USER MOD reduce.3.24.130724 H: found=0, std=0, add=698, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 698 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 57 GLN : amide:sc= -0.292 K(o=-0.29,f=-3!) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.00295 K(o=-0.29,f=-3.6) USER MOD Set 2.1: A 19 ASN : amide:sc= 2.14 K(o=1.9,f=-4) USER MOD Set 2.2: A 31 GLN : amide:sc= -0.254 K(o=1.9,f=-1.9) USER MOD Single : A 17 HIS :FLIP no HD1:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -166:sc= 1.28 (180deg=0.965) USER MOD Single : A 25 GLN : amide:sc= 1.16 K(o=1.2,f=-1.1) USER MOD Single : A 28 SER OG : rot -90:sc= 1.16 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HE2:sc= -0.367 K(o=-0.37,f=-1.6) USER MOD Single : A 38 THR OG1 : rot -150:sc= -1.5! USER MOD Single : A 41 SER OG : rot -170:sc= 0.193 USER MOD Single : A 42 LYS NZ :NH3+ -179:sc= 1.25 (180deg=1.2) USER MOD Single : A 44 MET CE :methyl 165:sc= -1.37 (180deg=-1.73!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot -61:sc= -1.26 USER MOD Single : A 51 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 54 SER OG : rot 180:sc= 0.00104 USER MOD Single : A 55 MET CE :methyl -139:sc= 0 (180deg=-0.54) USER MOD Single : A 65 GLN : amide:sc= -0.13 X(o=-0.13,f=-0.21) USER MOD Single : A 68 ASN : amide:sc= 0.0884 K(o=0.088,f=-3.5!) USER MOD Single : A 70 THR OG1 : rot 180:sc=-0.00214 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.125 USER MOD Single : A 75 GLN : amide:sc= -0.0151 K(o=-0.015,f=-1.1!) USER MOD Single : A 78 MET CE :methyl -128:sc= -0.339 (180deg=-2.01) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.118 X(o=-0.12,f=-0.59) USER MOD Single : A 90 GLN : amide:sc= 0.0937 K(o=0.094,f=-4.3!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.0767 USER MOD Single : B 357 ASN : amide:sc=-0.00647 X(o=-0.0065,f=-0.21) USER MOD Single : B 358 ASN : amide:sc= -0.352 X(o=-0.35,f=-0.0076) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD Single : B 367 SER OG : rot 44:sc= 0.0843 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 16 -6.680 15.628 12.310 1.00 10.00 N ATOM 2 CA ASP A 16 -6.546 14.327 13.001 1.00 10.00 C ATOM 3 C ASP A 16 -6.063 13.269 12.021 1.00 10.00 C ATOM 4 O ASP A 16 -5.574 13.601 10.939 1.00 10.00 O ATOM 5 CB ASP A 16 -7.885 13.911 13.615 1.00 10.00 C ATOM 6 CG ASP A 16 -8.312 14.828 14.738 1.00 10.00 C ATOM 7 OD1 ASP A 16 -8.420 14.363 15.890 1.00 10.00 O ATOM 8 OD2 ASP A 16 -8.551 16.024 14.475 1.00 10.00 O ATOM 0 HA ASP A 16 -5.815 14.426 13.803 1.00 10.00 H new ATOM 0 HB2 ASP A 16 -8.652 13.908 12.840 1.00 10.00 H new ATOM 0 HB3 ASP A 16 -7.808 12.891 13.991 1.00 10.00 H new ATOM 13 N HIS A 17 -6.198 12.003 12.397 1.00 10.00 N ATOM 14 CA HIS A 17 -5.773 10.903 11.540 1.00 10.00 C ATOM 15 C HIS A 17 -6.803 10.642 10.446 1.00 10.00 C ATOM 16 O HIS A 17 -7.977 10.999 10.584 1.00 10.00 O ATOM 17 CB HIS A 17 -5.564 9.624 12.355 1.00 10.00 C ATOM 18 CG HIS A 17 -4.308 9.606 13.175 1.00 10.00 C ATOM 19 ND1 HIS A 17 -3.037 9.324 12.798 1.00 10.00 N flip ATOM 20 CD2 HIS A 17 -4.326 9.871 14.523 1.00 10.00 C flip ATOM 21 CE1 HIS A 17 -2.259 9.410 13.924 1.00 10.00 C flip ATOM 22 NE2 HIS A 17 -3.077 9.741 14.934 1.00 10.00 N flip ATOM 0 H HIS A 17 -6.598 11.713 13.289 1.00 10.00 H new ATOM 0 HA HIS A 17 -4.827 11.190 11.081 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.418 9.488 13.019 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.550 8.773 11.674 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -5.185 10.132 15.124 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -1.194 9.243 13.986 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -2.773 9.875 15.898 1.00 10.00 H new ATOM 30 N ILE A 18 -6.359 10.009 9.373 1.00 10.00 N ATOM 31 CA ILE A 18 -7.221 9.682 8.251 1.00 10.00 C ATOM 32 C ILE A 18 -7.330 8.166 8.116 1.00 10.00 C ATOM 33 O ILE A 18 -6.343 7.448 8.291 1.00 10.00 O ATOM 34 CB ILE A 18 -6.689 10.301 6.934 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.647 10.017 5.776 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.289 9.788 6.611 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.228 10.663 4.473 1.00 10.00 C ATOM 0 H ILE A 18 -5.392 9.708 9.256 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.209 10.103 8.440 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.628 11.380 7.073 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.720 8.939 5.631 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.643 10.370 6.044 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -4.942 10.239 5.682 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.609 10.054 7.420 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.315 8.704 6.500 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -7.953 10.419 3.696 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.183 11.745 4.601 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.246 10.291 4.182 1.00 10.00 H new ATOM 49 N ASN A 19 -8.532 7.677 7.836 1.00 10.00 N ATOM 50 CA ASN A 19 -8.756 6.244 7.695 1.00 10.00 C ATOM 51 C ASN A 19 -8.686 5.821 6.237 1.00 10.00 C ATOM 52 O ASN A 19 -9.354 6.394 5.381 1.00 10.00 O ATOM 53 CB ASN A 19 -10.115 5.854 8.281 1.00 10.00 C ATOM 54 CG ASN A 19 -10.211 6.143 9.764 1.00 10.00 C ATOM 55 OD1 ASN A 19 -9.876 5.303 10.596 1.00 10.00 O ATOM 56 ND2 ASN A 19 -10.672 7.337 10.105 1.00 10.00 N ATOM 0 H ASN A 19 -9.365 8.250 7.702 1.00 10.00 H new ATOM 0 HA ASN A 19 -7.968 5.729 8.244 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -10.902 6.396 7.757 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.290 4.792 8.109 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -10.760 7.588 11.090 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -10.939 8.006 9.383 1.00 10.00 H new ATOM 63 N LEU A 20 -7.859 4.833 5.957 1.00 10.00 N ATOM 64 CA LEU A 20 -7.710 4.314 4.609 1.00 10.00 C ATOM 65 C LEU A 20 -8.031 2.828 4.600 1.00 10.00 C ATOM 66 O LEU A 20 -7.511 2.069 5.417 1.00 10.00 O ATOM 67 CB LEU A 20 -6.288 4.560 4.097 1.00 10.00 C ATOM 68 CG LEU A 20 -5.879 6.032 4.004 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.419 6.154 3.606 1.00 10.00 C ATOM 70 CD2 LEU A 20 -6.765 6.769 3.016 1.00 10.00 C ATOM 0 H LEU A 20 -7.274 4.369 6.652 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.403 4.832 3.946 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.587 4.045 4.754 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.190 4.108 3.110 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.007 6.488 4.986 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.145 7.207 3.545 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -3.796 5.660 4.352 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.266 5.682 2.635 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.460 7.814 2.963 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.670 6.312 2.031 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -7.803 6.710 3.344 1.00 10.00 H new ATOM 82 N LYS A 21 -8.902 2.415 3.692 1.00 10.00 N ATOM 83 CA LYS A 21 -9.302 1.019 3.602 1.00 10.00 C ATOM 84 C LYS A 21 -8.474 0.269 2.568 1.00 10.00 C ATOM 85 O LYS A 21 -8.555 0.550 1.369 1.00 10.00 O ATOM 86 CB LYS A 21 -10.785 0.910 3.247 1.00 10.00 C ATOM 87 CG LYS A 21 -11.714 1.500 4.294 1.00 10.00 C ATOM 88 CD LYS A 21 -13.153 1.531 3.803 1.00 10.00 C ATOM 89 CE LYS A 21 -14.065 2.242 4.790 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.380 2.588 4.188 1.00 10.00 N ATOM 0 H LYS A 21 -9.346 3.027 3.007 1.00 10.00 H new ATOM 0 HA LYS A 21 -9.128 0.565 4.578 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -10.959 1.414 2.296 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -11.037 -0.140 3.102 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.653 0.912 5.210 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.390 2.511 4.542 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.198 2.034 2.837 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -13.507 0.512 3.648 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -14.222 1.606 5.661 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.578 3.151 5.143 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -15.874 3.268 4.800 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.232 3.011 3.250 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -15.955 1.727 4.092 1.00 10.00 H new ATOM 104 N VAL A 22 -7.679 -0.677 3.038 1.00 10.00 N ATOM 105 CA VAL A 22 -6.855 -1.488 2.161 1.00 10.00 C ATOM 106 C VAL A 22 -7.478 -2.872 2.033 1.00 10.00 C ATOM 107 O VAL A 22 -7.437 -3.673 2.969 1.00 10.00 O ATOM 108 CB VAL A 22 -5.404 -1.599 2.681 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.565 -2.486 1.772 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.777 -0.217 2.807 1.00 10.00 C ATOM 0 H VAL A 22 -7.587 -0.902 4.029 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.812 -1.007 1.184 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.432 -2.059 3.669 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.548 -2.547 2.161 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -5.000 -3.485 1.735 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.545 -2.062 0.768 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.755 -0.313 3.174 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.768 0.269 1.831 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.359 0.384 3.506 1.00 10.00 H new ATOM 120 N ALA A 23 -8.079 -3.133 0.885 1.00 10.00 N ATOM 121 CA ALA A 23 -8.735 -4.405 0.641 1.00 10.00 C ATOM 122 C ALA A 23 -7.861 -5.322 -0.196 1.00 10.00 C ATOM 123 O ALA A 23 -7.225 -4.883 -1.157 1.00 10.00 O ATOM 124 CB ALA A 23 -10.071 -4.184 -0.049 1.00 10.00 C ATOM 0 H ALA A 23 -8.126 -2.478 0.105 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.906 -4.886 1.604 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.552 -5.146 -0.226 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.710 -3.569 0.585 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -9.910 -3.678 -1.001 1.00 10.00 H new ATOM 130 N GLY A 24 -7.830 -6.592 0.177 1.00 10.00 N ATOM 131 CA GLY A 24 -7.041 -7.561 -0.555 1.00 10.00 C ATOM 132 C GLY A 24 -7.828 -8.180 -1.691 1.00 10.00 C ATOM 133 O GLY A 24 -8.919 -7.717 -2.022 1.00 10.00 O ATOM 0 H GLY A 24 -8.339 -6.970 0.976 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -6.148 -7.078 -0.952 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.705 -8.344 0.124 1.00 10.00 H new ATOM 137 N GLN A 25 -7.284 -9.236 -2.278 1.00 10.00 N ATOM 138 CA GLN A 25 -7.943 -9.920 -3.383 1.00 10.00 C ATOM 139 C GLN A 25 -8.836 -11.038 -2.858 1.00 10.00 C ATOM 140 O GLN A 25 -9.487 -11.745 -3.625 1.00 10.00 O ATOM 141 CB GLN A 25 -6.903 -10.487 -4.352 1.00 10.00 C ATOM 142 CG GLN A 25 -6.101 -9.418 -5.080 1.00 10.00 C ATOM 143 CD GLN A 25 -6.863 -8.805 -6.238 1.00 10.00 C ATOM 144 OE1 GLN A 25 -7.645 -9.479 -6.912 1.00 10.00 O ATOM 145 NE2 GLN A 25 -6.632 -7.527 -6.487 1.00 10.00 N ATOM 0 H GLN A 25 -6.387 -9.639 -2.008 1.00 10.00 H new ATOM 0 HA GLN A 25 -8.563 -9.199 -3.916 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -6.218 -11.131 -3.800 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -7.408 -11.114 -5.087 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -5.825 -8.633 -4.376 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -5.173 -9.854 -5.451 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -5.977 -7.004 -5.905 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -7.109 -7.064 -7.261 1.00 10.00 H new ATOM 154 N ASP A 26 -8.852 -11.193 -1.545 1.00 10.00 N ATOM 155 CA ASP A 26 -9.656 -12.218 -0.897 1.00 10.00 C ATOM 156 C ASP A 26 -10.935 -11.624 -0.321 1.00 10.00 C ATOM 157 O ASP A 26 -12.007 -12.223 -0.420 1.00 10.00 O ATOM 158 CB ASP A 26 -8.853 -12.897 0.214 1.00 10.00 C ATOM 159 CG ASP A 26 -8.268 -11.900 1.190 1.00 10.00 C ATOM 160 OD1 ASP A 26 -7.173 -11.372 0.912 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.911 -11.615 2.222 1.00 10.00 O ATOM 0 H ASP A 26 -8.312 -10.616 -0.900 1.00 10.00 H new ATOM 0 HA ASP A 26 -9.927 -12.960 -1.648 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -9.497 -13.593 0.751 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -8.048 -13.484 -0.229 1.00 10.00 H new ATOM 166 N GLY A 27 -10.821 -10.449 0.281 1.00 10.00 N ATOM 167 CA GLY A 27 -11.980 -9.808 0.864 1.00 10.00 C ATOM 168 C GLY A 27 -11.653 -9.036 2.127 1.00 10.00 C ATOM 169 O GLY A 27 -12.410 -8.153 2.523 1.00 10.00 O ATOM 0 H GLY A 27 -9.948 -9.930 0.376 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.420 -9.130 0.133 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.732 -10.564 1.090 1.00 10.00 H new ATOM 173 N SER A 28 -10.537 -9.379 2.769 1.00 10.00 N ATOM 174 CA SER A 28 -10.117 -8.701 3.995 1.00 10.00 C ATOM 175 C SER A 28 -9.902 -7.211 3.744 1.00 10.00 C ATOM 176 O SER A 28 -9.343 -6.824 2.714 1.00 10.00 O ATOM 177 CB SER A 28 -8.832 -9.333 4.538 1.00 10.00 C ATOM 178 OG SER A 28 -7.884 -9.550 3.503 1.00 10.00 O ATOM 0 H SER A 28 -9.908 -10.121 2.461 1.00 10.00 H new ATOM 0 HA SER A 28 -10.909 -8.815 4.736 1.00 10.00 H new ATOM 0 HB2 SER A 28 -8.399 -8.684 5.300 1.00 10.00 H new ATOM 0 HB3 SER A 28 -9.067 -10.281 5.023 1.00 10.00 H new ATOM 0 HG SER A 28 -8.019 -10.441 3.117 1.00 10.00 H new ATOM 184 N VAL A 29 -10.355 -6.375 4.676 1.00 10.00 N ATOM 185 CA VAL A 29 -10.204 -4.932 4.527 1.00 10.00 C ATOM 186 C VAL A 29 -9.665 -4.311 5.806 1.00 10.00 C ATOM 187 O VAL A 29 -10.407 -4.102 6.764 1.00 10.00 O ATOM 188 CB VAL A 29 -11.539 -4.242 4.162 1.00 10.00 C ATOM 189 CG1 VAL A 29 -11.325 -2.753 3.925 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.176 -4.891 2.943 1.00 10.00 C ATOM 0 H VAL A 29 -10.824 -6.669 5.533 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.498 -4.777 3.711 1.00 10.00 H new ATOM 0 HB VAL A 29 -12.221 -4.364 5.003 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -12.276 -2.285 3.669 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -10.926 -2.294 4.830 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -10.620 -2.613 3.106 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.113 -4.385 2.710 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -11.499 -4.811 2.093 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.373 -5.942 3.152 1.00 10.00 H new ATOM 200 N VAL A 30 -8.376 -4.014 5.819 1.00 10.00 N ATOM 201 CA VAL A 30 -7.751 -3.416 6.988 1.00 10.00 C ATOM 202 C VAL A 30 -7.968 -1.905 7.001 1.00 10.00 C ATOM 203 O VAL A 30 -8.051 -1.264 5.947 1.00 10.00 O ATOM 204 CB VAL A 30 -6.241 -3.734 7.070 1.00 10.00 C ATOM 205 CG1 VAL A 30 -6.019 -5.225 7.278 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.519 -3.252 5.825 1.00 10.00 C ATOM 0 H VAL A 30 -7.743 -4.177 5.036 1.00 10.00 H new ATOM 0 HA VAL A 30 -8.229 -3.856 7.863 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.827 -3.203 7.927 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.950 -5.429 7.333 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -6.497 -5.538 8.206 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.451 -5.777 6.444 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.458 -3.487 5.906 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.935 -3.748 4.948 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.645 -2.174 5.726 1.00 10.00 H new ATOM 216 N GLN A 31 -8.064 -1.352 8.199 1.00 10.00 N ATOM 217 CA GLN A 31 -8.292 0.070 8.390 1.00 10.00 C ATOM 218 C GLN A 31 -6.995 0.765 8.804 1.00 10.00 C ATOM 219 O GLN A 31 -6.519 0.606 9.928 1.00 10.00 O ATOM 220 CB GLN A 31 -9.389 0.260 9.450 1.00 10.00 C ATOM 221 CG GLN A 31 -9.473 1.655 10.047 1.00 10.00 C ATOM 222 CD GLN A 31 -10.505 1.732 11.155 1.00 10.00 C ATOM 223 OE1 GLN A 31 -10.884 0.717 11.741 1.00 10.00 O ATOM 224 NE2 GLN A 31 -10.947 2.935 11.472 1.00 10.00 N ATOM 0 H GLN A 31 -7.986 -1.879 9.069 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.621 0.522 7.454 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.352 0.015 9.002 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -9.221 -0.454 10.256 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -8.497 1.942 10.439 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -9.726 2.371 9.265 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -10.610 3.753 10.964 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -11.626 3.047 12.225 1.00 10.00 H new ATOM 233 N PHE A 32 -6.414 1.513 7.883 1.00 10.00 N ATOM 234 CA PHE A 32 -5.180 2.229 8.160 1.00 10.00 C ATOM 235 C PHE A 32 -5.482 3.628 8.660 1.00 10.00 C ATOM 236 O PHE A 32 -6.077 4.434 7.951 1.00 10.00 O ATOM 237 CB PHE A 32 -4.308 2.300 6.911 1.00 10.00 C ATOM 238 CG PHE A 32 -3.321 1.175 6.810 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.583 0.074 6.016 1.00 10.00 C ATOM 240 CD2 PHE A 32 -2.128 1.222 7.513 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.674 -0.964 5.927 1.00 10.00 C ATOM 242 CE2 PHE A 32 -1.217 0.189 7.427 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.489 -0.905 6.631 1.00 10.00 C ATOM 0 H PHE A 32 -6.776 1.641 6.938 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.637 1.686 8.934 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.948 2.292 6.029 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.770 3.248 6.906 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.507 0.024 5.460 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.909 2.077 8.135 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.892 -1.821 5.307 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.292 0.237 7.982 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.776 -1.713 6.559 1.00 10.00 H new ATOM 253 N LYS A 33 -5.082 3.903 9.885 1.00 10.00 N ATOM 254 CA LYS A 33 -5.303 5.205 10.488 1.00 10.00 C ATOM 255 C LYS A 33 -3.973 5.940 10.633 1.00 10.00 C ATOM 256 O LYS A 33 -3.280 5.809 11.642 1.00 10.00 O ATOM 257 CB LYS A 33 -5.987 5.037 11.847 1.00 10.00 C ATOM 258 CG LYS A 33 -6.581 6.319 12.396 1.00 10.00 C ATOM 259 CD LYS A 33 -7.396 6.056 13.652 1.00 10.00 C ATOM 260 CE LYS A 33 -7.970 7.341 14.225 1.00 10.00 C ATOM 261 NZ LYS A 33 -8.820 7.086 15.414 1.00 10.00 N ATOM 0 H LYS A 33 -4.598 3.237 10.488 1.00 10.00 H new ATOM 0 HA LYS A 33 -5.955 5.798 9.847 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -6.777 4.291 11.756 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.262 4.648 12.562 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -5.782 7.026 12.620 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.214 6.782 11.639 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.207 5.365 13.422 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -6.768 5.572 14.400 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -7.156 8.012 14.498 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -8.558 7.848 13.460 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -9.192 7.988 15.775 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -9.612 6.466 15.148 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -8.253 6.625 16.154 1.00 10.00 H new ATOM 275 N ILE A 34 -3.614 6.698 9.609 1.00 10.00 N ATOM 276 CA ILE A 34 -2.356 7.438 9.599 1.00 10.00 C ATOM 277 C ILE A 34 -2.612 8.929 9.450 1.00 10.00 C ATOM 278 O ILE A 34 -3.759 9.360 9.391 1.00 10.00 O ATOM 279 CB ILE A 34 -1.438 6.968 8.447 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.105 7.222 7.089 1.00 10.00 C ATOM 281 CG2 ILE A 34 -1.100 5.493 8.608 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.201 6.950 5.904 1.00 10.00 C ATOM 0 H ILE A 34 -4.178 6.819 8.768 1.00 10.00 H new ATOM 0 HA ILE A 34 -1.859 7.245 10.550 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.512 7.542 8.486 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -2.993 6.595 7.008 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.441 8.258 7.048 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.453 5.177 7.790 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.586 5.339 9.557 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -2.018 4.906 8.593 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.742 7.152 4.980 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.324 7.595 5.960 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.885 5.907 5.919 1.00 10.00 H new ATOM 294 N LYS A 35 -1.548 9.717 9.405 1.00 10.00 N ATOM 295 CA LYS A 35 -1.685 11.157 9.238 1.00 10.00 C ATOM 296 C LYS A 35 -1.749 11.482 7.747 1.00 10.00 C ATOM 297 O LYS A 35 -1.237 10.722 6.925 1.00 10.00 O ATOM 298 CB LYS A 35 -0.520 11.900 9.904 1.00 10.00 C ATOM 299 CG LYS A 35 -0.502 11.773 11.422 1.00 10.00 C ATOM 300 CD LYS A 35 0.691 12.494 12.036 1.00 10.00 C ATOM 301 CE LYS A 35 0.691 12.382 13.554 1.00 10.00 C ATOM 302 NZ LYS A 35 1.825 13.121 14.169 1.00 10.00 N ATOM 0 H LYS A 35 -0.586 9.387 9.481 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.604 11.487 9.722 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.419 11.517 9.505 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.573 12.955 9.637 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.425 12.183 11.832 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.471 10.719 11.698 1.00 10.00 H new ATOM 0 HD2 LYS A 35 1.615 12.073 11.639 1.00 10.00 H new ATOM 0 HD3 LYS A 35 0.670 13.545 11.748 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -0.249 12.770 13.946 1.00 10.00 H new ATOM 0 HE3 LYS A 35 0.746 11.332 13.840 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 1.786 13.018 15.203 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 2.724 12.734 13.816 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 1.759 14.128 13.919 1.00 10.00 H new ATOM 316 N ARG A 36 -2.353 12.610 7.396 1.00 10.00 N ATOM 317 CA ARG A 36 -2.489 12.996 5.990 1.00 10.00 C ATOM 318 C ARG A 36 -1.137 13.293 5.343 1.00 10.00 C ATOM 319 O ARG A 36 -1.027 13.335 4.116 1.00 10.00 O ATOM 320 CB ARG A 36 -3.420 14.203 5.849 1.00 10.00 C ATOM 321 CG ARG A 36 -4.887 13.865 6.062 1.00 10.00 C ATOM 322 CD ARG A 36 -5.794 15.025 5.673 1.00 10.00 C ATOM 323 NE ARG A 36 -5.990 15.116 4.225 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.146 14.862 3.602 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.227 14.503 