USER MOD reduce.3.24.130724 H: found=0, std=0, add=1097, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1093 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 NoAdj : A 60 ASNHD21 : A 60 ASN OD1 : A 152 CACA :(metal ligand) USER MOD NoAdj : A 60 ASNHD22 : A 60 ASN OD1 : A 152 CACA :(metal ligand) USER MOD Set 1.1: A 94 LYS NZ :NH3+ -165:sc= 0.0107 (180deg=0) USER MOD Set 1.2: A 107 HIS : no HE2:sc= -0.149 X(o=-0.14,f=0) USER MOD Set 2.1: A 49 GLN : amide:sc= 1.15 K(o=2.2,f=-0.077) USER MOD Set 2.2: A 53 ASN : amide:sc= 1.07 K(o=2.2,f=-0.13) USER MOD Set 3.1: A 5 THR OG1 : rot 164:sc= 1.66 USER MOD Set 3.2: A 8 GLN : amide:sc= 0.388 K(o=2.1,f=0.37) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -49:sc= 0.606 USER MOD Single : A 28 THR OG1 : rot -85:sc= 1.25 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot -60:sc= 1.13 USER MOD Single : A 51 MET CE :methyl -173:sc= -1.76 (180deg=-1.99) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 75:sc= 0.298 USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -125:sc= -0.447 (180deg=-1.27) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 174:sc= 0 (180deg=-0.141) USER MOD Single : A 77 LYS NZ :NH3+ 148:sc= 1.22 (180deg=-0.207!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= 0.3 K(o=0.3,f=-2.5!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -59:sc= 1.23 USER MOD Single : A 109 MET CE :methyl -179:sc= -0.0325 (180deg=-0.037) USER MOD Single : A 110 THR OG1 : rot 62:sc= 1.32 USER MOD Single : A 111 ASN : amide:sc= -0.011 K(o=-0.011,f=-0.94) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= 0.526 K(o=0.53,f=0) USER MOD Single : A 137 ASN : amide:sc= -0.306 K(o=-0.31,f=-6.3!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 144 MET CE :methyl -151:sc= -0.0296 (180deg=-1.33) USER MOD Single : A 145 MET CE :methyl 151:sc= -0.72 (180deg=-1.17) USER MOD Single : A 146 THR OG1 : rot 180:sc=-0.00535 USER MOD Single : A 148 LYS NZ :NH3+ -165:sc= 1.17 (180deg=0.948) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -8.254 13.037 13.912 1.00 0.00 N ATOM 2 CA ALA A 1 -8.341 12.660 12.484 1.00 0.00 C ATOM 3 C ALA A 1 -8.468 13.789 11.519 1.00 0.00 C ATOM 4 O ALA A 1 -8.586 14.987 11.773 1.00 0.00 O ATOM 5 CB ALA A 1 -9.501 11.667 12.299 1.00 0.00 C ATOM 0 H1 ALA A 1 -8.169 12.179 14.493 1.00 0.00 H new ATOM 0 H2 ALA A 1 -7.420 13.641 14.062 1.00 0.00 H new ATOM 0 H3 ALA A 1 -9.112 13.557 14.187 1.00 0.00 H new ATOM 0 HA ALA A 1 -7.379 12.208 12.241 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -9.573 11.383 11.249 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -9.319 10.778 12.903 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -10.434 12.135 12.613 1.00 0.00 H new ATOM 10 N ASP A 2 -8.411 13.449 10.219 1.00 0.00 N ATOM 11 CA ASP A 2 -8.376 14.435 9.184 1.00 0.00 C ATOM 12 C ASP A 2 -9.625 14.212 8.403 1.00 0.00 C ATOM 13 O ASP A 2 -10.279 13.179 8.538 1.00 0.00 O ATOM 14 CB ASP A 2 -7.053 14.358 8.404 1.00 0.00 C ATOM 15 CG ASP A 2 -6.653 15.648 7.703 1.00 0.00 C ATOM 16 OD1 ASP A 2 -7.498 16.582 7.682 1.00 0.00 O ATOM 17 OD2 ASP A 2 -5.554 15.657 7.087 1.00 0.00 O ATOM 0 H ASP A 2 -8.389 12.486 9.883 1.00 0.00 H new ATOM 0 HA ASP A 2 -8.373 15.465 9.540 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -6.257 14.072 9.092 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -7.131 