B 12 -10.024 20.197 -7.123 1.00 0.00 N ATOM 0 H GLN B 12 -7.248 17.798 -3.376 1.00 0.00 H new ATOM 0 HA GLN B 12 -8.940 20.244 -3.949 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -9.247 17.269 -4.636 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -10.353 18.541 -5.117 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -7.388 18.586 -5.860 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -8.599 17.837 -6.882 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -10.721 19.455 -7.069 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -10.277 21.108 -7.507 1.00 0.00 H new ATOM 1747 N ASP B 13 -9.419 17.778 -1.825 1.00 0.00 N ATOM 1748 CA ASP B 13 -10.161 17.510 -0.561 1.00 0.00 C ATOM 1749 C ASP B 13 -9.599 18.475 0.468 1.00 0.00 C ATOM 1750 O ASP B 13 -10.277 18.958 1.354 1.00 0.00 O ATOM 1751 CB ASP B 13 -9.841 16.067 -0.188 1.00 0.00 C ATOM 1752 CG ASP B 13 -10.542 15.118 -1.161 1.00 0.00 C ATOM 1753 OD1 ASP B 13 -10.505 15.387 -2.350 1.00 0.00 O ATOM 1754 OD2 ASP B 13 -11.106 14.140 -0.701 1.00 0.00 O ATOM 0 H ASP B 13 -8.763 17.053 -2.115 1.00 0.00 H new ATOM 0 HA ASP B 13 -11.241 17.641 -0.635 1.00 0.00 H new ATOM 0 HB2 ASP B 13 -8.764 15.904 -0.217 1.00 0.00 H new ATOM 0 HB3 ASP B 13 -10.167 15.864 0.832 1.00 0.00 H new ATOM 1759 N THR B 14 -8.346 18.779 0.297 1.00 0.00 N ATOM 1760 CA THR B 14 -7.651 19.738 1.172 1.00 0.00 C ATOM 1761 C THR B 14 -7.466 21.022 0.345 1.00 0.00 C ATOM 1762 O THR B 14 -8.282 21.921 0.398 1.00 0.00 O ATOM 1763 CB THR B 14 -6.319 19.038 1.497 1.00 0.00 C ATOM 1764 OG1 THR B 14 -6.331 17.719 0.965 1.00 0.00 O ATOM 1765 CG2 THR B 14 -6.135 18.931 2.996 1.00 0.00 C ATOM 0 H THR B 14 -7.762 18.385 -0.440 1.00 0.00 H new ATOM 0 HA THR B 14 -8.165 20.010 2.094 1.00 0.00 H new ATOM 0 HB THR B 14 -5.509 19.623 1.061 1.00 0.00 H new ATOM 0 HG1 THR B 14 -6.538 17.080 1.679 1.00 0.00 H new ATOM 0 HG21 THR B 14 -5.189 18.434 3.212 1.00 0.00 H new ATOM 0 HG22 THR B 14 -6.129 19.929 3.434 1.00 0.00 H new ATOM 0 HG23 THR B 14 -6.954 18.353 3.423 1.00 0.00 H new ATOM 1773 N GLY B 15 -6.432 21.094 -0.458 1.00 0.00 N ATOM 1774 CA GLY B 15 -6.228 22.292 -1.337 1.00 0.00 C ATOM 1775 C GLY B 15 -5.787 23.504 -0.523 1.00 0.00 C ATOM 1776 O GLY B 15 -5.249 24.450 -1.062 1.00 0.00 O ATOM 0 H GLY B 15 -5.717 20.372 -0.544 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -5.478 22.067 -2.095 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -7.154 22.522 -1.864 1.00 0.00 H new ATOM 1780 N LEU B 16 -6.020 23.482 0.759 1.00 0.00 N ATOM 1781 CA LEU B 16 -5.627 24.635 1.650 1.00 0.00 C ATOM 1782 C LEU B 16 -4.582 25.518 0.992 1.00 0.00 C ATOM 1783 O LEU B 16 -4.787 26.692 0.755 1.00 0.00 O ATOM 1784 CB LEU B 16 -5.007 23.993 2.886 1.00 0.00 C ATOM 1785 CG LEU B 16 -6.047 23.140 3.590 1.00 0.00 C ATOM 1786 CD1 LEU B 16 -5.914 21.696 3.124 1.00 0.00 C ATOM 1787 CD2 LEU B 16 -5.822 23.213 5.103 1.00 0.00 C ATOM 0 H LEU B 16 -6.472 22.707 1.244 1.00 0.00 H new ATOM 0 HA LEU B 16 -6.492 25.260 1.871 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -4.152 23.380 2.600 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -4.636 24.764 3.562 1.00 0.00 H new ATOM 0 HG LEU B 16 -7.045 23.508 3.353 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -6.660 21.081 3.628 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -6.070 21.646 2.046 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -4.917 21.327 3.364 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -6.567 22.601 5.612 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -4.825 22.842 5.341 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -5.913 24.247 5.435 1.00 0.00 H new ATOM 1799 N THR B 17 -3.459 24.944 0.712 1.00 0.00 N ATOM 1800 CA THR B 17 -2.366 25.707 0.082 1.00 0.00 C ATOM 1801 C THR B 17 -1.640 24.821 -0.926 1.00 0.00 C ATOM 1802 O THR B 17 -0.584 25.167 -1.419 1.00 0.00 O ATOM 1803 CB THR B 17 -1.447 26.065 1.264 1.00 0.00 C ATOM 1804 OG1 THR B 17 -1.034 27.419 1.152 1.00 0.00 O ATOM 1805 CG2 THR B 17 -0.217 25.152 1.289 1.00 0.00 C ATOM 0 H THR B 17 -3.249 23.963 0.896 1.00 0.00 H new ATOM 0 HA THR B 17 -2.704 26.589 -0.462 1.00 0.00 H new ATOM 0 HB THR B 17 -2.002 25.925 2.192 1.00 0.00 H new ATOM 0 HG1 THR B 17 -0.450 27.646 1.906 1.00 0.00 H new ATOM 0 HG21 THR B 17 0.419 25.422 2.132 1.00 0.00 H new ATOM 0 HG22 THR B 17 -0.536 24.115 1.392 1.00 0.00 H new ATOM 0 HG23 THR B 17 0.342 25.269 0.361 1.00 0.00 H new ATOM 1813 N GLN B 18 -2.156 23.645 -1.184 1.00 0.00 N ATOM 1814 CA GLN B 18 -1.432 22.714 -2.086 1.00 0.00 C ATOM 1815 C GLN B 18 -0.077 22.455 -1.431 1.00 0.00 C ATOM 1816 O GLN B 18 0.889 22.098 -2.075 1.00 0.00 O ATOM 1817 CB GLN B 18 -1.276 23.432 -3.434 1.00 0.00 C ATOM 1818 CG GLN B 18 -2.597 24.104 -3.816 1.00 0.00 C ATOM 1819 CD GLN B 18 -2.589 24.445 -5.308 1.00 0.00 C ATOM 1820 OE1 GLN B 18 -1.540 24.582 -5.905 1.00 0.00 O ATOM 1821 NE2 GLN B 18 -3.722 24.590 -5.937 1.00 0.00 N ATOM 0 H GLN B 18 -3.039 23.297 -0.811 1.00 0.00 H new ATOM 0 HA GLN B 18 -1.946 21.766 -2.248 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -0.483 24.177 -3.371 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -0.983 22.719 -4.205 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -3.432 23.442 -3.589 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -2.739 25.010 -3.227 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -4.602 24.475 -5.435 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -3.728 24.819 -6.931 1.00 0.00 H new ATOM 1830 N VAL B 19 -0.037 22.659 -0.124 1.00 0.00 N ATOM 1831 CA VAL B 19 1.205 22.471 0.692 1.00 0.00 C ATOM 1832 C VAL B 19 2.396 22.147 -0.197 1.00 0.00 C ATOM 1833 O VAL B 19 3.082 23.021 -0.689 1.00 0.00 O ATOM 1834 CB VAL B 19 0.852 21.329 1.686 1.00 0.00 C ATOM 1835 CG1 VAL B 19 0.074 20.209 0.984 1.00 0.00 C ATOM 1836 CG2 VAL B 19 2.101 20.718 2.344 1.00 0.00 C ATOM 0 H VAL B 19 -0.846 22.958 0.421 1.00 0.00 H new ATOM 0 HA VAL B 19 1.504 23.371 1.228 1.00 0.00 H new ATOM 0 HB VAL B 19 0.236 21.784 2.461 1.00 0.00 H new ATOM 0 HG11 VAL B 19 -0.160 19.423 1.702 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -0.851 20.612 0.572 1.00 0.00 H new ATOM 0 HG13 VAL B 19 0.680 19.795 0.178 1.00 0.00 H new ATOM 0 HG21 VAL B 19 1.800 19.925 3.029 1.00 0.00 H new ATOM 0 HG22 VAL B 19 2.752 20.305 1.574 1.00 0.00 H new ATOM 0 HG23 VAL B 19 2.636 21.491 2.896 1.00 0.00 H new ATOM 1846 N SER B 20 2.623 20.909 -0.411 1.00 0.00 N ATOM 1847 CA SER B 20 3.716 20.459 -1.253 1.00 0.00 C ATOM 1848 C SER B 20 3.133 19.431 -2.185 1.00 0.00 C ATOM 1849 O SER B 20 3.827 18.554 -2.631 1.00 0.00 O ATOM 1850 CB SER B 20 4.728 19.841 -0.295 1.00 0.00 C ATOM 1851 OG SER B 20 5.886 20.661 -0.238 1.00 0.00 O ATOM 0 H SER B 20 2.064 20.154 -0.014 1.00 0.00 H new ATOM 0 HA SER B 20 4.194 21.240 -1.844 1.00 0.00 H new ATOM 0 HB2 SER B 20 4.291 19.741 0.698 1.00 0.00 H new ATOM 0 HB3 SER B 20 4.995 18.838 -0.628 1.00 0.00 H new ATOM 0 HG SER B 20 6.611 20.173 0.206 1.00 0.00 H new ATOM 1857 N VAL B 21 1.840 19.491 -2.439 1.00 0.00 N ATOM 1858 CA VAL B 21 1.191 18.479 -3.317 1.00 0.00 C ATOM 1859 C VAL B 21 2.248 17.866 -4.209 1.00 0.00 C ATOM 1860 O VAL B 21 2.366 16.663 -4.353 1.00 0.00 O ATOM 1861 CB VAL B 21 0.149 19.252 -4.137 1.00 0.00 C ATOM 1862 CG1 VAL