4.294 1.00 10.00 N ATOM 326 NH2 ARG A 36 -7.224 14.973 2.282 1.00 10.00 N ATOM 0 H ARG A 36 -2.756 13.273 8.058 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.926 12.146 5.465 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -3.123 14.967 6.568 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -3.295 14.634 4.856 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -5.147 12.986 5.473 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -5.053 13.608 7.108 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.761 14.907 6.162 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.364 15.958 6.039 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.192 15.392 3.653 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -8.178 14.420 5.309 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.103 14.312 3.808 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -6.403 15.252 1.744 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -8.105 14.780 1.805 1.00 10.00 H new ATOM 340 N HIS A 37 -0.109 13.489 6.161 1.00 10.00 N ATOM 341 CA HIS A 37 1.225 13.769 5.644 1.00 10.00 C ATOM 342 C HIS A 37 2.135 12.550 5.787 1.00 10.00 C ATOM 343 O HIS A 37 3.324 12.618 5.485 1.00 10.00 O ATOM 344 CB HIS A 37 1.845 14.994 6.338 1.00 10.00 C ATOM 345 CG HIS A 37 2.029 14.852 7.824 1.00 10.00 C ATOM 346 ND1 HIS A 37 3.137 14.239 8.357 1.00 10.00 N ATOM 347 CD2 HIS A 37 1.235 15.276 8.835 1.00 10.00 C ATOM 348 CE1 HIS A 37 2.996 14.308 9.667 1.00 10.00 C ATOM 349 NE2 HIS A 37 1.857 14.929 10.007 1.00 10.00 N ATOM 0 H HIS A 37 -0.173 13.459 7.179 1.00 10.00 H new ATOM 0 HA HIS A 37 1.126 13.997 4.583 1.00 10.00 H new ATOM 0 HB2 HIS A 37 2.815 15.199 5.884 1.00 10.00 H new ATOM 0 HB3 HIS A 37 1.213 15.861 6.146 1.00 10.00 H new ATOM 0 HD1 HIS A 37 3.911 13.817 7.844 1.00 10.00 H new ATOM 0 HD2 HIS A 37 0.290 15.790 8.737 1.00 10.00 H new ATOM 0 HE1 HIS A 37 3.708 13.914 10.377 1.00 10.00 H new ATOM 357 N THR A 38 1.570 11.438 6.239 1.00 10.00 N ATOM 358 CA THR A 38 2.336 10.211 6.404 1.00 10.00 C ATOM 359 C THR A 38 2.553 9.538 5.047 1.00 10.00 C ATOM 360 O THR A 38 1.593 9.260 4.328 1.00 10.00 O ATOM 361 CB THR A 38 1.628 9.233 7.368 1.00 10.00 C ATOM 362 OG1 THR A 38 1.462 9.855 8.648 1.00 10.00 O ATOM 363 CG2 THR A 38 2.421 7.941 7.531 1.00 10.00 C ATOM 0 H THR A 38 0.586 11.361 6.497 1.00 10.00 H new ATOM 0 HA THR A 38 3.302 10.475 6.835 1.00 10.00 H new ATOM 0 HB THR A 38 0.655 8.985 6.944 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.476 9.170 9.349 1.00 10.00 H new ATOM 0 HG21 THR A 38 1.895 7.275 8.215 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.527 7.454 6.561 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.408 8.168 7.933 1.00 10.00 H new ATOM 371 N PRO A 39 3.821 9.296 4.672 1.00 10.00 N ATOM 372 CA PRO A 39 4.163 8.659 3.396 1.00 10.00 C ATOM 373 C PRO A 39 3.463 7.316 3.201 1.00 10.00 C ATOM 374 O PRO A 39 3.557 6.420 4.048 1.00 10.00 O ATOM 375 CB PRO A 39 5.679 8.457 3.490 1.00 10.00 C ATOM 376 CG PRO A 39 6.142 9.469 4.476 1.00 10.00 C ATOM 377 CD PRO A 39 5.022 9.634 5.460 1.00 10.00 C ATOM 0 HA PRO A 39 3.849 9.268 2.548 1.00 10.00 H new ATOM 0 HB2 PRO A 39 5.923 7.446 3.818 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.157 8.602 2.521 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.053 9.139 4.975 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.372 10.415 3.985 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.140 8.971 6.317 1.00 10.00 H new ATOM 0 HD3 PRO A 39 4.975 10.652 5.848 1.00 10.00 H new ATOM 385 N LEU A 40 2.773 7.177 2.071 1.00 10.00 N ATOM 386 CA LEU A 40 2.056 5.948 1.751 1.00 10.00 C ATOM 387 C LEU A 40 3.034 4.798 1.547 1.00 10.00 C ATOM 388 O LEU A 40 2.661 3.630 1.628 1.00 10.00 O ATOM 389 CB LEU A 40 1.200 6.136 0.499 1.00 10.00 C ATOM 390 CG LEU A 40 -0.011 7.054 0.671 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.605 7.407 -0.681 1.00 10.00 C ATOM 392 CD2 LEU A 40 -1.058 6.398 1.560 1.00 10.00 C ATOM 0 H LEU A 40 2.696 7.904 1.360 1.00 10.00 H new ATOM 0 HA LEU A 40 1.401 5.707 2.589 1.00 10.00 H new ATOM 0 HB2 LEU A 40 1.830 6.536 -0.296 1.00 10.00 H new ATOM 0 HB3 LEU A 40 0.851 5.158 0.167 1.00 10.00 H new ATOM 0 HG LEU A 40 0.320 7.974 1.153 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.466 8.061 -0.541 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.144 7.918 -1.285 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.921 6.496 -1.189 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.912 7.066 1.671 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.386 5.462 1.107 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.627 6.195 2.540 1.00 10.00 H new ATOM 404 N SER A 41 4.290 5.146 1.290 1.00 10.00 N ATOM 405 CA SER A 41 5.345 4.166 1.090 1.00 10.00 C ATOM 406 C SER A 41 5.465 3.256 2.310 1.00 10.00 C ATOM 407 O SER A 41 5.608 2.039 2.185 1.00 10.00 O ATOM 408 CB SER A 41 6.662 4.901 0.840 1.00 10.00 C ATOM 409 OG SER A 41 6.428 6.295 0.685 1.00 10.00 O ATOM 0 H SER A 41 4.603 6.114 1.215 1.00 10.00 H new ATOM 0 HA SER A 41 5.106 3.543 0.228 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.345 4.730 1.672 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.143 4.505 -0.054 1.00 10.00 H new ATOM 0 HG SER A 41 7.247 6.731 0.371 1.00 10.00 H new ATOM 415 N LYS A 42 5.366 3.856 3.492 1.00 10.00 N ATOM 416 CA LYS A 42 5.461 3.112 4.739 1.00 10.00 C ATOM 417 C LYS A 42 4.171 2.340 4.988 1.00 10.00 C ATOM 418 O LYS A 42 4.186 1.249 5.554 1.00 10.00 O ATOM 419 CB LYS A 42 5.756 4.060 5.902 1.00 10.00 C ATOM 420 CG LYS A 42 6.880 5.038 5.602 1.00 10.00 C ATOM 421 CD LYS A 42 7.583 5.498 6.865 1.00 10.00 C ATOM 422 CE LYS A 42 8.838 6.291 6.530 1.00 10.00 C ATOM 423 NZ LYS A 42 9.706 6.497 7.716 1.00 10.00 N ATOM 0 H LYS A 42 5.220 4.858 3.610 1.00 10.00 H new ATOM 0 HA LYS A 42 6.282 2.399 4.662 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.852 4.618 6.147 1.00 10.00 H new ATOM 0 HB3 LYS A 42 6.017 3.474 6.783 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.603 4.567 4.936 1.00 10.00 H new ATOM 0 HG3 LYS A 42 6.477 5.903 5.075 1.00 10.00 H new ATOM 0 HD2 LYS A 42 6.907 6.113 7.459 1.00 10.00 H new ATOM 0 HD3 LYS A 42 7.846 4.634 7.475 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.401 5.767 5.757 1.00 10.00 H new ATOM 0 HE3 LYS A 42 8.554 7.259 6.117 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 10.540 7.056 7.443 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 9.174 7.005 8.451 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 10.014 5.575 8.086 1.00 10.00 H new ATOM 437 N LEU A 43 3.060 2.914 4.538 1.00 10.00 N ATOM 438 CA LEU A 43 1.751 2.289 4.682 1.00 10.00 C ATOM 439 C LEU A 43 1.723 0.971 3.921 1.00 10.00 C ATOM 440 O LEU A 43 1.235 -0.045 4.421 1.00 10.00 O ATOM 441 CB LEU A 43 0.660 3.235 4.160 1.00 10.00 C ATOM 442 CG LEU A 43 -0.744 2.634 4.041 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.778 3.598 4.593 1.00 10.00 C ATOM 444 CD2 LEU A 43 -1.062 2.293 2.592 1.00 10.00 C ATOM 0 H LEU A 43 3.041 3.818 4.067 1.00 10.00 H new ATOM 0 HA LEU A 43 1.561 2.088 5.736 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.609 4.100 4.821 1.00 10.00 H new ATOM 0 HB3 LEU A 43 0.962 3.601 3.179 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.774 1.714 4.625 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.771 3.158 4.502 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.565 3.798 5.643 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.742 4.531 4.031 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -2.064 1.867 2.530 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -1.014 3.198 1.986 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.337 1.569 2.221 1.00 10.00 H new ATOM 456 N MET A 44 2.269 0.998 2.711 1.00 10.00 N ATOM 457 CA MET A 44 2.329 -0.187 1.869 1.00 10.00 C ATOM 458 C MET A 44 3.188 -1.260 2.527 1.00 10.00 C ATOM 459 O MET A 44 2.846 -2.442 2.516 1.00 10.00 O ATOM 460 CB MET A 44 2.900 0.157 0.490 1.00 10.00 C ATOM 461 CG MET A 44 2.033 1.111 -0.314 1.00 10.00 C ATOM 462 SD MET A 44 2.600 1.309 -2.016 1.00 10.00 S ATOM 463 CE MET A 44 4.163 2.148 -1.775 1.00 10.00 C ATOM 0 H MET A 44 2.678 1.833 2.291 1.00 10.00 H new ATOM 0 HA MET A 44 1.315 -0.566 1.744 1.00 10.00 H new ATOM 0 HB2 MET A 44 3.888 0.599 0.617 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.033 -0.764 -0.078 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.006 0.745 -0.319 1.00 10.00 H new ATOM 0 HG3 MET A 44 2.022 2.085 0.176 1.00 10.00 H new ATOM 0 HE1 MET A 44 4.747 2.100 -2.694 1.00 10.00 H new ATOM 0 HE2 MET A 44 3.980 3.191 -1.515 1.00 10.00 H new ATOM 0 HE3 MET A 44 4.715 1.665 -0.969 1.00 10.00 H new ATOM 473 N LYS A 45 4.298 -0.831 3.116 1.00 10.00 N ATOM 474 CA LYS A 45 5.218 -1.741 3.784 1.00 10.00 C ATOM 475 C LYS A 45 4.577 -2.370 5.015 1.00 10.00 C ATOM 476 O LYS A 45 4.756 -3.558 5.268 1.00 10.00 O ATOM 477 CB LYS A 45 6.500 -1.011 4.180 1.00 10.00 C ATOM 478 CG LYS A 45 7.342 -0.590 2.992 1.00 10.00 C ATOM 479 CD LYS A 45 8.642 0.063 3.427 1.00 10.00 C ATOM 480 CE LYS A 45 9.468 0.501 2.229 1.00 10.00 C ATOM 481 NZ LYS A 45 10.798 1.032 2.629 1.00 10.00 N ATOM 0 H LYS A 45 4.583 0.148 3.144 1.00 10.00 H new ATOM 0 HA LYS A 45 5.464 -2.537 3.082 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.241 -0.128 4.764 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.093 -1.658 4.826 1.00 10.00 H new ATOM 0 HG2 LYS A 45 7.561 -1.461 2.375 1.00 10.00 H new ATOM 0 HG3 LYS A 45 6.775 0.105 2.373 1.00 10.00 H new ATOM 0 HD2 LYS A 45 8.425 0.926 4.057 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.218 -0.637 4.032 1.00 10.00 H new ATOM 0 HE2 LYS A 45 9.604 -0.344 1.555 1.00 10.00 H new ATOM 0 HE3 LYS A 45 8.924 1.266 1.675 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.327 1.319 1.781 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.670 1.855 3.252 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 11.329 0.294 3.135 1.00 10.00 H new ATOM 495 N ALA A 46 3.820 -1.576 5.769 1.00 10.00 N ATOM 496 CA ALA A 46 3.153 -2.065 6.972 1.00 10.00 C ATOM 497 C ALA A 46 2.239 -3.243 6.648 1.00 10.00 C ATOM 498 O ALA A 46 2.219 -4.243 7.364 1.00 10.00 O ATOM 499 CB ALA A 46 2.365 -0.948 7.637 1.00 10.00 C ATOM 0 H ALA A 46 3.653 -0.590 5.567 1.00 10.00 H new ATOM 0 HA ALA A 46 3.919 -2.410 7.667 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.875 -1.331 8.532 1.00 10.00 H new ATOM 0 HB2 ALA A 46 3.042 -0.139 7.912 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.612 -0.571 6.944 1.00 10.00 H new ATOM 505 N TYR A 47 1.493 -3.123 5.557 1.00 10.00 N ATOM 506 CA TYR A 47 0.595 -4.187 5.134 1.00 10.00 C ATOM 507 C TYR A 47 1.396 -5.352 4.560 1.00 10.00 C ATOM 508 O TYR A 47 1.077 -6.517 4.792 1.00 10.00 O ATOM 509 CB TYR A 47 -0.403 -3.664 4.095 1.00 10.00 C ATOM 510 CG TYR A 47 -1.469 -4.669 3.709 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.503 -5.220 2.434 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.437 -5.070 4.621 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.474 -6.134 2.078 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.412 -5.987 4.271 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.422 -6.517 3.001 1.00 10.00 C ATOM 516 OH TYR A 47 -4.388 -7.431 2.647 1.00 10.00 O ATOM 0 H TYR A 47 1.493 -2.302 4.952 1.00 10.00 H new ATOM 0 HA TYR A 47 0.037 -4.538 6.002 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.886 -2.769 4.488 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.142 -3.365 3.200 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.757 -4.928 1.709 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.428 -4.659 5.620 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.490 -6.547 1.080 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.161 -6.285 4.990 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.979 -7.595 3.411 1.00 10.00 H new ATOM 526 N CYS A 48 2.451 -5.021 3.827 1.00 10.00 N ATOM 527 CA CYS A 48 3.310 -6.021 3.209 1.00 10.00 C ATOM 528 C CYS A 48 3.995 -6.894 4.259 1.00 10.00 C ATOM 529 O CYS A 48 4.014 -8.122 4.143 1.00 10.00 O ATOM 530 CB CYS A 48 4.359 -5.337 2.335 1.00 10.00 C ATOM 531 SG CYS A 48 5.314 -6.470 1.311 1.00 10.00 S ATOM 0 H CYS A 48 2.734 -4.058 3.645 1.00 10.00 H new ATOM 0 HA CYS A 48 2.685 -6.666 2.591 1.00 10.00 H new ATOM 0 HB2 CYS A 48 3.862 -4.612 1.690 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.042 -4.779 2.975 1.00 10.00 H new ATOM 0 HG CYS A 48 5.967 -7.297 2.072 1.00 10.00 H new ATOM 537 N GLU A 49 4.553 -6.253 5.281 1.00 10.00 N ATOM 538 CA GLU A 49 5.234 -6.964 6.358 1.00 10.00 C ATOM 539 C GLU A 49 4.253 -7.847 7.120 1.00 10.00 C ATOM 540 O GLU A 49 4.628 -8.889 7.660 1.00 10.00 O ATOM 541 CB GLU A 49 5.899 -5.973 7.316 1.00 10.00 C ATOM 542 CG GLU A 49 7.104 -5.259 6.724 1.00 10.00 C ATOM 543 CD GLU A 49 8.247 -6.200 6.395 1.00 10.00 C ATOM 544 OE1 GLU A 49 8.829 -6.077 5.298 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.580 -7.056 7.242 1.00 10.00 O ATOM 0 H GLU A 49 4.547 -5.238 5.386 1.00 10.00 H new ATOM 0 HA GLU A 49 6.004 -7.597 5.916 1.00 10.00 H new ATOM 0 HB2 GLU A 49 5.163 -5.230 7.623 1.00 10.00 H new ATOM 0 HB3 GLU A 49 6.210 -6.505 8.215 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.800 -4.735 5.818 1.00 10.00 H new ATOM 0 HG3 GLU A 49 7.454 -4.503 7.427 1.00 10.00 H new ATOM 552 N ARG A 50 2.996 -7.424 7.149 1.00 10.00 N ATOM 553 CA ARG A 50 1.946 -8.170 7.826 1.00 10.00 C ATOM 554 C ARG A 50 1.662 -9.477 7.103 1.00 10.00 C ATOM 555 O ARG A 50 1.479 -10.519 7.729 1.00 10.00 O ATOM 556 CB ARG A 50 0.672 -7.342 7.885 1.00 10.00 C ATOM 557 CG ARG A 50 0.435 -6.675 9.222 1.00 10.00 C ATOM 558 CD ARG A 50 -0.914 -5.989 9.232 1.00 10.00 C ATOM 559 NE ARG A 50 -1.275 -5.477 10.550 1.00 10.00 N ATOM 560 CZ ARG A 50 -2.531 -5.302 10.946 1.00 10.00 C ATOM 561 NH1 ARG A 50 -3.534 -5.653 10.150 1.00 10.00 N ATOM 562 NH2 ARG A 50 -2.793 -4.791 12.139 1.00 10.00 N ATOM 0 H ARG A 50 2.678 -6.561 6.707 1.00 10.00 H new ATOM 0 HA ARG A 50 2.286 -8.392 8.838 1.00 10.00 H new ATOM 0 HB2 ARG A 50 0.712 -6.576 7.110 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -0.178 -7.984 7.655 1.00 10.00 H new ATOM 0 HG2 ARG A 50 0.480 -7.417 10.020 1.00 10.00 H new ATOM 0 HG3 ARG A 50 1.223 -5.947 9.418 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -0.904 -5.166 8.517 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -1.677 -6.692 8.898 1.00 10.00 H new ATOM 0 HE ARG A 50 -0.525 -5.242 11.200 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -3.340 -6.057 9.234 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -4.498 -5.518 10.455 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -2.028 -4.529 12.761 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -3.760 -4.659 12.436 1.00 10.00 H new ATOM 576 N GLN A 51 1.621 -9.411 5.778 1.00 10.00 N ATOM 577 CA GLN A 51 1.369 -10.593 4.966 1.00 10.00 C ATOM 578 C GLN A 51 2.633 -11.439 4.877 1.00 10.00 C ATOM 579 O GLN A 51 2.613 -12.562 4.375 1.00 10.00 O ATOM 580 CB GLN A 51 0.896 -10.201 3.562 1.00 10.00 C ATOM 581 CG GLN A 51 -0.217 -9.159 3.544 1.00 10.00 C ATOM 582 CD GLN A 51 -1.424 -9.557 4.372 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.495 -9.270 5.567 1.00 10.00 O ATOM 584 NE2 GLN A 51 -2.387 -10.209 3.742 1.00 10.00 N ATOM 0 H GLN A 51 1.759 -8.553 5.244 1.00 10.00 H new ATOM 0 HA GLN A 51 0.579 -11.176 5.440 1.00 10.00 H new ATOM 0 HB2 GLN A 51 1.746 -9.817 2.999 1.00 10.00 H new ATOM 0 HB3 GLN A 51 0.549 -11.096 3.045 1.00 10.00 H new ATOM 0 HG2 GLN A 51 0.175 -8.213 3.917 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -0.531 -8.991 2.514 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -2.290 -10.428 2.751 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -3.226 -10.493 4.248 1.00 10.00 H new ATOM 593 N GLY A 52 3.734 -10.880 5.367 1.00 10.00 N ATOM 594 CA GLY A 52 5.003 -11.577 5.356 1.00 10.00 C ATOM 595 C GLY A 52 5.547 -11.760 3.961 1.00 10.00 C ATOM 596 O GLY A 52 6.039 -12.830 3.619 1.00 10.00 O ATOM 0 H GLY A 52 3.767 -9.946 5.776 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.725 -11.021 5.954 1.00 10.00 H new ATOM 0 HA3 GLY A 52 4.883 -12.553 5.827 1.00 10.00 H new ATOM 600 N LEU A 53 5.460 -10.716 3.153 1.00 10.00 N ATOM 601 CA LEU A 53 5.953 -10.777 1.785 1.00 10.00 C ATOM 602 C LEU A 53 6.885 -9.610 1.495 1.00 10.00 C ATOM 603 O LEU A 53 7.064 -8.722 2.333 1.00 10.00 O ATOM 604 CB LEU A 53 4.783 -10.767 0.795 1.00 10.00 C ATOM 605 CG LEU A 53 3.836 -11.966 0.884 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.611 -11.741 0.012 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.553 -13.246 0.480 1.00 10.00 C ATOM 0 H LEU A 53 5.054 -9.819 3.418 1.00 10.00 H new ATOM 0 HA LEU A 53 6.511 -11.706 1.667 1.00 10.00 H new ATOM 0 HB2 LEU A 53 4.205 -9.857 0.952 1.00 10.00 H new ATOM 0 HB3 LEU A 53 5.186 -10.718 -0.217 1.00 10.00 H new ATOM 0 HG LEU A 53 3.508 -12.070 1.918 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.948 -12.603 0.087 1.00 10.00 H new ATOM 0 HD12 LEU A 53 2.084 -10.848 0.348 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.921 -11.611 -1.025 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.863 -14.087 0.550 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.911 -13.154 -0.545 1.00 10.00 H new ATOM 0 HD23 LEU A 53 5.399 -13.415 1.146 1.00 10.00 H new ATOM 619 N SER A 54 7.480 -9.623 0.311 1.00 10.00 N ATOM 620 CA SER A 54 8.386 -8.568 -0.106 1.00 10.00 C ATOM 621 C SER A 54 7.595 -7.448 -0.769 1.00 10.00 C ATOM 622 O SER A 54 6.663 -7.710 -1.533 1.00 10.00 O ATOM 623 CB SER A 54 9.432 -9.127 -1.075 1.00 10.00 C ATOM 624 OG SER A 54 10.307 -8.109 -1.538 1.00 10.00 O ATOM 0 H SER A 54 7.348 -10.360 -0.382 1.00 10.00 H new ATOM 0 HA SER A 54 8.901 -8.169 0.768 1.00 10.00 H new ATOM 0 HB2 SER A 54 10.009 -9.907 -0.579 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.931 -9.592 -1.924 1.00 10.00 H new ATOM 0 HG SER A 54 10.964 -8.497 -2.153 1.00 10.00 H new ATOM 630 N MET A 55 7.972 -6.201 -0.488 1.00 10.00 N ATOM 631 CA MET A 55 7.280 -5.047 -1.059 1.00 10.00 C ATOM 632 C MET A 55 7.460 -5.002 -2.572 1.00 10.00 C ATOM 633 O MET A 55 6.710 -4.333 -3.280 1.00 10.00 O ATOM 634 CB MET A 55 7.791 -3.747 -0.439 1.00 10.00 C ATOM 635 CG MET A 55 6.781 -2.609 -0.508 1.00 10.00 C ATOM 636 SD MET A 55 7.556 -0.981 -0.486 1.00 10.00 S ATOM 637 CE MET A 55 8.164 -0.874 -2.168 1.00 10.00 C ATOM 0 H MET A 55 8.749 -5.965 0.129 1.00 10.00 H new ATOM 0 HA MET A 55 6.219 -5.151 -0.834 1.00 10.00 H new ATOM 0 HB2 MET A 55 8.053 -3.928 0.603 1.00 10.00 H new ATOM 0 HB3 MET A 55 8.705 -3.444 -0.950 1.00 10.00 H new ATOM 0 HG2 MET A 55 6.188 -2.711 -1.417 1.00 10.00 H new ATOM 0 HG3 MET A 55 6.092 -2.689 0.333 1.00 10.00 H new ATOM 0 HE1 MET A 55 9.159 -0.428 -2.168 1.00 10.00 H new ATOM 0 HE2 MET A 55 8.214 -1.873 -2.601 1.00 10.00 H new ATOM 0 HE3 MET A 55 7.489 -0.256 -2.760 1.00 10.00 H new ATOM 647 N ARG A 56 8.451 -5.730 -3.063 1.00 10.00 N ATOM 648 CA ARG A 56 8.724 -5.773 -4.488 1.00 10.00 C ATOM 649 C ARG A 56 7.895 -6.868 -5.159 1.00 10.00 C ATOM 650 O ARG A 56 7.920 -7.017 -6.380 1.00 10.00 O ATOM 651 CB ARG A 56 10.213 -6.016 -4.736 1.00 10.00 C ATOM 652 CG ARG A 56 10.708 -5.458 -6.062 1.00 10.00 C ATOM 653 CD ARG A 56 12.168 -5.798 -6.301 1.00 10.00 C ATOM 654 NE ARG A 56 12.773 -4.941 -7.321 1.00 10.00 N ATOM 655 CZ ARG A 56 13.622 -3.949 -7.053 1.00 10.00 C ATOM 656 NH1 ARG A 56 13.969 -3.684 -5.797 1.00 10.00 N ATOM 657 NH2 ARG A 56 14.127 -3.218 -8.041 1.00 10.00 N ATOM 0 H ARG A 56 9.079 -6.298 -2.494 1.00 10.00 H new ATOM 0 HA ARG A 56 8.447 -4.812 -4.921 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.786 -5.566 -3.925 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.408 -7.088 -4.707 1.00 10.00 H new ATOM 0 HG2 ARG A 56 10.103 -5.859 -6.875 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.579 -4.376 -6.073 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.721 -5.695 -5.367 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.251 -6.841 -6.608 1.00 10.00 H new ATOM 0 HE ARG A 56 12.530 -5.113 -8.297 1.00 10.00 H new ATOM 0 HH11 ARG A 56 13.585 -4.241 -5.034 1.00 10.00 H new ATOM 0 HH12 ARG A 56 14.619 -2.924 -5.597 1.00 10.00 H new ATOM 0 HH21 ARG A 56 13.865 -3.415 -9.007 1.00 10.00 H new ATOM 0 HH22 ARG A 56 14.776 -2.459 -7.834 1.00 10.00 H new ATOM 671 N GLN A 57 7.140 -7.611 -4.359 1.00 10.00 N ATOM 672 CA GLN A 57 6.308 -8.695 -4.875 1.00 10.00 C ATOM 673 C GLN A 57 4.871 -8.235 -5.131 1.00 10.00 C ATOM 674 O GLN A 57 4.216 -8.708 -6.061 1.00 10.00 O ATOM 675 CB GLN A 57 6.310 -9.871 -3.897 1.00 10.00 C ATOM 676 CG GLN A 57 5.577 -11.096 -4.420 1.00 10.00 C ATOM 677 CD GLN A 57 5.343 -12.145 -3.353 1.00 10.00 C ATOM 678 OE1 GLN A 57 6.124 -12.280 -2.410 1.00 10.00 O ATOM 679 NE2 GLN A 57 4.254 -12.888 -3.488 1.00 10.00 N ATOM 0 H GLN A 57 7.086 -7.484 -3.348 1.00 10.00 H new ATOM 0 HA GLN A 57 6.733 -9.011 -5.828 1.00 10.00 H new ATOM 0 HB2 GLN A 57 7.341 -10.143 -3.671 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.851 -9.555 -2.960 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.618 -10.789 -4.836 1.00 10.00 H new ATOM 0 HG3 GLN A 57 6.152 -11.536 -5.235 1.00 10.00 H new ATOM 0 HE21 GLN A 57 3.633 -12.743 -4.285 1.00 10.00 H new ATOM 0 HE22 GLN A 57 4.036 -13.604 -2.795 1.00 10.00 H new ATOM 688 N ILE A 58 4.376 -7.322 -4.311 1.00 10.00 N ATOM 689 CA ILE A 58 3.009 -6.837 -4.475 1.00 10.00 C ATOM 690 C ILE A 58 2.982 -5.418 -5.033 1.00 10.00 C ATOM 691 O ILE A 58 3.995 -4.716 -5.032 1.00 10.00 O ATOM 692 CB ILE A 58 2.216 -6.884 -3.151 1.00 10.00 C ATOM 693 CG1 ILE A 58 3.015 -6.232 -2.019 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.854 -8.323 -2.800 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.316 -6.279 -0.675 1.00 10.00 C ATOM 0 H ILE A 58 4.889 -6.905 -3.535 1.00 10.00 H new ATOM 0 HA ILE A 58 2.530 -7.508 -5.188 1.00 10.00 H new ATOM 0 HB ILE A 58 1.292 -6.320 -3.281 1.00 10.00 H new ATOM 0 HG12 ILE A 58 3.981 -6.730 -1.934 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.214 -5.192 -2.279 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.295 -8.340 -1.864 1.00 10.00 H new ATOM 0 HG22 ILE A 58 1.242 -8.749 -3.595 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.765 -8.911 -2.689 1.00 10.00 H new ATOM 0 HD11 ILE A 58 2.941 -5.799 0.077 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.362 -5.755 -0.742 1.00 10.00 H new ATOM 0 HD13 ILE A 58 2.141 -7.317 -0.392 1.00 10.00 H new ATOM 707 N ARG A 59 1.822 -5.013 -5.529 1.00 10.00 N ATOM 708 CA ARG A 59 1.640 -3.683 -6.093 1.00 10.00 C ATOM 709 C ARG A 59 0.408 -3.027 -5.485 1.00 10.00 C ATOM 710 O ARG A 59 -0.579 -3.703 -5.192 1.00 10.00 O ATOM 711 CB ARG A 59 1.482 -3.755 -7.619 1.00 10.00 C ATOM 712 CG ARG A 59 2.651 -4.416 -8.336 1.00 10.00 C ATOM 713 CD ARG A 59 3.928 -3.602 -8.200 1.00 10.00 C ATOM 714 NE ARG A 59 5.053 -4.249 -8.869 1.00 10.00 N ATOM 715 CZ ARG A 59 5.979 -4.975 -8.240 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.926 -5.140 -6.925 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.961 -5.540 -8.932 1.00 10.00 N ATOM 0 H ARG A 59 0.984 -5.594 -5.552 1.00 10.00 H new ATOM 0 HA ARG A 59 2.524 -3.089 -5.861 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.570 -4.303 -7.853 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.356 -2.745 -8.008 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.811 -5.414 -7.928 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.408 -4.538 -9.392 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.774 -2.610 -8.624 1.00 10.00 H new ATOM 0 HD3 ARG A 59 4.162 -3.465 -7.144 1.00 10.00 H new ATOM 0 HE ARG A 59 5.136 -4.139 -9.880 1.00 10.00 H new ATOM 0 HH11 ARG A 59 5.173 -4.710 -6.387 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.638 -5.697 -6.452 1.00 10.00 H new ATOM 0 HH21 ARG A 59 7.007 -5.419 -9.944 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.669 -6.095 -8.452 1.00 10.00 H new ATOM 731 N PHE A 60 0.465 -1.718 -5.292 1.00 10.00 N ATOM 732 CA PHE A 60 -0.656 -0.982 -4.722 1.00 10.00 C ATOM 733 C PHE A 60 -1.149 0.073 -5.702 1.00 10.00 C ATOM 734 O PHE A 60 -0.351 0.759 -6.346 1.00 10.00 O ATOM 735 CB PHE A 60 -0.257 -0.320 -3.400 1.00 10.00 C ATOM 736 CG PHE A 60 -0.036 -1.290 -2.271 1.00 10.00 C ATOM 737 CD1 PHE A 60 1.176 -1.945 -2.131 1.00 10.00 C ATOM 738 CD2 PHE A 60 -1.040 -1.544 -1.350 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.387 -2.827 -1.089 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.835 -2.426 -0.306 1.00 10.00 C ATOM 741 CZ PHE A 60 0.379 -3.072 -0.178 1.00 10.00 C ATOM 0 H PHE A 60 1.275 -1.142 -5.521 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.461 -1.690 -4.526 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.656 0.255 -3.555 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -1.034 0.387 -3.111 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.966 -1.764 -2.845 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.994 -1.047 -1.449 1.00 10.00 H new ATOM 0 HE1 PHE A 60 2.340 -3.325 -0.987 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.623 -2.610 0.409 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.539 -3.767 0.633 1.00 10.00 H new ATOM 751 N ARG A 61 -2.461 0.197 -5.821 1.00 10.00 N ATOM 752 CA ARG A 61 -3.053 1.166 -6.731 1.00 10.00 C ATOM 753 C ARG A 61 -4.149 1.972 -6.050 1.00 10.00 C ATOM 754 O ARG A 61 -4.801 1.502 -5.116 1.00 10.00 O ATOM 755 CB ARG A 61 -3.641 0.467 -7.957 1.00 10.00 C ATOM 756 CG ARG A 61 -2.609 0.024 -8.979 1.00 10.00 C ATOM 757 CD ARG A 61 -3.285 -0.397 -10.269 1.00 10.00 C ATOM 758 NE ARG A 61 -2.412 -1.194 -11.125 1.00 10.00 N ATOM 759 CZ ARG A 61 -2.855 -2.136 -11.958 1.00 10.00 C ATOM 760 NH1 ARG A 61 -4.157 -2.387 -12.051 1.00 10.00 N ATOM 761 NH2 ARG A 61 -1.999 -2.822 -12.703 1.00 10.00 N ATOM 0 H ARG A 61 -3.137 -0.361 -5.299 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.257 1.843 -7.040 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.206 -0.405 -7.627 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.348 1.141 -8.441 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -1.911 0.838 -9.176 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -2.026 -0.806 -8.580 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -4.181 -0.971 -10.035 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -3.608 0.491 -10.812 1.00 10.00 H new ATOM 0 HE ARG A 61 -1.408 -1.021 -11.084 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -4.820 -1.858 -11.484 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -4.493 -3.108 -12.689 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -0.999 -2.629 -12.639 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -2.340 -3.542 -13.340 1.00 10.00 H new ATOM 775 N PHE A 62 -4.337 3.189 -6.531 1.00 10.00 N ATOM 776 CA PHE A 62 -5.357 4.085 -6.020 1.00 10.00 C ATOM 777 C PHE A 62 -6.025 4.804 -7.186 1.00 10.00 C ATOM 778 O PHE A 62 -5.381 5.585 -7.892 1.00 10.00 O ATOM 779 CB PHE A 62 -4.751 5.098 -5.044 1.00 10.00 C ATOM 780 CG PHE A 62 -5.661 6.252 -4.730 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.793 6.070 -3.953 1.00 10.00 C ATOM 782 CD2 PHE A 62 -5.389 7.519 -5.222 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.635 7.127 -3.673 1.00 10.00 C ATOM 784 CE2 PHE A 62 -6.227 8.580 -4.943 1.00 10.00 C ATOM 785 CZ PHE A 62 -7.351 8.383 -4.171 1.00 10.00 C ATOM 0 H PHE A 62 -3.783 3.584 -7.291 1.00 10.00 H new ATOM 0 HA PHE A 62 -6.103 3.503 -5.478 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -4.494 4.587 -4.116 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.822 5.483 -5.464 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -7.019 5.089 -3.562 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.511 7.678 -5.831 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -8.514 6.972 -3.065 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -6.002 9.563 -5.329 1.00 10.00 H new ATOM 0 HZ PHE A 62 -8.010 9.211 -3.955 1.00 10.00 H new ATOM 795 N ASP A 63 -7.303 4.507 -7.399 1.00 10.00 N ATOM 796 CA ASP A 63 -8.084 5.114 -8.479 1.00 10.00 C ATOM 797 C ASP A 63 -7.437 4.841 -9.841 1.00 10.00 C ATOM 798 O ASP A 63 -7.431 5.692 -10.733 1.00 10.00 O ATOM 799 CB ASP A 63 -8.253 6.625 -8.244 1.00 10.00 C ATOM 800 CG ASP A 63 -9.301 7.244 -9.151 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.494 6.904 -9.012 1.00 10.00 O ATOM 802 OD2 ASP A 63 -8.938 8.078 -10.005 1.00 10.00 O ATOM 0 H ASP A 63 -7.828 3.841 -6.832 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.074 4.658 -8.481 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -8.530 6.798 -7.204 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -7.297 7.123 -8.407 1.00 10.00 H new ATOM 807 N GLY A 64 -6.874 3.646 -9.986 1.00 10.00 N ATOM 808 CA GLY A 64 -6.236 3.266 -11.234 1.00 10.00 C ATOM 809 C GLY A 64 -4.787 3.714 -11.321 1.00 10.00 C ATOM 810 O GLY A 64 -4.023 3.207 -12.142 1.00 10.00 O ATOM 0 H GLY A 64 -6.848 2.931 -9.259 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.283 2.183 -11.344 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -6.794 3.695 -12.066 1.00 10.00 H new ATOM 814 N GLN A 65 -4.401 4.658 -10.471 1.00 10.00 N ATOM 815 CA GLN A 65 -3.039 5.168 -10.468 1.00 10.00 C ATOM 816 C GLN A 65 -2.183 4.398 -9.471 1.00 10.00 C ATOM 817 O GLN A 65 -2.605 4.166 -8.340 1.00 10.00 O ATOM 818 CB GLN A 65 -3.024 6.659 -10.116 1.00 10.00 C ATOM 819 CG GLN A 65 -3.647 7.547 -11.178 1.00 10.00 C ATOM 820 CD GLN A 65 -2.925 7.457 -12.504 1.00 10.00 C ATOM 821 OE1 GLN A 65 -3.299 6.678 -13.378 1.00 10.00 O ATOM 822 NE2 GLN A 65 -1.878 8.249 -12.661 1.00 10.00 N ATOM 0 H GLN A 65 -5.013 5.085 -9.776 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.626 5.035 -11.468 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -3.555 6.806 -9.176 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.993 6.973 -9.952 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -4.691 7.265 -11.316 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -3.639 8.581 -10.833 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -1.600 8.882 -11.911 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -1.348 8.227 -13.532 1.00 10.00 H new ATOM 831 N PRO A 66 -0.982 3.971 -9.882 1.00 10.00 N ATOM 832 CA PRO A 66 -0.067 3.242 -9.004 1.00 10.00 C ATOM 833 C PRO A 66 0.542 4.161 -7.950 1.00 10.00 C ATOM 834 O PRO A 66 1.022 5.254 -8.267 1.00 10.00 O ATOM 835 CB PRO A 66 1.012 2.723 -9.960 1.00 10.00 C ATOM 836 CG PRO A 66 0.994 3.671 -11.109 1.00 10.00 C ATOM 837 CD PRO A 66 -0.426 4.154 -11.237 1.00 10.00 C ATOM 0 HA PRO A 66 -0.565 2.448 -8.448 1.00 10.00 H new ATOM 0 HB2 PRO A 66 1.990 2.704 -9.479 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.796 1.705 -10.284 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.674 4.505 -10.935 1.00 10.00 H new ATOM 0 HG3 PRO A 66 1.321 3.178 -12.025 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.467 5.198 -11.549 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -0.980 3.578 -11.978 1.00 10.00 H new ATOM 845 N ILE A 67 0.507 3.729 -6.700 1.00 10.00 N ATOM 846 CA ILE A 67 1.055 4.521 -5.609 1.00 10.00 C ATOM 847 C ILE A 67 2.576 4.452 -5.621 1.00 10.00 C ATOM 848 O ILE A 67 3.156 3.366 -5.652 1.00 10.00 O ATOM 849 CB ILE A 67 0.525 4.043 -4.240 1.00 10.00 C ATOM 850 CG1 ILE A 67 -1.005 4.089 -4.224 1.00 10.00 C ATOM 851 CG2 ILE A 67 1.095 4.901 -3.115 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.622 3.494 -2.975 1.00 10.00 C ATOM 0 H ILE A 67 0.106 2.836 -6.415 1.00 10.00 H new ATOM 0 HA ILE A 67 0.735 5.552 -5.757 1.00 10.00 H new ATOM 0 HB ILE A 67 0.847 3.014 -4.082 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.329 5.125 -4.320 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.384 3.555 -5.095 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.710 4.549 -2.158 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.183 4.829 -3.117 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.800 5.940 -3.265 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.708 3.563 -3.037 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.329 2.448 -2.888 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.273 4.043 -2.100 1.00 10.00 H new ATOM 864 N ASN A 68 3.215 5.612 -5.609 1.00 10.00 N ATOM 865 CA ASN A 68 4.665 5.672 -5.629 1.00 10.00 C ATOM 866 C ASN A 68 5.217 5.792 -4.215 1.00 10.00 C ATOM 867 O ASN A 68 4.491 6.125 -3.277 1.00 10.00 O ATOM 868 CB ASN A 68 5.139 6.846 -6.486 1.00 10.00 C ATOM 869 CG ASN A 68 6.261 6.449 -7.425 1.00 10.00 C ATOM 870 OD1 ASN A 68 7.270 5.881 -7.003 1.00 10.00 O ATOM 871 ND2 ASN A 68 6.088 6.729 -8.708 1.00 10.00 N ATOM 0 H ASN A 68 2.752 6.521 -5.586 1.00 10.00 H new ATOM 0 HA ASN A 68 5.040 4.747 -6.067 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.301 7.233 -7.066 1.00 10.00 H new ATOM 0 HB3 ASN A 68 5.478 7.654 -5.838 1.00 10.00 H new ATOM 0 HD21 ASN A 68 6.805 6.473 -9.387 1.00 10.00 H new ATOM 0 HD22 ASN A 68 5.238 7.200 -9.017 1.00 10.00 H new ATOM 878 N GLU A 69 6.511 5.549 -4.071 1.00 10.00 N ATOM 879 CA GLU A 69 7.165 5.605 -2.768 1.00 10.00 C ATOM 880 C GLU A 69 7.460 7.037 -2.328 1.00 10.00 C ATOM 881 