B 21 -0.986 19.712 -3.221 1.00 0.00 C ATOM 1863 CG2 VAL B 21 0.790 20.476 -4.801 1.00 0.00 C ATOM 0 H VAL B 21 1.212 20.205 -2.069 1.00 0.00 H new ATOM 0 HA VAL B 21 0.717 17.670 -2.762 1.00 0.00 H new ATOM 0 HB VAL B 21 -0.244 18.593 -4.911 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -1.725 20.261 -3.805 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -1.458 18.843 -2.762 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -0.585 20.360 -2.442 1.00 0.00 H new ATOM 0 HG21 VAL B 21 0.037 21.013 -5.378 1.00 0.00 H new ATOM 0 HG22 VAL B 21 1.197 21.135 -4.034 1.00 0.00 H new ATOM 0 HG23 VAL B 21 1.593 20.152 -5.464 1.00 0.00 H new ATOM 1873 N SER B 22 3.076 18.711 -4.725 1.00 0.00 N ATOM 1874 CA SER B 22 4.200 18.235 -5.579 1.00 0.00 C ATOM 1875 C SER B 22 5.281 17.612 -4.702 1.00 0.00 C ATOM 1876 O SER B 22 5.881 16.613 -5.050 1.00 0.00 O ATOM 1877 CB SER B 22 4.726 19.484 -6.285 1.00 0.00 C ATOM 1878 OG SER B 22 5.975 19.189 -6.894 1.00 0.00 O ATOM 0 H SER B 22 3.029 19.722 -4.596 1.00 0.00 H new ATOM 0 HA SER B 22 3.888 17.475 -6.295 1.00 0.00 H new ATOM 0 HB2 SER B 22 4.012 19.818 -7.037 1.00 0.00 H new ATOM 0 HB3 SER B 22 4.841 20.299 -5.570 1.00 0.00 H new ATOM 0 HG SER B 22 6.314 19.988 -7.349 1.00 0.00 H new ATOM 1884 N LYS B 23 5.531 18.197 -3.565 1.00 0.00 N ATOM 1885 CA LYS B 23 6.561 17.654 -2.658 1.00 0.00 C ATOM 1886 C LYS B 23 5.993 16.568 -1.737 1.00 0.00 C ATOM 1887 O LYS B 23 6.646 15.567 -1.523 1.00 0.00 O ATOM 1888 CB LYS B 23 7.053 18.862 -1.873 1.00 0.00 C ATOM 1889 CG LYS B 23 8.353 19.375 -2.491 1.00 0.00 C ATOM 1890 CD LYS B 23 8.127 20.762 -3.102 1.00 0.00 C ATOM 1891 CE LYS B 23 7.617 21.722 -2.025 1.00 0.00 C ATOM 1892 NZ LYS B 23 8.355 22.995 -2.263 1.00 0.00 N ATOM 0 H LYS B 23 5.058 19.035 -3.228 1.00 0.00 H new ATOM 0 HA LYS B 23 7.368 17.163 -3.202 1.00 0.00 H new ATOM 0 HB2 LYS B 23 6.298 19.648 -1.883 1.00 0.00 H new ATOM 0 HB3 LYS B 23 7.216 18.590 -0.830 1.00 0.00 H new ATOM 0 HG2 LYS B 23 9.132 19.425 -1.731 1.00 0.00 H new ATOM 0 HG3 LYS B 23 8.700 18.682 -3.258 1.00 0.00 H new ATOM 0 HD2 LYS B 23 9.057 21.139 -3.528 1.00 0.00 H new ATOM 0 HD3 LYS B 23 7.406 20.698 -3.917 1.00 0.00 H new ATOM 0 HE2 LYS B 23 6.540 21.869 -2.105 1.00 0.00 H new ATOM 0 HE3 LYS B 23 7.812 21.334 -1.025 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 8.059 23.704 -1.562 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 9.377 22.826 -2.173 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 8.145 23.345 -3.220 1.00 0.00 H new ATOM 1906 N MET B 24 4.800 16.707 -1.189 1.00 0.00 N ATOM 1907 CA MET B 24 4.316 15.596 -0.316 1.00 0.00 C ATOM 1908 C MET B 24 4.205 14.322 -1.155 1.00 0.00 C ATOM 1909 O MET B 24 4.367 13.233 -0.645 1.00 0.00 O ATOM 1910 CB MET B 24 2.953 15.962 0.318 1.00 0.00 C ATOM 1911 CG MET B 24 2.271 17.146 -0.363 1.00 0.00 C ATOM 1912 SD MET B 24 0.537 16.733 -0.601 1.00 0.00 S ATOM 1913 CE MET B 24 0.861 15.663 -2.017 1.00 0.00 C ATOM 0 H MET B 24 4.173 17.503 -1.304 1.00 0.00 H new ATOM 0 HA MET B 24 5.023 15.430 0.497 1.00 0.00 H new ATOM 0 HB2 MET B 24 2.294 15.095 0.271 1.00 0.00 H new ATOM 0 HB3 MET B 24 3.101 16.194 1.373 1.00 0.00 H new ATOM 0 HG2 MET B 24 2.368 18.044 0.248 1.00 0.00 H new ATOM 0 HG3 MET B 24 2.746 17.359 -1.321 1.00 0.00 H new ATOM 0 HE1 MET B 24 0.099 15.827 -2.779 1.00 0.00 H new ATOM 0 HE2 MET B 24 1.843 15.894 -2.430 1.00 0.00 H new ATOM 0 HE3 MET B 24 0.837 14.621 -1.699 1.00 0.00 H new ATOM 1923 N LEU B 25 3.966 14.434 -2.448 1.00 0.00 N ATOM 1924 CA LEU B 25 3.901 13.193 -3.268 1.00 0.00 C ATOM 1925 C LEU B 25 5.327 12.745 -3.597 1.00 0.00 C ATOM 1926 O LEU B 25 5.684 11.598 -3.412 1.00 0.00 O ATOM 1927 CB LEU B 25 3.082 13.558 -4.518 1.00 0.00 C ATOM 1928 CG LEU B 25 3.963 13.727 -5.769 1.00 0.00 C ATOM 1929 CD1 LEU B 25 4.679 12.414 -6.111 1.00 0.00 C ATOM 1930 CD2 LEU B 25 3.082 14.115 -6.957 1.00 0.00 C ATOM 0 H LEU B 25 3.818 15.309 -2.951 1.00 0.00 H new ATOM 0 HA LEU B 25 3.425 12.357 -2.756 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.340 12.781 -4.702 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.536 14.483 -4.334 1.00 0.00 H new ATOM 0 HG LEU B 25 4.704 14.500 -5.566 1.00 0.00 H new ATOM 0 HD11 LEU B 25 5.296 12.556 -6.998 1.00 0.00 H new ATOM 0 HD12 LEU B 25 5.310 12.115 -5.274 1.00 0.00 H new ATOM 0 HD13 LEU B 25 3.940 11.636 -6.304 1.00 0.00 H new ATOM 0 HD21 LEU B 25 3.702 14.236 -7.845 1.00 0.00 H new ATOM 0 HD22 LEU B 25 2.344 13.333 -7.133 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.572 15.053 -6.740 1.00 0.00 H new ATOM 1942 N ALA B 26 6.156 13.642 -4.067 1.00 0.00 N ATOM 1943 CA ALA B 26 7.558 13.252 -4.376 1.00 0.00 C ATOM 1944 C ALA B 26 8.202 12.776 -3.081 1.00 0.00 C ATOM 1945 O ALA B 26 9.065 11.917 -3.062 1.00 0.00 O ATOM 1946 CB ALA B 26 8.235 14.525 -4.887 1.00 0.00 C ATOM 0 H ALA B 26 5.923 14.618 -4.248 1.00 0.00 H new ATOM 0 HA ALA B 26 7.636 12.454 -5.115 1.00 0.00 H new ATOM 0 HB1 ALA B 26 9.275 14.310 -5.134 1.00 0.00 H new ATOM 0 HB2 ALA B 26 7.716 14.881 -5.777 1.00 0.00 H new ATOM 0 HB3 ALA B 26 8.197 15.293 -4.114 1.00 0.00 H new ATOM 1952 N SER B 27 7.740 13.314 -1.989 1.00 0.00 N ATOM 1953 CA SER B 27 8.272 12.896 -0.671 1.00 0.00 C ATOM 1954 C SER B 27 7.545 11.636 -0.232 1.00 0.00 C ATOM 1955 O SER B 27 8.108 10.773 0.402 1.00 0.00 O ATOM 1956 CB SER B 27 7.956 14.047 0.272 1.00 0.00 C ATOM 1957 OG SER B 27 8.689 15.197 -0.126 1.00 0.00 O ATOM 0 H SER B 27 7.013 14.029 -1.956 1.00 0.00 H new ATOM 0 HA SER B 27 9.341 12.682 -0.691 1.00 0.00 H new ATOM 0 HB2 SER B 27 6.887 14.260 0.258 1.00 0.00 H new ATOM 0 HB3 SER B 27 8.213 13.774 1.296 1.00 0.00 H new ATOM 0 HG SER B 27 8.299 15.566 -0.946 1.00 0.00 H new ATOM 1963 N PHE B 28 6.296 11.523 -0.593 1.00 0.00 N ATOM 1964 CA PHE B 28 5.507 10.313 -0.231 1.00 0.00 C ATOM 1965 C PHE B 28 6.245 9.089 -0.743 1.00 0.00 C ATOM 1966 O PHE B 28 6.529 8.183 0.000 1.00 0.00 O ATOM 1967 CB PHE B 28 4.165 10.533 -0.931 1.00 0.00 C ATOM 1968 CG PHE B 28 3.406 9.244 -1.165 1.00 0.00 C ATOM 1969 CD1 PHE B 28 3.786 8.352 -2.181 1.00 0.00 C ATOM 1970 CD2 PHE B 28 2.263 8.984 -0.409 1.00 0.00 C ATOM 1971 CE1 PHE B 28 3.021 7.218 -2.427 1.00 0.00 C ATOM 1972 CE2 PHE B 28 1.507 7.846 -0.648 1.00 0.00 C ATOM 1973 CZ PHE B 28 1.878 6.961 -1.661 1.00 0.00 C ATOM 0 H PHE B 28 5.784 12.224 -1.128 1.00 0.00 H new ATOM 0 HA PHE B 28 5.364 10.158 0.838 1.00 0.00 H new ATOM 0 HB2 PHE B 28 3.553 11.205 -0.330 1.00 0.00 H new ATOM 0 HB3 PHE B 28 4.336 11.027 -1.887 1.00 0.00 H new ATOM 0 HD1 PHE B 28 4.670 8.547 -2.770 1.00 0.00 H new ATOM 0 HD2 PHE B 28 1.965 9.673 0.367 1.00 0.00 H new ATOM 0 HE1 PHE B 28 3.309 6.533 -3.211 1.00 0.00 H new ATOM 0 HE2 PHE B 28 0.631 7.645 -0.050 1.00 0.00 H new ATOM 0 HZ PHE B 28 1.284 6.080 -1.854 1.00 0.00 H new ATOM 1983 N GLU B 29 6.629 9.068 -1.984 1.00 0.00 N ATOM 1984 CA GLU B 29 7.407 7.904 -2.449 1.00 0.00 C ATOM 1985 C GLU B 29 8.724 7.930 -1.710 1.00 0.00 C ATOM 1986 O GLU B 29 9.281 6.912 -1.350 1.00 0.00 O ATOM 1987 CB GLU B 29 7.643 8.093 -3.934 1.00 0.00 C ATOM 1988 CG GLU B 29 8.130 6.767 -4.492 1.00 0.00 C ATOM 1989 CD GLU B 29 9.265 7.006 -5.490 1.00 0.00 C ATOM 1990 OE1 GLU B 29 9.159 7.941 -6.266 1.00 0.00 O ATOM 1991 OE2 GLU B 29 10.221 6.248 -5.461 1.00 