O GLU A 69 8.378 7.277 -1.540 1.00 10.00 O ATOM 882 CB GLU A 69 8.464 4.808 -2.798 1.00 10.00 C ATOM 883 CG GLU A 69 8.266 3.307 -2.746 1.00 10.00 C ATOM 884 CD GLU A 69 9.552 2.581 -2.425 1.00 10.00 C ATOM 885 OE1 GLU A 69 9.796 2.294 -1.237 1.00 10.00 O ATOM 886 OE2 GLU A 69 10.335 2.316 -3.358 1.00 10.00 O ATOM 0 H GLU A 69 7.133 5.310 -4.843 1.00 10.00 H new ATOM 0 HA GLU A 69 6.474 5.169 -2.046 1.00 10.00 H new ATOM 0 HB2 GLU A 69 9.013 5.061 -3.705 1.00 10.00 H new ATOM 0 HB3 GLU A 69 9.085 5.112 -1.955 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.515 3.065 -1.994 1.00 10.00 H new ATOM 0 HG3 GLU A 69 7.881 2.958 -3.704 1.00 10.00 H new ATOM 893 N THR A 70 6.696 7.980 -2.843 1.00 10.00 N ATOM 894 CA THR A 70 6.866 9.377 -2.489 1.00 10.00 C ATOM 895 C THR A 70 5.508 10.068 -2.435 1.00 10.00 C ATOM 896 O THR A 70 5.419 11.295 -2.431 1.00 10.00 O ATOM 897 CB THR A 70 7.777 10.106 -3.499 1.00 10.00 C ATOM 898 OG1 THR A 70 8.498 9.152 -4.294 1.00 10.00 O ATOM 899 CG2 THR A 70 8.765 11.009 -2.776 1.00 10.00 C ATOM 0 H THR A 70 5.947 7.803 -3.512 1.00 10.00 H new ATOM 0 HA THR A 70 7.340 9.419 -1.509 1.00 10.00 H new ATOM 0 HB THR A 70 7.147 10.716 -4.146 1.00 10.00 H new ATOM 0 HG1 THR A 70 9.072 9.625 -4.932 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.398 11.514 -3.506 1.00 10.00 H new ATOM 0 HG22 THR A 70 8.220 11.752 -2.193 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.386 10.410 -2.110 1.00 10.00 H new ATOM 907 N ASP A 71 4.448 9.267 -2.376 1.00 10.00 N ATOM 908 CA ASP A 71 3.092 9.798 -2.340 1.00 10.00 C ATOM 909 C ASP A 71 2.540 9.794 -0.921 1.00 10.00 C ATOM 910 O ASP A 71 2.939 8.979 -0.084 1.00 10.00 O ATOM 911 CB ASP A 71 2.167 8.981 -3.249 1.00 10.00 C ATOM 912 CG ASP A 71 2.399 9.242 -4.724 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.740 10.388 -5.086 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.238 8.299 -5.531 1.00 10.00 O ATOM 0 H ASP A 71 4.503 8.249 -2.352 1.00 10.00 H new ATOM 0 HA ASP A 71 3.132 10.826 -2.699 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.313 7.920 -3.047 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.130 9.212 -3.004 1.00 10.00 H new ATOM 919 N THR A 72 1.633 10.722 -0.658 1.00 10.00 N ATOM 920 CA THR A 72 0.987 10.842 0.640 1.00 10.00 C ATOM 921 C THR A 72 -0.525 10.946 0.436 1.00 10.00 C ATOM 922 O THR A 72 -0.976 11.245 -0.674 1.00 10.00 O ATOM 923 CB THR A 72 1.491 12.087 1.408 1.00 10.00 C ATOM 924 OG1 THR A 72 1.509 13.225 0.540 1.00 10.00 O ATOM 925 CG2 THR A 72 2.884 11.857 1.979 1.00 10.00 C ATOM 0 H THR A 72 1.323 11.415 -1.340 1.00 10.00 H new ATOM 0 HA THR A 72 1.232 9.959 1.231 1.00 10.00 H new ATOM 0 HB THR A 72 0.806 12.270 2.236 1.00 10.00 H new ATOM 0 HG1 THR A 72 1.828 14.009 1.035 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.210 12.750 2.513 1.00 10.00 H new ATOM 0 HG22 THR A 72 2.860 11.011 2.666 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.580 11.645 1.167 1.00 10.00 H new ATOM 933 N PRO A 73 -1.332 10.689 1.479 1.00 10.00 N ATOM 934 CA PRO A 73 -2.795 10.771 1.382 1.00 10.00 C ATOM 935 C PRO A 73 -3.261 12.114 0.822 1.00 10.00 C ATOM 936 O PRO A 73 -4.101 12.166 -0.075 1.00 10.00 O ATOM 937 CB PRO A 73 -3.258 10.605 2.832 1.00 10.00 C ATOM 938 CG PRO A 73 -2.166 9.845 3.497 1.00 10.00 C ATOM 939 CD PRO A 73 -0.892 10.274 2.826 1.00 10.00 C ATOM 0 HA PRO A 73 -3.203 10.021 0.704 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.414 11.572 3.310 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -4.204 10.066 2.886 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -2.136 10.060 4.565 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.319 8.771 3.393 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.413 11.094 3.362 1.00 10.00 H new ATOM 0 HD3 PRO A 73 -0.170 9.459 2.779 1.00 10.00 H new ATOM 947 N ALA A 74 -2.683 13.198 1.332 1.00 10.00 N ATOM 948 CA ALA A 74 -3.046 14.539 0.887 1.00 10.00 C ATOM 949 C ALA A 74 -2.548 14.814 -0.532 1.00 10.00 C ATOM 950 O ALA A 74 -3.144 15.598 -1.265 1.00 10.00 O ATOM 951 CB ALA A 74 -2.498 15.580 1.850 1.00 10.00 C ATOM 0 H ALA A 74 -1.962 13.174 2.053 1.00 10.00 H new ATOM 0 HA ALA A 74 -4.134 14.603 0.875 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -2.776 16.576 1.506 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.913 15.410 2.844 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -1.412 15.501 1.892 1.00 10.00 H new ATOM 957 N GLN A 75 -1.461 14.153 -0.914 1.00 10.00 N ATOM 958 CA GLN A 75 -0.878 14.327 -2.243 1.00 10.00 C ATOM 959 C GLN A 75 -1.762 13.700 -3.318 1.00 10.00 C ATOM 960 O GLN A 75 -1.993 14.297 -4.368 1.00 10.00 O ATOM 961 CB GLN A 75 0.521 13.702 -2.285 1.00 10.00 C ATOM 962 CG GLN A 75 1.118 13.577 -3.681 1.00 10.00 C ATOM 963 CD GLN A 75 1.634 14.894 -4.224 1.00 10.00 C ATOM 964 OE1 GLN A 75 2.042 15.777 -3.471 1.00 10.00 O ATOM 965 NE2 GLN A 75 1.626 15.032 -5.541 1.00 10.00 N ATOM 0 H GLN A 75 -0.963 13.489 -0.321 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.804 15.395 -2.445 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.191 14.302 -1.670 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.476 12.711 -1.833 1.00 10.00 H new ATOM 0 HG2 GLN A 75 1.934 12.855 -3.658 1.00 10.00 H new ATOM 0 HG3 GLN A 75 0.362 13.182 -4.359 1.00 10.00 H new ATOM 0 HE21 GLN A 75 1.279 14.276 -6.131 1.00 10.00 H new ATOM 0 HE22 GLN A 75 1.967 15.895 -5.965 1.00 10.00 H new ATOM 974 N LEU A 76 -2.268 12.506 -3.039 1.00 10.00 N ATOM 975 CA LEU A 76 -3.108 11.791 -3.992 1.00 10.00 C ATOM 976 C LEU A 76 -4.581 12.167 -3.849 1.00 10.00 C ATOM 977 O LEU A 76 -5.439 11.558 -4.486 1.00 10.00 O ATOM 978 CB LEU A 76 -2.936 10.281 -3.816 1.00 10.00 C ATOM 979 CG LEU A 76 -1.597 9.708 -4.291 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.567 8.204 -4.091 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.351 10.056 -5.750 1.00 10.00 C ATOM 0 H LEU A 76 -2.112 12.012 -2.161 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.788 12.081 -4.993 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -3.060 10.040 -2.760 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.738 9.777 -4.355 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.801 10.154 -3.695 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.610 7.811 -4.433 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.697 7.975 -3.033 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.373 7.745 -4.663 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.395 9.640 -6.067 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.150 9.639 -6.363 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.332 11.139 -5.867 1.00 10.00 H new ATOM 993 N GLU A 77 -4.863 13.170 -3.018 1.00 10.00 N ATOM 994 CA GLU A 77 -6.232 13.635 -2.791 1.00 10.00 C ATOM 995 C GLU A 77 -7.105 12.520 -2.213 1.00 10.00 C ATOM 996 O GLU A 77 -8.246 12.315 -2.635 1.00 10.00 O ATOM 997 CB GLU A 77 -6.841 14.172 -4.089 1.00 10.00 C ATOM 998 CG GLU A 77 -6.180 15.450 -4.586 1.00 10.00 C ATOM 999 CD GLU A 77 -6.317 16.593 -3.604 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -5.403 16.781 -2.774 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -7.337 17.311 -3.658 1.00 10.00 O ATOM 0 H GLU A 77 -4.156 13.679 -2.487 1.00 10.00 H new ATOM 0 HA GLU A 77 -6.193 14.445 -2.063 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.762 13.407 -4.862 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.903 14.359 -3.933 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -5.123 15.260 -4.772 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -6.624 15.738 -5.539 1.00 10.00 H new ATOM 1008 N MET A 78 -6.553 11.805 -1.245 1.00 10.00 N ATOM 1009 CA MET A 78 -7.264 10.720 -0.591 1.00 10.00 C ATOM 1010 C MET A 78 -8.016 11.260 0.613 1.00 10.00 C ATOM 1011 O MET A 78 -7.482 12.075 1.368 1.00 10.00 O ATOM 1012 CB MET A 78 -6.289 9.622 -0.150 1.00 10.00 C ATOM 1013 CG MET A 78 -5.340 9.172 -1.249 1.00 10.00 C ATOM 1014 SD MET A 78 -4.159 7.930 -0.690 1.00 10.00 S ATOM 1015 CE MET A 78 -5.238 6.513 -0.499 1.00 10.00 C ATOM 0 H MET A 78 -5.608 11.959 -0.894 1.00 10.00 H new ATOM 0 HA MET A 78 -7.971 10.287 -1.298 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.705 9.985 0.696 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.859 8.762 0.201 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.919 8.768 -2.079 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.797 10.037 -1.630 1.00 10.00 H new ATOM 0 HE1 MET A 78 -5.106 6.087 0.495 1.00 10.00 H new ATOM 0 HE2 MET A 78 -6.275 6.825 -0.625 1.00 10.00 H new ATOM 0 HE3 MET A 78 -4.991 5.763 -1.251 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.248 10.816 0.792 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.055 11.279 1.910 1.00 10.00 C ATOM 1027 C GLU A 79 -10.301 10.160 2.907 1.00 10.00 C ATOM 1028 O GLU A 79 -9.825 9.038 2.730 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.387 11.848 1.420 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.271 13.251 0.842 1.00 10.00 C ATOM 1031 CD GLU A 79 -10.494 14.201 1.740 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -10.733 14.214 2.968 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -9.642 14.944 1.218 1.00 10.00 O ATOM 0 H GLU A 79 -9.710 10.140 0.183 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.500 12.072 2.412 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.800 11.184 0.661 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.094 11.862 2.249 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.782 13.198 -0.131 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.270 13.653 0.675 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.045 10.477 3.957 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.354 9.507 4.999 1.00 10.00 C ATOM 1042 C ASP A 80 -12.192 8.361 4.443 1.00 10.00 C ATOM 1043 O ASP A 80 -13.174 8.588 3.729 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.091 10.182 6.159 1.00 10.00 C ATOM 1045 CG ASP A 80 -12.252 9.273 7.362 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -11.228 8.872 7.952 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -13.408 8.976 7.736 1.00 10.00 O ATOM 0 H ASP A 80 -11.447 11.402 4.111 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.413 9.099 5.369 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.547 11.078 6.457 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.075 10.505 5.819 1.00 10.00 H new ATOM 1052 N GLU A 81 -11.768 7.142 4.762 1.00 10.00 N ATOM 1053 CA GLU A 81 -12.434 5.910 4.337 1.00 10.00 C ATOM 1054 C GLU A 81 -12.231 5.643 2.850 1.00 10.00 C ATOM 1055 O GLU A 81 -13.076 5.019 2.201 1.00 10.00 O ATOM 1056 CB GLU A 81 -13.925 5.939 4.674 1.00 10.00 C ATOM 1057 CG GLU A 81 -14.219 5.776 6.154 1.00 10.00 C ATOM 1058 CD GLU A 81 -15.685 5.528 6.421 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -16.240 6.154 7.348 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -16.290 4.708 5.697 1.00 10.00 O ATOM 0 H GLU A 81 -10.939 6.977 5.332 1.00 10.00 H new ATOM 0 HA GLU A 81 -11.973 5.093 4.891 