0.00 O ATOM 0 H GLU B 29 6.442 9.790 -2.679 1.00 0.00 H new ATOM 0 HA GLU B 29 6.898 6.957 -2.271 1.00 0.00 H new ATOM 0 HB2 GLU B 29 6.724 8.404 -4.432 1.00 0.00 H new ATOM 0 HB3 GLU B 29 8.381 8.876 -4.108 1.00 0.00 H new ATOM 0 HG2 GLU B 29 8.476 6.127 -3.681 1.00 0.00 H new ATOM 0 HG3 GLU B 29 7.308 6.245 -4.981 1.00 0.00 H new ATOM 1998 N LYS B 30 9.210 9.112 -1.456 1.00 0.00 N ATOM 1999 CA LYS B 30 10.474 9.229 -0.712 1.00 0.00 C ATOM 2000 C LYS B 30 10.256 8.737 0.713 1.00 0.00 C ATOM 2001 O LYS B 30 11.168 8.360 1.383 1.00 0.00 O ATOM 2002 CB LYS B 30 10.839 10.710 -0.716 1.00 0.00 C ATOM 2003 CG LYS B 30 12.300 10.851 -0.296 1.00 0.00 C ATOM 2004 CD LYS B 30 12.782 12.276 -0.578 1.00 0.00 C ATOM 2005 CE LYS B 30 12.096 13.248 0.384 1.00 0.00 C ATOM 2006 NZ LYS B 30 12.885 13.164 1.644 1.00 0.00 N ATOM 0 H LYS B 30 8.781 9.995 -1.734 1.00 0.00 H new ATOM 0 HA LYS B 30 11.271 8.635 -1.159 1.00 0.00 H new ATOM 0 HB2 LYS B 30 10.688 11.135 -1.708 1.00 0.00 H new ATOM 0 HB3 LYS B 30 10.194 11.261 -0.032 1.00 0.00 H new ATOM 0 HG2 LYS B 30 12.407 10.624 0.765 1.00 0.00 H new ATOM 0 HG3 LYS B 30 12.916 10.134 -0.839 1.00 0.00 H new ATOM 0 HD2 LYS B 30 13.864 12.335 -0.461 1.00 0.00 H new ATOM 0 HD3 LYS B 30 12.558 12.549 -1.609 1.00 0.00 H new ATOM 0 HE2 LYS B 30 12.095 14.263 -0.014 1.00 0.00 H new ATOM 0 HE3 LYS B 30 11.055 12.970 0.551 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 12.238 13.151 2.458 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 13.454 12.294 1.640 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 13.514 13.989 1.715 1.00 0.00 H new ATOM 2020 N ILE B 31 9.053 8.701 1.188 1.00 0.00 N ATOM 2021 CA ILE B 31 8.848 8.189 2.568 1.00 0.00 C ATOM 2022 C ILE B 31 8.189 6.830 2.512 1.00 0.00 C ATOM 2023 O ILE B 31 8.357 6.008 3.382 1.00 0.00 O ATOM 2024 CB ILE B 31 8.006 9.209 3.303 1.00 0.00 C ATOM 2025 CG1 ILE B 31 6.851 9.716 2.457 1.00 0.00 C ATOM 2026 CG2 ILE B 31 8.911 10.367 3.711 1.00 0.00 C ATOM 2027 CD1 ILE B 31 5.549 9.269 3.112 1.00 0.00 C ATOM 0 H ILE B 31 8.211 8.998 0.694 1.00 0.00 H new ATOM 0 HA ILE B 31 9.791 8.057 3.098 1.00 0.00 H new ATOM 0 HB ILE B 31 7.565 8.735 4.180 1.00 0.00 H new ATOM 0 HG12 ILE B 31 6.884 10.803 2.380 1.00 0.00 H new ATOM 0 HG13 ILE B 31 6.921 9.322 1.443 1.00 0.00 H new ATOM 0 HG21 ILE B 31 8.325 11.116 4.243 1.00 0.00 H new ATOM 0 HG22 ILE B 31 9.704 9.997 4.361 1.00 0.00 H new ATOM 0 HG23 ILE B 31 9.351 10.816 2.821 1.00 0.00 H new ATOM 0 HD11 ILE B 31 4.704 9.622 2.521 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.524 8.181 3.166 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.487 9.684 4.118 1.00 0.00 H new ATOM 2039 N ILE B 32 7.484 6.573 1.464 1.00 0.00 N ATOM 2040 CA ILE B 32 6.858 5.242 1.304 1.00 0.00 C ATOM 2041 C ILE B 32 7.942 4.273 0.887 1.00 0.00 C ATOM 2042 O ILE B 32 8.214 3.287 1.550 1.00 0.00 O ATOM 2043 CB ILE B 32 5.834 5.372 0.178 1.00 0.00 C ATOM 2044 CG1 ILE B 32 4.814 6.473 0.520 1.00 0.00 C ATOM 2045 CG2 ILE B 32 5.124 4.026 0.008 1.00 0.00 C ATOM 2046 CD1 ILE B 32 3.436 5.870 0.784 1.00 0.00 C ATOM 0 H ILE B 32 7.310 7.230 0.703 1.00 0.00 H new ATOM 0 HA ILE B 32 6.382 4.893 2.221 1.00 0.00 H new ATOM 0 HB ILE B 32 6.334 5.645 -0.752 1.00 0.00 H new ATOM 0 HG12 ILE B 32 5.149 7.026 1.398 1.00 0.00 H new ATOM 0 HG13 ILE B 32 4.753 7.187 -0.302 1.00 0.00 H new ATOM 0 HG21 ILE B 32 4.389 4.101 -0.793 1.00 0.00 H new ATOM 0 HG22 ILE B 32 5.856 3.258 -0.242 1.00 0.00 H new ATOM 0 HG23 ILE B 32 4.622 3.760 0.938 1.00 0.00 H new ATOM 0 HD11 ILE B 32 2.731 6.666 1.024 1.00 0.00 H new ATOM 0 HD12 ILE B 32 3.095 5.338 -0.104 1.00 0.00 H new ATOM 0 HD13 ILE B 32 3.497 5.175 1.621 1.00 0.00 H new ATOM 2058 N THR B 33 8.578 4.565 -0.211 1.00 0.00 N ATOM 2059 CA THR B 33 9.655 3.688 -0.682 1.00 0.00 C ATOM 2060 C THR B 33 10.896 3.923 0.182 1.00 0.00 C ATOM 2061 O THR B 33 11.700 3.031 0.376 1.00 0.00 O ATOM 2062 CB THR B 33 9.872 4.081 -2.152 1.00 0.00 C ATOM 2063 OG1 THR B 33 9.367 3.055 -2.992 1.00 0.00 O ATOM 2064 CG2 THR B 33 11.357 4.281 -2.438 1.00 0.00 C ATOM 0 H THR B 33 8.390 5.378 -0.797 1.00 0.00 H new ATOM 0 HA THR B 33 9.425 2.625 -0.607 1.00 0.00 H new ATOM 0 HB THR B 33 9.347 5.016 -2.347 1.00 0.00 H new ATOM 0 HG1 THR B 33 8.483 3.312 -3.327 1.00 0.00 H new ATOM 0 HG21 THR B 33 11.492 4.559 -3.483 1.00 0.00 H new ATOM 0 HG22 THR B 33 11.747 5.073 -1.799 1.00 0.00 H new ATOM 0 HG23 THR B 33 11.894 3.354 -2.237 1.00 0.00 H new ATOM 2072 N GLU B 34 11.066 5.113 0.715 1.00 0.00 N ATOM 2073 CA GLU B 34 12.253 5.357 1.559 1.00 0.00 C ATOM 2074 C GLU B 34 12.014 4.838 2.980 1.00 0.00 C ATOM 2075 O GLU B 34 12.950 4.445 3.642 1.00 0.00 O ATOM 2076 CB GLU B 34 12.432 6.858 1.522 1.00 0.00 C ATOM 2077 CG GLU B 34 12.683 7.280 0.057 1.00 0.00 C ATOM 2078 CD GLU B 34 14.031 6.729 -0.412 1.00 0.00 C ATOM 2079 OE1 GLU B 34 14.986 6.834 0.340 1.00 0.00 O ATOM 2080 OE2 GLU B 34 14.086 6.213 -1.516 1.00 0.00 O ATOM 0 H GLU B 34 10.437 5.907 0.597 1.00 0.00 H new ATOM 0 HA GLU B 34 13.145 4.839 1.207 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.545 7.356 1.914 1.00 0.00 H new ATOM 0 HB3 GLU B 34 13.270 7.156 2.152 1.00 0.00 H new ATOM 0 HG2 GLU B 34 11.883 6.905 -0.582 1.00 0.00 H new ATOM 0 HG3 GLU B 34 12.674 8.367 -0.026 1.00 0.00 H new ATOM 2087 N THR B 35 10.782 4.780 3.464 1.00 0.00 N ATOM 2088 CA THR B 35 10.600 4.217 4.839 1.00 0.00 C ATOM 2089 C THR B 35 10.889 2.736 4.765 1.00 0.00 C ATOM 2090 O THR B 35 11.752 2.228 5.450 1.00 0.00 O ATOM 2091 CB THR B 35 9.149 4.408 5.268 1.00 0.00 C ATOM 2092 OG1 THR B 35 8.958 5.736 5.741 1.00 0.00 O ATOM 2093 CG2 THR B 35 8.856 3.404 6.394 1.00 0.00 C ATOM 0 H THR B 35 9.935 5.085 2.985 1.00 0.00 H new ATOM 0 HA THR B 35 11.261 4.713 5.550 1.00 0.00 H new ATOM 0 HB THR B 35 8.476 4.242 4.427 1.00 0.00 H new ATOM 0 HG1 THR B 35 8.513 6.269 5.049 1.00 0.00 H new ATOM 0 HG21 THR B 35 7.823 3.517 6.722 1.00 0.00 H new ATOM 0 HG22 THR B 35 9.011 2.390 6.026 1.00 0.00 H new ATOM 0 HG23 THR B 35 9.526 3.592 7.233 1.00 0.00 H new ATOM 2101 N VAL B 36 10.177 2.037 3.919 1.00 0.00 N ATOM 2102 CA VAL B 36 10.439 0.581 3.777 1.00 0.00 C ATOM 2103 C VAL B 36 11.939 0.403 3.615 1.00 0.00 C ATOM 2104 O VAL B 36 12.559 -0.474 4.181 1.00 0.00 O ATOM 2105 CB VAL B 36 9.696 0.167 2.505 1.00 0.00 C ATOM 2106 CG1 VAL B 36 10.203 0.976 1.312 1.00 0.00 C ATOM 2107 CG2 VAL B 36 9.917 -1.321 2.241 1.00 0.00 C ATOM 0 H VAL B 36 9.434 2.410 3.328 1.00 0.00 H new ATOM 0 HA VAL B 36 10.110 -0.017 4.627 1.00 0.00 H new ATOM 0 HB VAL B 36 8.632 0.360 2.640 1.00 0.00 H new ATOM 0 HG11 VAL B 36 9.667 0.673 0.413 1.00 0.00 H new ATOM 0 HG12 VAL B 36 10.035 2.037 1.494 1.00 0.00 H new ATOM 0 HG13 VAL B 36 11.269 0.796 1.177 1.00 0.00 H new ATOM 0 HG21 VAL B 36 9.386 -1.612 1.335 1.00 0.00 H new ATOM 0 HG22 VAL B 36 10.982 -1.514 2.116 1.00 0.00 H new ATOM 0 HG23 VAL B 36 9.540 -1.900 3.084 1.00 0.00 H new ATOM 2117 N ALA B 37 12.524 1.281 2.866 1.00 0.00 N ATOM 2118 CA ALA B 37 13.987 1.225 2.672 1.00 0.00 C ATOM 2119 C ALA B 37 14.680 1.645 3.966 1.00 0.00 C ATOM 2120 O ALA B 37 15.708 1.116 4.325 1.00 0.00 O ATOM 2121 CB ALA B 37 14.273 2.200 1.544 1.00 0.00 C ATOM 0 H ALA B 37 12.049 2.040 2.377 1.00 0.00 H new ATOM 0 HA ALA B 37 14.351 0.227 2.426 1.00 0.00 H new ATOM 0 HB1 ALA B 37 15.344 2.216 1.339 1.00 0.00 H new ATOM 0 HB2 ALA B 37 13.737 1.887 0.648 1.00 0.00 H new ATOM 0 HB3 ALA B 37 13.944 3.198 1.834 1.00 0.00 H new ATOM 2127 N LYS B 38 14.082 2.543 4.708 1.00 0.00 N ATOM 2128 CA LYS B 38 14.675 2.934 6.015 1.00 0.00 C ATOM 2129 C LYS B 38 14.524 1.729 6.905 1.00 0.00 C ATOM 2130 O LYS B 38 15.241 1.531 7.866 1.00 0.00 O ATOM 2131 CB LYS B 38 13.838 4.110 6.530 1.00 0.00 C ATOM 2132 CG LYS B 38 14.762 5.241 6.991 1.00 0.00 C ATOM 2133 CD LYS B 38 15.377 5.938 5.774 1.00 0.00 C ATOM 2134 CE LYS B 38 14.272 6.572 4.921 1.00 0.00 C ATOM 2135 NZ LYS B 38 14.544 8.036 4.964 1.00 0.00 N ATOM 0 H LYS B 38 13.213 3.018 4.464 1.00 0.00 H new ATOM 0 HA LYS B 38 15.723 3.231 5.966 1.00 0.00 H new ATOM 0 HB2 LYS B 38 13.174 4.468 5.743 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.206 3.784 7.356 1.00 0.00 H new ATOM 0 HG2 LYS B 38 14.201 5.960 7.588 1.00 0.00 H new ATOM 0 HG3 LYS B 38 15.550 4.842 7.629 1.00 0.00 H new ATOM 0 HD2 LYS B 38 16.081 6.704 6.100 1.00 0.00 H new ATOM 0 HD3 LYS B 38 15.941 5.219 5.179 1.00 0.00 H new ATOM 0 HE2 LYS B 38 14.298 6.196 3.898 1.00 0.00 H new ATOM 0 HE3 LYS B 38 13.284 6.342 5.320 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 13.828 8.539 4.402 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 14.506 8.367 5.949 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 15.488 8.225 4.571 1.00 0.00 H new ATOM 2149 N GLY B 39 13.599 0.897 6.535 1.00 0.00 N ATOM 2150 CA GLY B 39 13.374 -0.334 7.273 1.00 0.00 C ATOM 2151 C GLY B 39 12.193 -0.168 8.222 1.00 0.00 C ATOM 2152 O GLY B 39 12.139 -0.778 9.272 1.00 0.00 O ATOM 0 H GLY B 39 12.985 1.036 5.733 1.00 0.00 H new ATOM 0 HA2 GLY B 39 13.181 -1.153 6.580 1.00 0.00 H new ATOM 0 HA3 GLY B 39 14.269 -0.598 7.837 1.00 0.00 H new ATOM 2156 N ASP B 40 11.240 0.646 7.859 1.00 0.00 N ATOM 2157 CA ASP B 40 10.057 0.834 8.750 1.00 0.00 C ATOM 2158 C ASP B 40 8.786 0.379 8.031 1.00 0.00 C ATOM 2159 O ASP B 40 8.702 0.411 6.819 1.00 0.00 O ATOM 2160 CB ASP B 40 10.012 2.333 9.062 1.00 0.00 C ATOM 2161 CG ASP B 40 10.210 2.551 10.564 1.00 0.00 C ATOM 2162 OD1 ASP B 40 9.597 1.828 11.333 1.00 0.00 O ATOM 2163 OD2 ASP B 40 10.972 3.435 10.919 1.00 0.00 O ATOM 0 H ASP B 40 11.227 1.185 6.993 1.00 0.00 H new ATOM 0 HA ASP B 40 10.129 0.246 9.665 1.00 0.00 H new ATOM 0 HB2 ASP B 40 10.789 2.855 8.503 1.00 0.00 H new ATOM 0 HB3 ASP B 40 9.057 2.752 8.746 1.00 0.00 H new ATOM 2168 N LYS B 41 7.803 -0.058 8.770 1.00 0.00 N ATOM 2169 CA LYS B 41 6.541 -0.532 8.136 1.00 0.00 C ATOM 2170 C LYS B 41 5.502 0.588 8.106 1.00 0.00 C ATOM 2171 O LYS B 41 4.720 0.746 9.024 1.00 0.00 O ATOM 2172 CB LYS B 41 6.061 -1.683 9.021 1.00 0.00 C ATOM 2173 CG LYS B 41 7.010 -2.874 8.876 1.00 0.00 C ATOM 2174 CD LYS B 41 8.007 -2.881 10.037 1.00 0.00 C ATOM 2175 CE LYS B 41 7.262 -3.130 11.353 1.00 0.00 C ATOM 2176 NZ LYS B 41 7.611 -1.969 12.220 1.00 0.00 N ATOM 0 H LYS B 41 7.820 -0.107 9.789 1.00 0.00 H new ATOM 0 HA LYS B 41 6.695 -0.845 7.103 1.00 0.00 H new ATOM 0 HB2 LYS B 41 6.021 -1.362 10.062 1.00 0.00 H new ATOM 0 HB3 LYS B 41 5.050 -1.975 8.738 1.00 0.00 H new ATOM 0 HG2 LYS B 41 6.443 -3.805 8.865 1.00 0.00 H new ATOM 0 HG3 LYS B 41 7.542 -2.814 7.927 1.00 0.00 H new ATOM 0 HD2 LYS B 41 8.758 -3.656 9.880 1.00 0.00 H new ATOM 0 HD3 LYS B 41 8.536 -1.929 10.081 1.00 0.00 H new ATOM 0 HE2 LYS B 41 6.186 -3.192 11.191 1.00 0.00 H new ATOM 0 HE3 LYS B 41 7.571 -4.070 11.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 7.072 -2.024 13.108 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 8.629 -1.987 12.432 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 7.376 -1.084 11.727 1.00 0.00 H new ATOM 2190 N VAL B 42 5.480 1.358 7.055 1.00 0.00 N ATOM 2191 CA VAL B 42 4.481 2.462 6.961 1.00 0.00 C ATOM 2192 C VAL B 42 3.103 1.875 6.645 1.00 0.00 C ATOM 2193 O VAL B 42 2.996 0.818 6.059 1.00 0.00 O ATOM 2194 CB VAL B 42 4.979 3.356 5.821 1.00 0.00 C ATOM 2195 CG1 VAL B 42 5.022 2.561 4.512 1.00 0.00 C ATOM 2196 CG2 VAL B 42 4.037 4.549 5.662 1.00 0.00 C ATOM 0 H VAL B 42 6.109 1.272 6.257 1.00 0.00 H new ATOM 0 HA VAL B 42 4.382 3.026 7.888 1.00 0.00 H new ATOM 0 HB VAL B 42 5.983 3.710 6.056 1.00 0.00 H new ATOM 0 HG11 VAL B 42 5.377 3.204 3.707 1.00 0.00 H new ATOM 0 HG12 VAL B 42 5.698 1.713 4.623 1.00 0.00 H new ATOM 0 HG13 VAL B 42 4.022 2.199 4.273 1.00 0.00 H new ATOM 0 HG21 VAL B 42 4.390 5.186 4.851 1.00 0.00 H new ATOM 0 HG22 VAL B 42 3.033 4.192 5.432 1.00 0.00 H new ATOM 0 HG23 VAL B 42 4.015 5.121 6.589 1.00 0.00 H new ATOM 2206 N GLN B 43 2.049 2.539 7.039 1.00 0.00 N ATOM 2207 CA GLN B 43 0.689 1.988 6.760 1.00 0.00 C ATOM 2208 C GLN B 43 -0.365 3.093 6.767 1.00 0.00 C ATOM 2209 O GLN B 43 -0.085 4.238 7.061 1.00 0.00 O ATOM 2210 CB GLN B 43 0.420 1.003 7.899 1.00 0.00 C ATOM 2211 CG GLN B 43 0.561 1.715 9.245 1.00 0.00 C ATOM 2212 CD GLN B 43 0.012 0.819 10.357 1.00 0.00 C ATOM 2213 OE1 GLN B 43 -1.153 0.477 10.358 1.00 0.00 O ATOM 2214 NE2 GLN B 43 0.810 0.421 11.311 1.00 0.00 N ATOM 0 H GLN B 43 2.068 3.429 7.537 1.00 0.00 H new ATOM 0 HA GLN B 43 0.642 1.517 5.778 1.00 0.00 H new ATOM 0 HB2 GLN B 43 -0.582 0.585 7.802 1.00 0.00 H new ATOM 0 HB3 GLN B 43 1.120 0.169 7.843 1.00 0.00 H new ATOM 0 HG2 GLN B 43 1.608 1.950 9.436 1.00 0.00 H new ATOM 0 HG3 GLN B 43 0.021 2.661 9.226 1.00 0.00 H new ATOM 0 HE21 GLN B 43 1.789 0.708 11.310 1.00 0.00 H new ATOM 0 HE22 GLN B 43 0.455 -0.177 12.057 1.00 0.00 H new ATOM 2223 N LEU B 44 -1.584 2.745 6.454 1.00 0.00 N ATOM 2224 CA LEU B 44 -2.678 3.755 6.454 1.00 0.00 C ATOM 2225 C LEU B 44 -3.847 3.235 7.288 1.00 0.00 C ATOM 2226 O LEU B 44 -4.439 2.225 6.965 1.00 0.00 O ATOM 2227 CB LEU B 44 -3.109 3.916 4.989 1.00 0.00 C ATOM 2228 CG LEU B 44 -1.884 4.064 4.080 1.00 0.00 C ATOM 2229 CD1 LEU B 44 -2.336 4.210 2.622 1.00 0.00 C ATOM 2230 CD2 LEU B 44 -1.098 5.310 4.482 1.00 0.00 C ATOM 0 H LEU B 44 -1.869 1.800 6.197 1.00 0.00 H new ATOM 0 HA LEU B 44 -2.354 4.705 6.878 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -3.696 3.051 4.680 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -3.752 4.790 4.887 1.00 0.00 H new ATOM 0 HG LEU B 44 -1.255 3.180 4.183 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -1.462 4.315 1.979 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.900 3.326 2.326 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.967 5.093 2.523 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -0.227 5.415 3.835 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -1.734 6.190 4.380 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -0.772 5.216 5.518 1.00 0.00 H new ATOM 2242 N THR B 45 -4.179 3.920 8.359 1.00 0.00 N ATOM 2243 CA THR B 45 -5.318 3.486 9.240 1.00 0.00 C ATOM 2244 C THR B 45 -5.515 1.958 9.189 1.00 0.00 C ATOM 2245 O THR B 45 -4.764 1.217 9.792 1.00 0.00 O ATOM 2246 CB THR B 45 -6.554 4.239 8.717 1.00 0.00 C ATOM 2247 OG1 THR B 45 -7.728 3.624 9.227 1.00 0.00 O ATOM 2248 CG2 THR B 45 -6.590 4.212 7.186 1.00 0.00 C ATOM 0 H THR B 45 -3.706 4.770 8.665 1.00 0.00 H new ATOM 0 HA THR B 45 -5.128 3.719 10.288 1.00 0.00 H new ATOM 0 HB THR B 45 -6.502 5.276 9.049 1.00 0.00 H new ATOM 0 HG1 THR B 45 -8.517 4.102 8.897 1.00 0.00 H new ATOM 0 HG21 THR B 45 -7.470 