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.348 6.883 4.330 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -14.429 5.145 4.123 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -13.634 4.946 6.550 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -13.901 6.672 6.687 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.102 6.093 2.316 1.00 10.00 N ATOM 1068 CA ASP A 82 -10.798 5.876 0.906 1.00 10.00 C ATOM 1069 C ASP A 82 -10.459 4.405 0.670 1.00 10.00 C ATOM 1070 O ASP A 82 -10.327 3.639 1.624 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.651 6.772 0.441 1.00 10.00 C ATOM 1072 CG ASP A 82 -9.899 7.315 -0.950 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -10.378 6.542 -1.810 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -9.637 8.515 -1.185 1.00 10.00 O ATOM 0 H ASP A 82 -10.387 6.606 2.832 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.679 6.138 0.320 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.529 7.600 1.139 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.719 6.206 0.451 1.00 10.00 H new ATOM 1079 N THR A 83 -10.305 4.006 -0.584 1.00 10.00 N ATOM 1080 CA THR A 83 -10.018 2.611 -0.896 1.00 10.00 C ATOM 1081 C THR A 83 -8.714 2.445 -1.678 1.00 10.00 C ATOM 1082 O THR A 83 -8.424 3.207 -2.602 1.00 10.00 O ATOM 1083 CB THR A 83 -11.175 1.987 -1.701 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.423 2.546 -1.262 1.00 10.00 O ATOM 1085 CG2 THR A 83 -11.205 0.474 -1.530 1.00 10.00 C ATOM 0 H THR A 83 -10.373 4.620 -1.396 1.00 10.00 H new ATOM 0 HA THR A 83 -9.908 2.095 0.058 1.00 10.00 H new ATOM 0 HB THR A 83 -11.020 2.211 -2.756 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.158 2.150 -1.776 1.00 10.00 H new ATOM 0 HG21 THR A 83 -12.030 0.059 -2.108 1.00 10.00 H new ATOM 0 HG22 THR A 83 -10.265 0.049 -1.883 1.00 10.00 H new ATOM 0 HG23 THR A 83 -11.341 0.230 -0.476 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.927 1.449 -1.284 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.662 1.142 -1.939 1.00 10.00 C ATOM 1095 C ILE A 84 -6.700 -0.283 -2.496 1.00 10.00 C ATOM 1096 O ILE A 84 -7.174 -1.202 -1.823 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.471 1.286 -0.962 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.443 2.699 -0.368 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.155 0.978 -1.667 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.389 2.897 0.700 1.00 10.00 C ATOM 0 H ILE A 84 -8.149 0.833 -0.502 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.522 1.854 -2.753 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.599 0.568 -0.152 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.271 3.416 -1.171 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.422 2.923 0.056 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.331 1.085 -0.962 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -4.176 -0.043 -2.048 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -4.016 1.671 -2.496 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.434 3.921 1.070 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.571 2.206 1.523 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.402 2.706 0.277 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.223 -0.457 -3.724 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.216 -1.769 -4.371 1.00 10.00 C ATOM 1114 C ASP A 85 -4.862 -2.449 -4.226 1.00 10.00 C ATOM 1115 O ASP A 85 -3.818 -1.811 -4.375 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.550 -1.643 -5.860 1.00 10.00 C ATOM 1117 CG ASP A 85 -8.019 -1.387 -6.122 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -8.813 -2.352 -6.117 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -8.390 -0.215 -6.338 1.00 10.00 O ATOM 0 H ASP A 85 -5.835 0.294 -4.294 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.975 -2.375 -3.876 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -5.964 -0.831 -6.290 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.250 -2.558 -6.372 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.886 -3.744 -3.937 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.662 -4.524 -3.789 1.00 10.00 C ATOM 1126 C VAL A 86 -3.580 -5.586 -4.881 1.00 10.00 C ATOM 1127 O VAL A 86 -4.522 -6.354 -5.082 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.585 -5.213 -2.409 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -2.232 -5.886 -2.216 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.853 -4.215 -1.293 1.00 10.00 C ATOM 0 H VAL A 86 -5.743 -4.279 -3.800 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.824 -3.832 -3.876 1.00 10.00 H new ATOM 0 HB VAL A 86 -4.356 -5.982 -2.370 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -2.200 -6.365 -1.237 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -2.085 -6.637 -2.992 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -1.441 -5.138 -2.280 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -3.794 -4.722 -0.330 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -3.109 -3.419 -1.331 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.848 -3.788 -1.418 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.463 -5.617 -5.593 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.263 -6.580 -6.667 1.00 10.00 C ATOM 1142 C PHE A 87 -0.977 -7.369 -6.455 1.00 10.00 C ATOM 1143 O PHE A 87 -0.108 -6.959 -5.683 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.212 -5.869 -8.023 1.00 10.00 C ATOM 1145 CG PHE A 87 -3.525 -5.269 -8.436 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -4.498 -6.047 -9.042 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -3.787 -3.926 -8.217 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -5.708 -5.495 -9.419 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -4.995 -3.374 -8.592 1.00 10.00 C ATOM 1150 CZ PHE A 87 -5.955 -4.158 -9.193 1.00 10.00 C ATOM 0 H PHE A 87 -1.678 -4.983 -5.446 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.105 -7.272 -6.657 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.459 -5.082 -7.983 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -1.891 -6.579 -8.785 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.309 -7.095 -9.222 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.038 -3.305 -7.748 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -6.459 -6.111 -9.890 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.188 -2.326 -8.414 1.00 10.00 H new ATOM 0 HZ PHE A 87 -6.900 -3.726 -9.487 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.863 -8.497 -7.143 1.00 10.00 N ATOM 1161 CA GLN A 88 0.316 -9.348 -7.045 1.00 10.00 C ATOM 1162 C GLN A 88 1.092 -9.318 -8.355 1.00 10.00 C ATOM 1163 O GLN A 88 0.499 -9.195 -9.429 1.00 10.00 O ATOM 1164 CB GLN A 88 -0.090 -10.788 -6.716 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.372 -11.023 -5.241 1.00 10.00 C ATOM 1166 CD GLN A 88 0.860 -11.471 -4.475 1.00 10.00 C ATOM 1167 OE1 GLN A 88 1.986 -11.118 -4.821 1.00 10.00 O ATOM 1168 NE2 GLN A 88 0.654 -12.258 -3.431 1.00 10.00 N ATOM 0 H GLN A 88 -1.579 -8.846 -7.780 1.00 10.00 H new ATOM 0 HA GLN A 88 0.951 -8.970 -6.244 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.979 -11.046 -7.292 1.00 10.00 H new ATOM 0 HB3 GLN A 88 0.704 -11.462 -7.037 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -0.757 -10.105 -4.798 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.152 -11.777 -5.140 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -0.296 -12.529 -3.176 1.00 10.00 H new ATOM 0 HE22 GLN A 88 1.445 -12.594 -2.882 1.00 10.00 H new ATOM 1177 N GLN A 89 2.410 -9.411 -8.264 1.00 10.00 N ATOM 1178 CA GLN A 89 3.256 -9.402 -9.450 1.00 10.00 C ATOM 1179 C GLN A 89 3.250 -10.776 -10.108 1.00 10.00 C ATOM 1180 O GLN A 89 3.291 -11.801 -9.424 1.00 10.00 O ATOM 1181 CB GLN A 89 4.690 -8.996 -9.089 1.00 10.00 C ATOM 1182 CG GLN A 89 5.583 -8.742 -10.296 1.00 10.00 C ATOM 1183 CD GLN A 89 5.093 -7.594 -11.161 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.514 -6.627 -10.667 1.00 10.00 O ATOM 1185 NE2 GLN A 89 5.320 -7.697 -12.458 1.00 10.00 N ATOM 0 H GLN A 89 2.917 -9.493 -7.383 1.00 10.00 H new ATOM 0 HA GLN A 89 2.857 -8.670 -10.153 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.659 -8.095 -8.477 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.136 -9.781 -8.478 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.595 -8.527 -9.954 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.637 -9.648 -10.899 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.804 -8.515 -12.828 1.00 10.00 H new ATOM 0 HE22 GLN A 89 5.012 -6.958 -13.090 1.00 10.00 H new ATOM 1194 N GLN A 90 3.190 -10.784 -11.433 1.00 10.00 N ATOM 1195 CA GLN A 90 3.173 -12.018 -12.208 1.00 10.00 C ATOM 1196 C GLN A 90 4.418 -12.853 -11.922 1.00 10.00 C ATOM 1197 O GLN A 90 5.512 -12.314 -11.725 1.00 10.00 O ATOM 1198 CB GLN A 90 3.088 -11.704 -13.708 1.00 10.00 C ATOM 1199 CG GLN A 90 1.737 -11.155 -14.159 1.00 10.00 C ATOM 1200 CD GLN A 90 1.460 -9.752 -13.648 1.00 10.00 C ATOM 1201 OE1 GLN A 90 2.378 -8.972 -13.405 1.00 10.00 O ATOM 1202 NE2 GLN A 90 0.190 -9.428 -13.481 1.00 10.00 N ATOM 0 H GLN A 90 3.152 -9.937 -12.000 1.00 10.00 H new ATOM 0 HA GLN A 90 2.294 -12.592 -11.914 1.00 10.00 H new ATOM 0 HB2 GLN A 90 3.864 -10.981 -13.960 1.00 10.00 H new ATOM 0 HB3 GLN A 90 3.304 -12.612 -14.270 1.00 10.00 H new ATOM 0 HG2 GLN A 90 1.699 -11.152 -15.248 1.00 10.00 H new ATOM 0 HG3 GLN A 90 0.947 -11.823 -13.814 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -0.542 -10.106 -13.695 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -0.059 -8.500 -13.138 1.00 10.00 H new ATOM 1211 N THR A 91 4.246 -14.165 -11.892 1.00 10.00 N ATOM 1212 CA THR A 91 5.345 -15.076 -11.624 1.00 10.00 C ATOM 1213 C THR A 91 6.151 -15.356 -12.887 1.00 10.00 C ATOM 1214 O THR A 91 7.377 -15.475 -12.838 1.00 10.00 O ATOM 1215 CB THR A 91 4.825 -16.401 -11.043 1.00 10.00 C ATOM 1216 OG1 THR A 91 3.500 -16.659 -11.530 1.00 10.00 O ATOM 1217 CG2 THR A 91 4.809 -16.353 -9.526 1.00 10.00 C ATOM 0 H THR A 91 3.349 -14.624 -12.051 1.00 10.00 H new ATOM 0 HA THR A 91 5.996 -14.595 -10.894 1.00 10.00 H new ATOM 0 HB THR A 91 5.493 -17.202 -11.360 1.00 10.00 H new ATOM 0 HG1 THR A 91 3.174 -17.505 -11.158 1.00 10.00 H new ATOM 0 HG21 THR A 91 4.438 -17.301 -9.136 1.00 10.00 H new ATOM 0 HG22 THR A 91 5.820 -16.180 -9.157 1.00 10.00 H new ATOM 0 HG23 THR A 91 4.158 -15.544 -9.194 1.00 10.00 H new ATOM 1225 N GLY A 92 5.458 -15.446 -14.014 1.00 10.00 N ATOM 1226 CA GLY A 92 6.117 -15.718 -15.271 1.00 10.00 C ATOM 1227 C GLY A 92 5.326 -15.185 -16.441 1.00 10.00 C ATOM 1228 O GLY A 92 4.685 -14.129 -16.289 1.00 10.00 O ATOM 0 H GLY A 92 4.446 -15.334 -14.078 1.00 10.00 H new ATOM 0 HA2 GLY A 92 7.110 -15.267 -15.267 1.00 10.00 H new ATOM 0 HA3 GLY A 92 6.255 -16.793 -15.384 1.00 10.00 H new TER 1232 GLY A 92 ATOM 1233 N ASN B 357 -15.200 -10.605 5.936 1.00 10.00 N ATOM 1234 CA ASN B 357 -13.968 -9.789 5.880 1.00 10.00 C ATOM 1235 C ASN B 357 -13.574 -9.347 7.273 1.00 10.00 C ATOM 1236 O ASN B 357 -14.397 -9.339 8.188 1.00 10.00 O ATOM 1237 