4.749 6.833 1.00 0.00 H new ATOM 0 HG22 THR B 45 -5.692 4.689 6.792 1.00 0.00 H new ATOM 0 HG23 THR B 45 -6.633 3.179 6.841 1.00 0.00 H new ATOM 2256 N GLY B 46 -6.509 1.476 8.480 1.00 0.00 N ATOM 2257 CA GLY B 46 -6.723 0.005 8.411 1.00 0.00 C ATOM 2258 C GLY B 46 -6.971 -0.423 6.961 1.00 0.00 C ATOM 2259 O GLY B 46 -7.983 -1.021 6.651 1.00 0.00 O ATOM 0 H GLY B 46 -7.175 2.039 7.951 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -5.852 -0.516 8.808 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -7.574 -0.276 9.032 1.00 0.00 H new ATOM 2263 N PHE B 47 -6.049 -0.146 6.071 1.00 0.00 N ATOM 2264 CA PHE B 47 -6.239 -0.569 4.653 1.00 0.00 C ATOM 2265 C PHE B 47 -4.895 -0.661 3.923 1.00 0.00 C ATOM 2266 O PHE B 47 -4.754 -1.421 2.987 1.00 0.00 O ATOM 2267 CB PHE B 47 -7.212 0.443 4.023 1.00 0.00 C ATOM 2268 CG PHE B 47 -6.529 1.742 3.672 1.00 0.00 C ATOM 2269 CD1 PHE B 47 -5.752 1.844 2.514 1.00 0.00 C ATOM 2270 CD2 PHE B 47 -6.694 2.853 4.501 1.00 0.00 C ATOM 2271 CE1 PHE B 47 -5.142 3.059 2.192 1.00 0.00 C ATOM 2272 CE2 PHE B 47 -6.083 4.066 4.179 1.00 0.00 C ATOM 2273 CZ PHE B 47 -5.307 4.168 3.025 1.00 0.00 C ATOM 0 H PHE B 47 -5.180 0.351 6.265 1.00 0.00 H new ATOM 0 HA PHE B 47 -6.662 -1.571 4.580 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -7.653 0.011 3.125 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -8.030 0.639 4.716 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -5.624 0.986 1.870 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -7.296 2.774 5.394 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -4.542 3.141 1.298 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -6.211 4.924 4.822 1.00 0.00 H new ATOM 0 HZ PHE B 47 -4.833 5.106 2.775 1.00 0.00 H new ATOM 2283 N LEU B 48 -3.895 0.064 4.355 1.00 0.00 N ATOM 2284 CA LEU B 48 -2.568 -0.048 3.683 1.00 0.00 C ATOM 2285 C LEU B 48 -1.460 -0.249 4.736 1.00 0.00 C ATOM 2286 O LEU B 48 -1.550 0.236 5.845 1.00 0.00 O ATOM 2287 CB LEU B 48 -2.395 1.257 2.906 1.00 0.00 C ATOM 2288 CG LEU B 48 -2.723 1.077 1.397 1.00 0.00 C ATOM 2289 CD1 LEU B 48 -1.775 1.940 0.561 1.00 0.00 C ATOM 2290 CD2 LEU B 48 -2.570 -0.390 0.953 1.00 0.00 C ATOM 0 H LEU B 48 -3.939 0.721 5.134 1.00 0.00 H new ATOM 0 HA LEU B 48 -2.506 -0.905 3.012 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -3.045 2.022 3.331 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -1.370 1.612 3.016 1.00 0.00 H new ATOM 0 HG LEU B 48 -3.759 1.381 1.245 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -2.005 1.813 -0.497 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -1.898 2.987 0.836 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -0.745 1.635 0.747 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -2.808 -0.476 -0.107 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -1.544 -0.716 1.122 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -3.250 -1.017 1.529 1.00 0.00 H new ATOM 2302 N ASN B 49 -0.442 -1.012 4.404 1.00 0.00 N ATOM 2303 CA ASN B 49 0.646 -1.310 5.385 1.00 0.00 C ATOM 2304 C ASN B 49 1.900 -1.825 4.670 1.00 0.00 C ATOM 2305 O ASN B 49 2.046 -3.009 4.468 1.00 0.00 O ATOM 2306 CB ASN B 49 0.053 -2.441 6.210 1.00 0.00 C ATOM 2307 CG ASN B 49 -0.066 -2.019 7.675 1.00 0.00 C ATOM 2308 OD1 ASN B 49 -1.120 -1.606 8.117 1.00 0.00 O ATOM 2309 ND2 ASN B 49 0.977 -2.106 8.455 1.00 0.00 N ATOM 0 H ASN B 49 -0.321 -1.443 3.487 1.00 0.00 H new ATOM 0 HA ASN B 49 0.944 -0.434 5.962 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -0.929 -2.709 5.820 1.00 0.00 H new ATOM 0 HB3 ASN B 49 0.681 -3.328 6.129 1.00 0.00 H new ATOM 0 HD21 ASN B 49 0.907 -1.828 9.434 1.00 0.00 H new ATOM 0 HD22 ASN B 49 1.862 -2.452 8.086 1.00 0.00 H new ATOM 2316 N ILE B 50 2.801 -0.966 4.289 1.00 0.00 N ATOM 2317 CA ILE B 50 4.026 -1.440 3.579 1.00 0.00 C ATOM 2318 C ILE B 50 5.068 -1.904 4.597 1.00 0.00 C ATOM 2319 O ILE B 50 5.167 -1.360 5.680 1.00 0.00 O ATOM 2320 CB ILE B 50 4.498 -0.221 2.765 1.00 0.00 C ATOM 2321 CG1 ILE B 50 4.380 -0.528 1.265 1.00 0.00 C ATOM 2322 CG2 ILE B 50 5.941 0.131 3.088 1.00 0.00 C ATOM 2323 CD1 ILE B 50 5.313 -1.686 0.894 1.00 0.00 C ATOM 0 H ILE B 50 2.746 0.042 4.436 1.00 0.00 H new ATOM 0 HA ILE B 50 3.848 -2.296 2.928 1.00 0.00 H new ATOM 0 HB ILE B 50 3.866 0.627 3.028 1.00 0.00 H new ATOM 0 HG12 ILE B 50 3.350 -0.786 1.018 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.636 0.357 0.683 1.00 0.00 H new ATOM 0 HG21 ILE B 50 6.246 0.995 2.498 1.00 0.00 H new ATOM 0 HG22 ILE B 50 6.029 0.366 4.149 1.00 0.00 H new ATOM 0 HG23 ILE B 50 6.584 -0.716 2.849 1.00 0.00 H new ATOM 0 HD11 ILE B 50 5.224 -1.898 -0.171 1.00 0.00 H new ATOM 0 HD12 ILE B 50 6.342 -1.412 1.125 1.00 0.00 H new ATOM 0 HD13 ILE B 50 5.037 -2.573 1.465 1.00 0.00 H new ATOM 2335 N LYS B 51 5.842 -2.904 4.266 1.00 0.00 N ATOM 2336 CA LYS B 51 6.866 -3.386 5.243 1.00 0.00 C ATOM 2337 C LYS B 51 7.861 -4.332 4.562 1.00 0.00 C ATOM 2338 O LYS B 51 7.471 -5.332 3.992 1.00 0.00 O ATOM 2339 CB LYS B 51 6.078 -4.124 6.332 1.00 0.00 C ATOM 2340 CG LYS B 51 5.096 -5.112 5.694 1.00 0.00 C ATOM 2341 CD LYS B 51 5.048 -6.397 6.523 1.00 0.00 C ATOM 2342 CE LYS B 51 6.358 -7.170 6.350 1.00 0.00 C ATOM 2343 NZ LYS B 51 6.392 -8.137 7.485 1.00 0.00 N ATOM 0 H LYS B 51 5.812 -3.402 3.376 1.00 0.00 H new ATOM 0 HA LYS B 51 7.449 -2.562 5.654 1.00 0.00 H new ATOM 0 HB2 LYS B 51 6.764 -4.656 6.991 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.536 -3.407 6.948 1.00 0.00 H new ATOM 0 HG2 LYS B 51 4.103 -4.667 5.637 1.00 0.00 H new ATOM 0 HG3 LYS B 51 5.403 -5.337 4.673 1.00 0.00 H new ATOM 0 HD2 LYS B 51 4.892 -6.157 7.575 1.00 0.00 H new ATOM 0 HD3 LYS B 51 4.206 -7.014 6.208 1.00 0.00 H new ATOM 0 HE2 LYS B 51 6.387 -7.687 5.391 1.00 0.00 H new ATOM 0 HE3 LYS B 51 7.217 -6.500 6.377 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 7.165 -7.884 8.133 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 5.487 -8.105 7.996 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 6.548 -9.098 7.118 1.00 0.00 H new ATOM 2357 N PRO B 52 9.122 -3.984 4.635 1.00 0.00 N ATOM 2358 CA PRO B 52 10.169 -4.810 4.012 1.00 0.00 C ATOM 2359 C PRO B 52 10.661 -5.877 4.976 1.00 0.00 C ATOM 2360 O PRO B 52 10.724 -5.675 6.174 1.00 0.00 O ATOM 2361 CB PRO B 52 11.280 -3.814 3.726 1.00 0.00 C ATOM 2362 CG PRO B 52 11.094 -2.709 4.720 1.00 0.00 C ATOM 2363 CD PRO B 52 9.694 -2.804 5.286 1.00 0.00 C ATOM 0 HA PRO B 52 9.818 -5.336 3.124 1.00 0.00 H new ATOM 0 HB2 PRO B 52 12.260 -4.278 3.834 1.00 0.00 H new ATOM 0 HB3 PRO B 52 11.216 -3.438 2.705 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.832 -2.789 5.518 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.245 -1.741 4.243 1.00 0.00 H new ATOM 0 HD2 PRO B 52 9.710 -2.916 6.370 1.00 0.00 H new ATOM 0 HD3 PRO B 52 9.114 -1.908 5.066 1.00 0.00 H new ATOM 2371 N VAL B 53 11.026 -7.006 4.453 1.00 0.00 N ATOM 2372 CA VAL B 53 11.537 -8.095 5.321 1.00 0.00 C ATOM 2373 C VAL B 53 12.826 -8.667 4.739 1.00 0.00 C ATOM 2374 O VAL B 53 12.847 -9.245 3.672 1.00 0.00 O ATOM 2375 CB VAL B 53 10.429 -9.137 5.371 1.00 0.00 C ATOM 2376 CG1 VAL B 53 9.153 -8.489 5.916 1.00 0.00 C ATOM 2377 CG2 VAL B 53 10.157 -9.674 3.966 1.00 0.00 C ATOM 0 H VAL B 53 10.993 -7.224 3.457 1.00 0.00 H new ATOM 0 HA VAL B 53 11.782 -7.745 6.324 1.00 0.00 H new ATOM 0 HB VAL B 53 10.736 -9.958 6.018 1.00 0.00 H new ATOM 0 HG11 VAL B 53 8.356 -9.231 5.954 1.00 0.00 H new ATOM 0 HG12 VAL B 53 9.340 -8.105 6.919 1.00 0.00 H new ATOM 0 HG13 VAL B 53 8.854 -7.669 5.263 1.00 0.00 H new ATOM 0 HG21 VAL B 53 9.363 -10.419 4.009 1.00 0.00 H new ATOM 0 HG22 VAL B 53 9.851 -8.854 3.316 1.00 0.00 H new ATOM 0 HG23 VAL B 53 11.063 -10.132 3.570 1.00 0.00 H new ATOM 2387 N ALA B 54 13.901 -8.483 5.445 1.00 0.00 N ATOM 2388 CA ALA B 54 15.232 -8.973 4.972 1.00 0.00 C ATOM 2389 C ALA B 54 15.142 -10.395 4.412 1.00 0.00 C ATOM 2390 O ALA B 54 14.899 -11.345 5.129 1.00 0.00 O ATOM 2391 CB ALA B 54 16.128 -8.943 6.210 1.00 0.00 C ATOM 0 H ALA B 54 13.920 -8.006 6.346 1.00 0.00 H new ATOM 0 HA ALA B 54 15.618 -8.354 4.162 1.00 0.00 H new ATOM 0 HB1 ALA B 54 17.127 -9.290 5.945 1.00 0.00 H new ATOM 0 HB2 ALA B 54 16.187 -7.924 6.592 1.00 0.00 H new ATOM 0 HB3 ALA B 54 15.710 -9.594 6.978 1.00 0.00 H new ATOM 2710 N VAL B 75 15.876 -6.662 0.639 1.00 0.00 N ATOM 2711 CA VAL B 75 14.765 -6.737 1.633 1.00 0.00 C ATOM 2712 C VAL B 75 13.567 -7.452 0.998 1.00 0.00 C ATOM 2713 O VAL B 75 13.576 -7.756 -0.179 1.00 0.00 O ATOM 2714 CB VAL B 75 14.449 -5.274 2.000 1.00 0.00 C ATOM 2715 CG1 VAL B 75 13.035 -4.887 1.554 1.00 0.00 C ATOM 2716 CG2 VAL B 75 14.565 -5.096 3.516 1.00 0.00 C ATOM 0 HA VAL B 75 15.022 -7.304 2.528 1.00 0.00 H new ATOM 0 HB VAL B 75 15.163 -4.629 1.487 1.00 0.00 H new ATOM 0 HG11 VAL B 75 12.839 -3.850 1.826 1.00 0.00 H new ATOM 0 HG12 VAL B 75 12.950 -5.001 0.473 1.00 0.00 H new ATOM 0 HG13 VAL B 75 12.309 -5.534 2.045 1.00 0.00 H new ATOM 0 HG21 VAL B 75 14.342 -4.062 3.779 1.00 0.00 H new ATOM 0 HG22 VAL B 75 13.858 -5.758 4.015 1.00 0.00 H new ATOM 0 HG23 VAL B 75 15.578 -5.341 3.835 1.00 0.00 H new ATOM 2726 N GLY B 76 12.548 -7.734 1.759 1.00 0.00 N ATOM 2727 CA GLY B 76 11.371 -8.440 1.178 1.00 0.00 C ATOM 2728 C GLY B 76 10.160 -7.519 1.220 1.00 0.00 C ATOM 2729 O GLY B 76 9.126 -7.862 1.754 1.00 0.00 O ATOM 0 H GLY B 76 12.478 -7.509 2.751 1.00 0.00 H new ATOM 0 HA2 GLY B 76 11.581 -8.736 0.150 1.00 0.00 H new ATOM 0 HA3 GLY B 76 11.167 -9.353 1.738 1.00 0.00 H new ATOM 2733 N VAL B 77 10.296 -6.347 0.663 1.00 0.00 N ATOM 2734 CA VAL B 77 9.178 -5.356 0.651 1.00 0.00 C ATOM 2735 C VAL B 77 7.829 -6.035 0.448 1.00 0.00 C ATOM 2736 O VAL B 77 7.347 -6.162 -0.660 1.00 0.00 O ATOM 2737 CB VAL B 77 9.494 -4.426 -0.529 1.00 0.00 C ATOM 2738 CG1 VAL B 77 8.406 -3.358 -0.665 1.00 0.00 C ATOM 2739 CG2 VAL B 77 10.842 -3.740 -0.299 1.00 0.00 C ATOM 0 H VAL B 77 11.150 -6.027 0.207 1.00 0.00 H new ATOM 0 HA VAL B 77 9.105 -4.822 1.599 1.00 0.00 H new ATOM 0 HB VAL B 77 9.533 -5.020 -1.442 1.00 0.00 H new ATOM 0 HG11 VAL B 77 8.641 -2.704 -1.505 1.00 0.00 H new ATOM 0 HG12 VAL B 77 7.443 -3.839 -0.838 1.00 0.00 H new ATOM 0 HG13 VAL B 77 8.358 -2.769 0.251 1.00 0.00 H new ATOM 0 HG21 VAL B 77 11.063 -3.081 -1.139 1.00 0.00 H new ATOM 0 HG22 VAL B 77 10.801 -3.156 0.620 1.00 0.00 H new ATOM 0 HG23 VAL B 77 11.624 -4.494 -0.214 1.00 0.00 H new ATOM 2749 N SER B 78 7.213 -6.449 1.521 1.00 0.00 N ATOM 2750 CA SER B 78 5.871 -7.096 1.411 1.00 0.00 C ATOM 2751 C SER B 78 4.911 -6.092 0.756 1.00 0.00 C ATOM 2752 O SER B 78 5.231 -5.520 -0.264 1.00 0.00 O ATOM 2753 CB SER B 78 5.461 -7.412 2.851 1.00 0.00 C ATOM 2754 OG SER B 78 4.558 -8.510 2.851 1.00 0.00 O ATOM 0 H SER B 78 7.579 -6.368 2.470 1.00 0.00 H new ATOM 0 HA SER B 78 5.866 -8.002 0.805 1.00 0.00 H new ATOM 0 HB2 SER B 78 6.341 -7.650 3.448 1.00 0.00 H new ATOM 0 HB3 SER B 78 4.992 -6.540 3.308 1.00 0.00 H new ATOM 0 HG SER B 78 4.294 -8.717 3.772 1.00 0.00 H new ATOM 2760 N VAL B 79 3.753 -5.835 1.309 1.00 0.00 N ATOM 2761 CA VAL B 79 2.872 -4.835 0.641 1.00 0.00 C ATOM 2762 C VAL B 79 2.168 -3.936 1.616 1.00 0.00 C ATOM 2763 O VAL B 79 2.454 -3.889 2.788 1.00 0.00 O ATOM 2764 CB VAL B 79 1.811 -5.600 -0.137 1.00 0.00 C ATOM 2765 CG1 VAL B 79 2.480 -6.575 -1.093 1.00 0.00 C ATOM 2766 CG2 VAL B 79 0.910 -6.349 0.852 1.00 0.00 C ATOM 0 H VAL B 79 3.390 -6.258 2.163 1.00 0.00 H new ATOM 0 HA VAL B 79 3.497 -4.210 0.003 1.00 0.00 H new ATOM 0 HB VAL B 79 1.204 -4.907 -0.720 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.717 -7.121 -1.648 1.00 0.00 H new ATOM 0 HG12 VAL B 79 3.113 -6.025 -1.790 1.00 0.00 H new ATOM 0 HG13 VAL B 79 3.090 -7.279 -0.527 1.00 0.00 H new ATOM 0 HG21 VAL B 79 0.146 -6.900 0.303 1.00 0.00 H new ATOM 0 HG22 VAL B 79 1.511 -7.046 1.436 1.00 0.00 H new ATOM 0 HG23 VAL B 79 0.431 -5.634 1.521 1.00 0.00 H new ATOM 2776 N LYS B 80 1.253 -3.206 1.074 1.00 0.00 N ATOM 2777 CA LYS B 80 0.469 -2.238 1.836 1.00 0.00 C ATOM 2778 C LYS B 80 -0.946 -2.748 2.199 1.00 0.00 C ATOM 2779 O LYS B 80 -1.351 -2.676 3.340 1.00 0.00 O ATOM 2780 CB LYS B 80 0.416 -1.039 0.903 1.00 0.00 C ATOM 2781 CG LYS B 80 0.260 0.251 1.698 1.00 0.00 C ATOM 2782 CD LYS B 80 1.545 0.582 2.432 1.00 0.00 C ATOM 2783 CE LYS B 80 2.177 1.843 1.826 1.00 0.00 C ATOM 2784 NZ LYS B 80 2.237 2.821 2.949 1.00 0.00 N ATOM 0 H LYS B 80 1.011 -3.249 0.084 1.00 0.00 H new ATOM 0 HA LYS B 80 0.913 -2.018 2.807 1.00 0.00 H new ATOM 0 HB2 LYS B 80 1.326 -0.996 0.305 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -0.417 -1.148 0.209 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -0.003 1.069 1.027 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -0.557 0.148 2.412 1.00 0.00 H new ATOM 0 HD2 LYS B 80 1.340 0.739 3.491 1.00 0.00 H new ATOM 0 HD3 LYS B 80 2.241 -0.254 2.363 1.00 0.00 H new ATOM 0 HE2 LYS B 80 3.171 1.635 1.430 1.00 0.00 H new ATOM 0 HE3 LYS B 80 1.578 2.227 1.000 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 3.087 3.412 2.849 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 1.391 3.425 2.929 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 2.276 2.309 3.853 1.00 0.00 H new ATOM 2798 N PRO B 81 -1.685 -3.165 1.217 1.00 0.00 N ATOM 2799 CA PRO B 81 -3.099 -3.572 1.435 1.00 0.00 C ATOM 2800 C PRO B 81 -3.268 -4.601 2.550 1.00 0.00 C ATOM 2801 O PRO B 81 -2.509 -5.539 2.692 1.00 0.00 O ATOM 2802 CB PRO B 81 -3.535 -4.090 0.063 1.00 0.00 C ATOM 2803 CG PRO B 81 -2.254 -4.426 -0.617 1.00 0.00 C ATOM 2804 CD PRO B 81 -1.286 -3.362 -0.164 1.00 0.00 C ATOM 0 HA PRO B 81 -3.719 -2.746 1.785 1.00 0.00 H new ATOM 0 HB2 PRO B 81 -4.181 -4.964 0.153 1.00 0.00 H new ATOM 0 HB3 PRO B 81 -4.095 -3.335 -0.490 1.00 0.00 H new ATOM 0 HG2 PRO B 81 -1.907 -5.421 -0.338 1.00 0.00 H new ATOM 0 HG3 PRO B 81 -2.368 -4.421 -1.701 1.00 0.00 H new ATOM 0 HD2 PRO B 81 -0.250 -3.690 -0.247 1.00 0.00 H new ATOM 0 HD3 PRO B 81 -1.379 -2.448 -0.751 1.00 0.00 H new ATOM 2812 N GLY B 82 -4.297 -4.406 3.335 1.00 0.00 N ATOM 2813 CA GLY B 82 -4.611 -5.321 4.462 1.00 0.00 C ATOM 2814 C GLY B 82 -6.104 -5.569 4.398 1.00 0.00 C ATOM 2815 O GLY B 82 -6.560 -6.657 4.103 1.00 0.00 O ATOM 0 H GLY B 82 -4.948 -3.627 3.234 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -4.057 -6.255 4.372 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -4.331 -4.875 5.416 1.00 0.00 H new ATOM 2819 N GLU B 83 -6.865 -4.533 4.597 1.00 0.00 N ATOM 2820 CA GLU B 83 -8.334 -4.658 4.466 1.00 0.00 C ATOM 2821 C GLU B 83 -8.695 -4.188 3.091 1.00 0.00 C ATOM 2822 O GLU B 83 -9.635 -3.448 2.905 1.00 0.00 O ATOM 2823 CB GLU B 83 -8.957 -3.753 5.510 1.00 0.00 C ATOM 2824 CG GLU B 83 -10.071 -4.535 6.181 1.00 0.00 C ATOM 2825 CD GLU B 83 -10.627 -3.745 7.367 1.00 0.00 C ATOM 2826 OE1 GLU B 83 -9.890 -3.547 8.319 1.00 0.00 O ATOM 2827 OE2 GLU B 83 -11.780 -3.351 7.303 1.00 0.00 O ATOM 0 H GLU B 83 -6.529 -3.603 4.846 1.00 0.00 H new ATOM 0 HA GLU B 83 -8.683 -5.680 4.611 1.00 0.00 H new ATOM 0 HB2 GLU B 83 -8.212 -3.441 6.242 1.00 0.00 H new ATOM 0 HB3 GLU B 83 -9.348 -2.847 5.048 1.00 0.00 H new ATOM 0 HG2 GLU B 83 -10.867 -4.738 5.464 1.00 0.00 H new ATOM 0 HG3 GLU B 83 -9.695 -5.500 6.521 1.00 0.00 H new ATOM 2834 N SER B 84 -7.945 -4.658 2.135 1.00 0.00 N ATOM 2835 CA SER B 84 -8.152 -4.319 0.695 1.00 0.00 C ATOM 2836 C SER B 84 -9.182 -3.240 0.553 1.00 0.00 C ATOM 2837 O SER B 84 -10.149 -3.345 -0.194 1.00 0.00 O ATOM 2838 CB SER B 84 -8.611 -5.621 0.037 1.00 0.00 C ATOM 2839 OG SER B 84 -7.828 -5.869 -1.122 1.00 0.00 O ATOM 0 H SER B 84 -7.162 -5.291 2.299 1.00 0.00 H new ATOM 0 HA SER B 84 -7.245 -3.936 0.226 1.00 0.00 H new ATOM 0 HB2 SER B 84 -8.513 -6.449 0.739 1.00 0.00 H new ATOM 0 HB3 SER B 84 -9.665 -5.553 -0.231 1.00 0.00 H new ATOM 0 HG SER B 84 -8.121 -6.704 -1.542 1.00 0.00 H new ATOM 2845 N LEU B 85 -9.114 -2.243 1.378 1.00 0.00 N ATOM 2846 CA LEU B 85 -10.254 -1.310 1.342 1.00 0.00 C ATOM 2847 C LEU B 85 -11.363 -2.141 0.719 1.00 0.00 C ATOM 2848 O LEU B 85 -12.269 -1.665 0.110 1.00 0.00 O ATOM 2849 CB LEU B 85 -9.851 -0.143 0.428 1.00 0.00 C ATOM 2850 CG LEU B 85 -8.362 0.188 0.598 1.00 0.00 C ATOM 2851 CD1 LEU B 85 -7.574 -0.337 -0.604 1.00 0.00 C ATOM 2852 CD2 LEU B 85 -8.186 1.706 0.695 1.00 0.00 C ATOM 0 H LEU B 85 -8.364 -2.041 2.039 1.00 0.00 H new ATOM 0 HA LEU B 85 -10.555 -0.897 2.305 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -10.055 -0.401 -0.611 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -10.453 0.735 0.663 1.00 0.00 H new ATOM 0 HG LEU B 85 -7.991 -0.284 1.507 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -6.518 -0.099 -0.478 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -7.697 -1.418 -0.676 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -7.945 0.132 -1.515 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -7.129 1.943 0.816 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -8.561 2.175 -0.215 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -8.743 2.083 1.553 1.00 0.00 H new ATOM 2864 N LYS B 86 -11.241 -3.452 0.967 1.00 0.00 N ATOM 2865 CA LYS B 86 -12.219 -4.479 0.534 1.00 0.00 C ATOM 2866 C LYS B 86 -13.541 -3.940 0.980 1.00 0.00 C ATOM 2867 O LYS B 86 -14.559 -4.006 0.319 1.00 0.00 O ATOM 2868 CB LYS B 86 -11.797 -5.699 1.377 1.00 0.00 C ATOM 2869 CG LYS B 86 -11.678 -6.956 0.523 1.00 0.00 C ATOM 2870 CD LYS B 86 -10.731 -7.929 1.234 1.00 0.00 C ATOM 2871 CE LYS B 86 -10.446 -9.126 0.324 1.00 0.00 C ATOM 2872 NZ LYS B 86 -11.453 -10.152 0.713 1.00 0.00 N ATOM 0 H LYS B 86 -10.451 -3.842 1.481 1.00 0.00 H new ATOM 0 HA LYS B 86 -12.265 -4.723 -0.527 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -10.842 -5.495 1.861 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -12.527 -5.864 2.170 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -12.657 -7.414 0.381 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -11.296 -6.708 -0.467 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -9.800 -7.424 1.490 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -11.177 -8.268 2.169 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -10.544 -8.855 -0.727 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -9.430 -9.496 0.465 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -11.322 -11.005 0.132 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -11.331 -10.395 1.717 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -12.410 -9.774 0.562 1.00 0.00 H new ATOM 2886 N LYS B 87 -13.453 -3.317 2.103 1.00 0.00 N ATOM 2887 CA LYS B 87 -14.580 -2.628 2.694 1.00 0.00 C ATOM 2888 C LYS B 87 -14.906 -1.463 1.775 1.00 0.00 C ATOM 2889 O LYS B 87 -16.056 -1.152 1.493 1.00 0.00 O ATOM 2890 CB LYS B 87 -13.986 -2.153 4.019 1.00 0.00 C ATOM 2891 CG LYS B 87 -15.095 -1.655 4.948 1.00 0.00 C ATOM 2892 CD LYS B 87 -15.431 -0.198 4.613 1.00 0.00 C ATOM 2893 CE LYS B 87 -15.240 0.673 5.858 1.00 0.00 C ATOM 2894 NZ LYS B 87 -16.608 0.837 6.424 1.00 0.00 N ATOM 0 H LYS B 87 -12.596 -3.262 2.653 1.00 0.00 H new ATOM 0 HA LYS B 87 -15.494 -3.205 2.834 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -13.442 -2.969 4.495 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -13.267 -1.354 3.838 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -15.983 -2.278 4.838 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -14.776 -1.736 5.987 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -14.790 0.157 3.806 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -16.459 -0.124 4.259 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -14.570 0.197 6.574 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -14.800 1.637 5.602 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -16.561 1.423 7.282 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -17.221 1.299 5.722 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -16.999 -0.096 6.664 1.00 0.00 H new ATOM 2908 N ALA B 88 -13.884 -0.840 1.253 1.00 0.00 N ATOM 2909 CA ALA B 88 -14.135 0.281 0.321 1.00 0.00 C ATOM 2910 C ALA B 88 -14.483 -0.300 -1.042 1.00 0.00 C ATOM 2911 O ALA B 88 -15.186 0.290 -1.837 1.00 0.00 O ATOM 2912 CB ALA B 88 -12.821 1.048 0.277 1.00 0.00 C ATOM 0 H ALA B 88 -12.904 -1.058 1.431 1.00 0.00 H new ATOM 0 HA ALA B 88 -14.957 0.931 0.622 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -12.920 1.901 -0.395 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -12.572 1.402 1.278 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -12.029 0.392 -0.083 1.00 0.00 H new ATOM 2918 N ALA B 89 -14.008 -1.478 -1.303 1.00 0.00 N ATOM 2919 CA ALA B 89 -14.308 -2.121 -2.599 1.00 0.00 C ATOM 2920 C ALA B 89 -15.781 -2.472 -2.644 1.00 0.00 C ATOM 2921 O ALA B 89 -16.462 -2.180 -3.606 1.00 0.00 O ATOM 2922 CB ALA B 89 -13.411 -3.352 -2.643 1.00 0.00 C ATOM 0 H ALA B 89 -13.423 -2.024 -0.671 1.00 0.00 H new ATOM 0 HA ALA B 89 -14.117 -1.484 -3.462 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -13.574 -3.888 -3.578 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -12.367 -3.044 -2.578 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -13.649 -4.006 -1.804 1.00 0.00 H new ATOM 2928 N GLU B 90 -16.304 -3.033 -1.589 1.00 0.00 N ATOM 2929 CA GLU B 90 -17.760 -3.313 -1.582 1.00 0.00 C ATOM 2930 C GLU B 90 -18.458 -1.964 -1.789 1.00 0.00 C ATOM 2931 O GLU B 90 -19.536 -1.876 -2.344 1.00 0.00 O ATOM 2932 CB GLU B 90 -18.064 -3.931 -0.205 1.00 0.00 C ATOM 2933 CG GLU B 90 -18.442 -2.846 0.809 1.00 0.00 C ATOM 2934 CD GLU B 90 -18.182 -3.359 2.228 1.00 0.00 C ATOM 2935 OE1 GLU B 90 -18.509 -4.505 2.492 1.00 0.00 O ATOM 2936 OE2 GLU B 90 -17.657 -2.598 3.024 1.00 0.00 O ATOM 0 H GLU B 90 -15.795 -3.304 -0.748 1.00 0.00 H new ATOM 0 HA GLU B 90 -18.099 -3.999 -2.358 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -18.879 -4.649 -0.296 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -17.193 -4.481 0.152 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -17.860 -1.943 0.625 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -19.492 -2.577 0.695 1.00 0.00 H new ATOM 2943 N GLY B 91 -17.808 -0.903 -1.357 1.00 0.00 N ATOM 2944 CA GLY B 91 -18.377 0.459 -1.534 1.00 0.00 C ATOM 2945 C GLY B 91 -18.529 0.794 -3.030 1.00 0.00 C ATOM 2946 O GLY B 91 -19.497 1.416 -3.421 1.00 0.00 O ATOM 0 H GLY B 91 -16.903 -0.932 -0.888 1.00 0.00 H new ATOM 0 HA2 GLY B 91 -19.348 0.520 -1.042 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -17.730 1.194 -1.055 1.00 0.00 H new ATOM 2950 N LEU B 92 -17.592 0.408 -3.882 1.00 0.00 N ATOM 2951 CA LEU B 92 -17.747 0.750 -5.339 1.00 0.00 C ATOM 2952 C LEU B 92 -18.726 -0.194 -6.034 1.00 0.00 C ATOM 2953 O LEU B 92 -18.703 -0.324 -7.242 1.00 0.00 O ATOM 2954 CB LEU B 92 -16.347 0.603 -5.959 1.00 0.00 C ATOM 2955 CG LEU B 92 -16.026 -0.875 -6.226 1.00 0.00 C ATOM 2956 CD1 LEU B 92 -16.118 -1.161 -7.728 1.00 0.00 C ATOM 2957 CD2 LEU B 92 -14.608 -1.184 -5.739 1.00 0.00 C ATOM 0 H LEU B 92 -16.751 -0.114 -3.637 1.00 0.00 H new ATOM 0 HA LEU B 92 -18.146 1.758 -5.457 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -16.295 1.166 -6.891 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -15.600 1.027 -5.288 1.00 0.00 H new ATOM 0 HG LEU B 92 -16.742 -1.500 -5.693 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -15.890 -2.211 -7.913 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -17.126 -0.942 -8.079 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -15.404 -0.535 -8.262 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -14.379 -2.233 -5.928 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -13.895 -0.555 -6.272 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -14.539 -0.984 -4.670 1.00 0.00 H new ATOM 2969 N LYS B 93 -19.560 -0.877 -5.297 1.00 0.00 N ATOM 2970 CA LYS B 93 -20.499 -1.835 -5.953 1.00 0.00 C ATOM 2971 C LYS B 93 -19.661 -2.789 -6.799 1.00 0.00 C ATOM 2972 O LYS B 93 -20.005 -3.150 -7.913 1.00 0.00 O ATOM 2973 CB LYS B 93 -21.429 -0.987 -6.827 1.00 0.00 C ATOM 2974 CG LYS B 93 -22.356 -0.156 -5.936 1.00 0.00 C ATOM 2975 CD LYS B 93 -21.797 1.262 -5.797 1.00 0.00 C ATOM 2976 CE LYS B 93 -22.925 2.219 -5.406 1.00 0.00 C ATOM 2977 NZ LYS B 93 -22.236 3.431 -4.883 1.00 0.00 N ATOM 0 H LYS B 93 -19.633 -0.816 -4.281 1.00 0.00 H new ATOM 0 HA LYS B 93 -21.087 -2.422 -5.247 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -20.842 -0.331 -7.470 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -22.017 -1.631 -7.481 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -23.357 -0.123 -6.366 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -22.446 -0.620 -4.954 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -21.011 1.282 -5.042 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -21.345 1.580 -6.737 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -23.553 2.461 -6.264 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -23.574 1.777 -4.650 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -22.944 4.135 -4.594 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -21.651 3.171 -4.063 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -21.631 3.834 -5.626 1.00 0.00 H new ATOM 2991 N TYR B 94 -18.534 -3.169 -6.261 1.00 0.00 N ATOM 2992 CA TYR B 94 -17.603 -4.076 -6.980 1.00 0.00 C ATOM 2993 C TYR B 94 -18.375 -5.201 -7.684 1.00 0.00 C ATOM 2994 O TYR B 94 -17.971 -5.679 -8.725 1.00 0.00 O ATOM 2995 CB TYR B 94 -16.673 -4.605 -5.887 1.00 0.00 C ATOM 2996 CG TYR B 94 -17.159 -5.933 -5.395 1.00 0.00 C ATOM 2997 CD1 TYR B 94 -18.197 -6.005 -4.465 1.00 0.00 C ATOM 2998 CD2 TYR B 94 -16.575 -7.091 -5.896 1.00 0.00 C ATOM 2999 CE1 TYR B 94 -18.650 -7.257 -4.033 1.00 0.00 C ATOM 3000 CE2 TYR B 94 -17.025 -8.342 -5.475 1.00 0.00 C ATOM 3001 CZ TYR B 94 -18.065 -8.427 -4.541 1.00 0.00 C ATOM 3002 OH TYR B 94 -18.513 -9.663 -4.125 1.00 0.00 O ATOM 0 H TYR B 94 -18.216 -2.882 -5.335 1.00 0.00 H new ATOM 0 HA TYR B 94 -17.045 -3.576 -7.772 1.00 0.00 H new ATOM 0 HB2 TYR B 94 -15.660 -4.702 -6.277 1.00 0.00 H new ATOM 0 HB3 TYR B 94 -16.630 -3.896 -5.060 1.00 0.00 H new ATOM 0 HD1 TYR B 94 -18.647 -5.101 -4.081 1.00 0.00 H new ATOM 0 HD2 TYR B 94 -15.771 -7.021 -6.613 1.00 0.00 H new ATOM 0 HE1 TYR B 94 -19.449 -7.322 -3.309 1.00 0.00 H new ATOM 0 HE2 TYR B 94 -16.574 -9.241 -5.867 1.00 0.00 H new ATOM 0 HH TYR B 94 -18.000 -10.366 -4.576 1.00 0.00 H new ATOM 3012 N GLU B 95 -19.497 -5.608 -7.140 1.00 0.00 N ATOM 3013 CA GLU B 95 -20.296 -6.677 -7.810 1.00 0.00 C ATOM 3014 C GLU B 95 -20.672 -6.196 -9.208 1.00 0.00 C ATOM 3015 O GLU B 95 -20.490 -6.890 -10.188 1.00 0.00 O ATOM 3016 CB GLU B 95 -21.547 -6.868 -6.956 1.00 0.00 C ATOM 3017 CG GLU B 95 -21.155 -7.382 -5.571 1.00 0.00 C ATOM 3018 CD GLU B 95 -22.350 -8.090 -4.930 1.00 0.00 C ATOM 3019 OE1 GLU B 95 -23.199 -7.403 -4.388 1.00 0.00 O ATOM 3020 OE2 GLU B 95 -22.395 -9.308 -4.993 1.00 0.00 O ATOM 0 H GLU B 95 -19.889 -5.249 -6.270 1.00 0.00 H new ATOM 0 HA GLU B 95 -19.747 -7.614 -7.905 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -22.084 -5.924 -6.865 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -22.223 -7.574 -7.438 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -20.313 -8.069 -5.652 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -20.831 -6.553 -4.942 1.00 0.00 H new ATOM 3027 N ASP B 96 -21.159 -4.985 -9.304 1.00 0.00 N ATOM 3028 CA ASP B 96 -21.506 -4.427 -10.642 1.00 0.00 C ATOM 3029 C ASP B 96 -20.262 -4.504 -11.518 1.00 0.00 C ATOM 3030 O ASP B 96 -20.324 -4.787 -12.698 1.00 0.00 O ATOM 3031 CB ASP B 96 -21.894 -2.970 -10.389 1.00 0.00 C ATOM 3032 CG ASP B 96 -23.313 -2.909 -9.821 1.00 0.00 C ATOM 3033 OD1 ASP B 96 -23.573 -3.600 -8.851 1.00 0.00 O ATOM 3034 OD2 ASP B 96 -24.117 -2.170 -10.366 1.00 0.00 O ATOM 0 H ASP B 96 -21.330 -4.362 -8.515 1.00 0.00 H new ATOM 0 HA ASP B 96 -22.315 -4.964 -11.138 1.00 0.00 H new ATOM 0 HB2 ASP B 96 -21.192 -2.512 -9.692 1.00 0.00 H new ATOM 0 HB3 ASP B 96 -21.838 -2.402 -11.317 1.00 0.00 H new ATOM 3039 N PHE B 97 -19.123 -4.285 -10.918 1.00 0.00 N ATOM 3040 CA PHE B 97 -17.845 -4.376 -11.677 1.00 0.00 C ATOM 3041 C PHE B 97 -17.534 -5.852 -11.939 1.00 0.00 C ATOM 3042 O PHE B 97 -16.894 -6.208 -12.909 1.00 0.00 O ATOM 3043 CB PHE B 97 -16.794 -3.757 -10.753 1.00 0.00 C ATOM 3044 CG PHE B 97 -15.893 -2.841 -11.542 1.00 0.00 C ATOM 3045 CD1 PHE B 97 -16.349 -1.577 -11.936 1.00 0.00 C ATOM 3046 CD2 PHE B 97 -14.598 -3.253 -11.874 1.00 0.00 C ATOM 3047 CE1 PHE B 97 -15.508 -0.726 -12.663 1.00 0.00 C ATOM 3048 CE2 PHE B 97 -13.757 -2.403 -12.601 1.00 0.00 C ATOM 3049 CZ PHE B 97 -14.212 -1.139 -12.996 1.00 0.00 C ATOM 0 H PHE B 97 -19.024 -4.046 -9.931 1.00 0.00 H new ATOM 0 HA PHE B 97 -17.877 -3.867 -12.640 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -17.283 -3.200 -9.953 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -16.205 -4.543 -10.280 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -17.349 -1.259 -11.679 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -14.247 -4.228 -11.569 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -15.859 0.249 -12.967 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -12.757 -2.722 -12.857 1.00 0.00 H new ATOM 0 HZ PHE B 97 -13.564 -0.483 -13.557 1.00 0.00 H new