CB ASN B 357 -14.159 -8.555 4.996 1.00 10.00 C ATOM 1238 CG ASN B 357 -15.178 -7.573 5.547 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -14.857 -6.729 6.387 1.00 10.00 O ATOM 1240 ND2 ASN B 357 -16.406 -7.657 5.063 1.00 10.00 N ATOM 0 HA ASN B 357 -13.180 -10.407 5.450 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -13.201 -8.048 4.881 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -14.473 -8.874 4.002 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -17.126 -7.010 5.384 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -16.633 -8.369 4.369 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.314 -8.987 7.437 1.00 10.00 N ATOM 1248 CA ASN B 358 -11.827 -8.545 8.730 1.00 10.00 C ATOM 1249 C ASN B 358 -11.260 -7.141 8.653 1.00 10.00 C ATOM 1250 O ASN B 358 -10.466 -6.836 7.762 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.779 -9.523 9.283 1.00 10.00 C ATOM 1252 CG ASN B 358 -9.599 -9.741 8.347 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -8.608 -9.008 8.384 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -9.693 -10.764 7.515 1.00 10.00 N ATOM 0 H ASN B 358 -11.613 -8.992 6.696 1.00 10.00 H new ATOM 0 HA ASN B 358 -12.675 -8.527 9.415 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -10.411 -9.147 10.238 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -11.257 -10.482 9.481 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -8.928 -10.971 6.872 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -10.530 -11.347 7.516 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.698 -6.274 9.562 1.00 10.00 N ATOM 1262 CA ARG B 359 -11.197 -4.912 9.594 1.00 10.00 C ATOM 1263 C ARG B 359 -10.578 -4.598 10.957 1.00 10.00 C ATOM 1264 O ARG B 359 -11.221 -4.726 12.002 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.324 -3.917 9.285 1.00 10.00 C ATOM 1266 CG ARG B 359 -13.555 -4.092 10.153 1.00 10.00 C ATOM 1267 CD ARG B 359 -14.660 -3.138 9.737 1.00 10.00 C ATOM 1268 NE ARG B 359 -15.906 -3.410 10.444 1.00 10.00 N ATOM 1269 CZ ARG B 359 -16.851 -4.230 9.993 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -16.728 -4.800 8.798 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -17.931 -4.463 10.729 1.00 10.00 N ATOM 0 H ARG B 359 -12.392 -6.491 10.277 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.425 -4.815 8.830 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -11.944 -2.903 9.411 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -12.611 -4.022 8.239 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -13.911 -5.119 10.080 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -13.295 -3.918 11.197 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -14.347 -2.112 9.933 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -14.826 -3.221 8.663 1.00 10.00 H new ATOM 0 HE ARG B 359 -16.062 -2.944 11.338 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -15.907 -4.609 8.224 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -17.455 -5.428 8.455 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -18.035 -4.013 11.639 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -18.657 -5.092 10.385 1.00 10.00 H new ATOM 1285 N ASP B 360 -9.315 -4.224 10.924 1.00 10.00 N ATOM 1286 CA ASP B 360 -8.550 -3.852 12.110 1.00 10.00 C ATOM 1287 C ASP B 360 -7.870 -2.513 11.854 1.00 10.00 C ATOM 1288 O ASP B 360 -7.458 -2.254 10.720 1.00 10.00 O ATOM 1289 CB ASP B 360 -7.568 -4.946 12.531 1.00 10.00 C ATOM 1290 CG ASP B 360 -6.200 -4.804 11.912 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -6.021 -5.253 10.765 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -5.292 -4.266 12.585 1.00 10.00 O ATOM 0 H ASP B 360 -8.777 -4.167 10.060 1.00 10.00 H new ATOM 0 HA ASP B 360 -9.228 -3.742 12.957 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -7.469 -4.935 13.616 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -7.981 -5.917 12.259 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.744 -1.622 12.848 1.00 10.00 N ATOM 1298 CA PRO B 361 -7.149 -0.318 12.619 1.00 10.00 C ATOM 1299 C PRO B 361 -5.703 -0.233 13.104 1.00 10.00 C ATOM 1300 O PRO B 361 -5.364 -0.578 14.238 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.047 0.579 13.479 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.575 -0.305 14.578 1.00 10.00 C ATOM 1303 CD PRO B 361 -8.248 -1.740 14.217 1.00 10.00 C ATOM 0 HA PRO B 361 -7.099 -0.055 11.562 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.485 1.418 13.888 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -8.862 0.998 12.889 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -8.122 -0.039 15.533 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.652 -0.175 14.689 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.502 -2.166 14.888 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -9.128 -2.381 14.270 1.00 10.00 H new ATOM 1311 N ILE B 362 -4.864 0.238 12.187 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.430 0.364 12.388 1.00 10.00 C ATOM 1313 C ILE B 362 -3.009 1.819 12.302 1.00 10.00 C ATOM 1314 O ILE B 362 -3.431 2.533 11.397 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.651 -0.433 11.318 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.375 -1.744 10.989 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.226 -0.706 11.778 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -3.192 -2.182 9.553 1.00 10.00 C ATOM 0 H ILE B 362 -5.171 0.548 11.265 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.202 -0.033 13.377 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.604 0.170 10.411 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -3.010 -2.529 11.651 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -4.439 -1.625 11.193 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.697 -1.268 11.009 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.713 0.240 11.954 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.246 -1.285 12.701 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -3.729 -3.116 9.386 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -3.583 -1.414 8.886 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -2.132 -2.332 9.351 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.188 2.261 13.233 1.00 10.00 N ATOM 1331 CA VAL B 363 -1.748 3.642 13.244 1.00 10.00 C ATOM 1332 C VAL B 363 -0.250 3.719 12.997 1.00 10.00 C ATOM 1333 O VAL B 363 0.538 3.043 13.661 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.052 4.315 14.598 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -1.686 5.791 14.571 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -3.509 4.122 14.989 1.00 10.00 C ATOM 0 H VAL B 363 -1.813 1.687 13.989 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.289 4.162 12.454 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.435 3.832 15.356 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -1.911 6.239 15.539 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -0.622 5.898 14.360 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.262 6.295 13.795 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -3.696 4.606 15.947 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.152 4.564 14.228 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -3.725 3.057 15.073 1.00 10.00 H new ATOM 1346 N ILE B 364 0.133 4.545 12.036 1.00 10.00 N ATOM 1347 CA ILE B 364 1.534 4.731 11.694 1.00 10.00 C ATOM 1348 C ILE B 364 1.931 6.185 11.890 1.00 10.00 C ATOM 1349 O ILE B 364 1.232 7.094 11.439 1.00 10.00 O ATOM 1350 CB ILE B 364 1.844 4.324 10.235 1.00 10.00 C ATOM 1351 CG1 ILE B 364 1.415 2.883 9.970 1.00 10.00 C ATOM 1352 CG2 ILE B 364 3.328 4.491 9.938 1.00 10.00 C ATOM 1353 CD1 ILE B 364 1.513 2.481 8.511 1.00 10.00 C ATOM 0 H ILE B 364 -0.513 5.101 11.475 1.00 10.00 H new ATOM 0 HA ILE B 364 2.108 4.084 12.357 1.00 10.00 H new ATOM 0 HB ILE B 364 1.277 4.980 9.574 1.00 10.00 H new ATOM 0 HG12 ILE B 364 2.034 2.213 10.566 1.00 10.00 H new ATOM 0 HG13 ILE B 364 0.387 2.751 10.307 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.528 4.200 8.907 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.613 5.533 10.083 1.00 10.00 H new ATOM 0 HG23 ILE B 364 3.907 3.860 10.612 1.00 10.00 H new ATOM 0 HD11 ILE B 364 1.193 1.445 8.397 1.00 10.00 H new ATOM 0 HD12 ILE B 364 0.872 3.127 7.912 1.00 10.00 H new ATOM 0 HD13 ILE B 364 2.545 2.581 8.175 1.00 10.00 H new ATOM 1365 N SER B 365 3.031 6.396 12.589 1.00 10.00 N ATOM 1366 CA SER B 365 3.533 7.737 12.835 1.00 10.00 C ATOM 1367 C SER B 365 4.930 7.881 12.240 1.00 10.00 C ATOM 1368 O SER B 365 5.801 7.032 12.461 1.00 10.00 O ATOM 1369 CB SER B 365 3.542 8.024 14.339 1.00 10.00 C ATOM 1370 OG SER B 365 2.317 7.624 14.928 1.00 10.00 O ATOM 0 H SER B 365 3.597 5.653 12.998 1.00 10.00 H new ATOM 0 HA SER B 365 2.879 8.465 12.355 1.00 10.00 H new ATOM 0 HB2 SER B 365 4.369 7.494 14.811 1.00 10.00 H new ATOM 0 HB3 SER B 365 3.705 9.088 14.511 1.00 10.00 H new ATOM 0 HG SER B 365 2.339 7.812 15.889 1.00 10.00 H new ATOM 1376 N ASP B 366 5.137 8.934 11.467 1.00 10.00 N ATOM 1377 CA ASP B 366 6.429 9.167 10.843 1.00 10.00 C ATOM 1378 C ASP B 366 6.999 10.503 11.285 1.00 10.00 C ATOM 1379 O ASP B 366 6.315 11.528 11.234 1.00 10.00 O ATOM 1380 CB ASP B 366 6.324 9.115 9.318 1.00 10.00 C ATOM 1381 CG ASP B 366 7.683 8.987 8.658 1.00 10.00 C ATOM 1382 OD1 ASP B 366 7.860 9.509 7.538 1.00 10.00 O ATOM 1383 OD2 ASP B 366 8.579 8.345 9.250 1.00 10.00 O ATOM 0 H ASP B 366 4.430 9.639 11.257 1.00 10.00 H new ATOM 0 HA ASP B 366 7.103 8.373 11.163 1.00 10.00 H new ATOM 0 HB2 ASP B 366 5.699 8.271 9.026 1.00 10.00 H new ATOM 0 HB3 ASP B 366 5.830 10.017 8.958 1.00 10.00 H new ATOM 1388 N SER B 367 8.245 10.482 11.723 1.00 10.00 N ATOM 1389 CA SER B 367 8.911 11.683 12.185 1.00 10.00 C ATOM 1390 C SER B 367 10.037 12.082 11.232 1.00 10.00 C ATOM 1391 O SER B 367 11.014 11.343 11.073 1.00 10.00 O ATOM 1392 CB SER B 367 9.472 11.447 13.588 1.00 10.00 C ATOM 1393 OG SER B 367 10.118 10.185 13.665 1.00 10.00 O ATOM 0 H SER B 367 8.818 9.639 11.768 1.00 10.00 H new ATOM 0 HA SER B 367 8.186 12.496 12.213 1.00 10.00 H new ATOM 0 HB2 SER B 367 10.178 12.238 13.841 1.00 10.00 H new ATOM 0 HB3 SER B 367 8.666 11.494 14.320 1.00 10.00 H new ATOM 0 HG SER B 367 10.677 10.055 12.871 1.00 10.00 H new ATOM 1399 N PRO B 368 9.910 13.245 10.575 1.00 10.00 N ATOM 1400 CA PRO B 368 10.922 13.742 9.645 1.00 10.00 C ATOM 1401 C PRO B 368 12.139 14.311 10.371 1.00 10.00 C ATOM 1402 O PRO B 368 11.958 15.051 11.361 1.00 10.00 O ATOM 1403 CB PRO B 368 10.186 14.840 8.876 1.00 10.00 C ATOM 1404 CG PRO B 368 9.136 15.329 9.812 1.00 10.00 C ATOM 1405 CD PRO B 368 8.753 14.157 10.678 1.00 10.00 C ATOM 0 HA PRO B 368 11.318 12.953 9.005 1.00 10.00 H new ATOM 0 HB2 PRO B 368 10.864 15.644 8.589 1.00 10.00 H new ATOM 0 HB3 PRO B 368 9.746 14.451 7.958 1.00 10.00 H new ATOM 0 HG2 PRO B 368 9.511 16.153 10.419 1.00 10.00 H new ATOM 0 HG3 PRO B 368 8.272 15.704 9.264 1.00 10.00 H new ATOM 0 HD2 PRO B 368 8.576 14.463 11.709 1.00 10.00 H new ATOM 0 HD3 PRO B 368 7.837 13.682 10.325 1.00 10.00 H new TER 1413 PRO B 368