13.565 7.660 1.00 0.00 H new ATOM 22 N GLN A 3 -9.953 15.051 7.404 1.00 0.00 N ATOM 23 CA GLN A 3 -11.202 14.864 6.733 1.00 0.00 C ATOM 24 C GLN A 3 -11.061 14.799 5.251 1.00 0.00 C ATOM 25 O GLN A 3 -10.240 15.535 4.706 1.00 0.00 O ATOM 26 CB GLN A 3 -12.224 15.957 7.087 1.00 0.00 C ATOM 27 CG GLN A 3 -12.000 16.343 8.550 1.00 0.00 C ATOM 28 CD GLN A 3 -13.261 17.024 9.063 1.00 0.00 C ATOM 29 OE1 GLN A 3 -13.974 16.546 9.944 1.00 0.00 O ATOM 30 NE2 GLN A 3 -13.629 18.127 8.359 1.00 0.00 N ATOM 0 H GLN A 3 -9.381 15.827 7.071 1.00 0.00 H new ATOM 0 HA GLN A 3 -11.568 13.901 7.089 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -12.098 16.824 6.439 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -13.241 15.593 6.938 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -11.777 15.458 9.146 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -11.144 17.012 8.639 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -13.014 18.498 7.635 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -14.520 18.583 8.555 1.00 0.00 H new ATOM 39 N LEU A 4 -11.792 13.941 4.518 1.00 0.00 N ATOM 40 CA LEU A 4 -11.585 13.764 3.114 1.00 0.00 C ATOM 41 C LEU A 4 -11.927 15.022 2.391 1.00 0.00 C ATOM 42 O LEU A 4 -12.654 15.915 2.824 1.00 0.00 O ATOM 43 CB LEU A 4 -12.398 12.565 2.598 1.00 0.00 C ATOM 44 CG LEU A 4 -11.901 11.158 2.968 1.00 0.00 C ATOM 45 CD1 LEU A 4 -12.989 10.071 2.935 1.00 0.00 C ATOM 46 CD2 LEU A 4 -10.678 10.859 2.084 1.00 0.00 C ATOM 0 H LEU A 4 -12.537 13.362 4.905 1.00 0.00 H new ATOM 0 HA LEU A 4 -10.534 13.545 2.926 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -13.419 12.668 2.965 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -12.442 12.631 1.511 1.00 0.00 H new ATOM 0 HG LEU A 4 -11.606 11.140 4.017 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -12.552 9.111 3.209 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -13.779 10.325 3.642 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -13.408 10.006 1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -10.295 9.866 2.317 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -10.969 10.898 1.034 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -9.902 11.601 2.273 1.00 0.00 H new ATOM 58 N THR A 5 -11.360 15.268 1.197 1.00 0.00 N ATOM 59 CA THR A 5 -11.760 16.322 0.317 1.00 0.00 C ATOM 60 C THR A 5 -13.097 16.238 -0.337 1.00 0.00 C ATOM 61 O THR A 5 -13.617 15.140 -0.531 1.00 0.00 O ATOM 62 CB THR A 5 -10.712 16.691 -0.690 1.00 0.00 C ATOM 63 OG1 THR A 5 -10.389 15.531 -1.444 1.00 0.00 O ATOM 64 CG2 THR A 5 -9.390 17.223 -0.111 1.00 0.00 C ATOM 0 H THR A 5 -10.590 14.709 0.829 1.00 0.00 H new ATOM 0 HA THR A 5 -11.880 17.126 1.044 1.00 0.00 H new ATOM 0 HB THR A 5 -11.150 17.500 -1.274 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.907 15.792 -2.256 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.705 17.459 -0.925 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.584 18.123 0.472 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.943 16.464 0.531 1.00 0.00 H new ATOM 72 N GLU A 6 -13.669 17.409 -0.669 1.00 0.00 N ATOM 73 CA GLU A 6 -14.998 17.472 -1.194 1.00 0.00 C ATOM 74 C GLU A 6 -15.288 16.624 -2.383 1.00 0.00 C ATOM 75 O GLU A 6 -16.156 15.756 -2.474 1.00 0.00 O ATOM 76 CB GLU A 6 -15.306 18.922 -1.604 1.00 0.00 C ATOM 77 CG GLU A 6 -15.262 19.876 -0.409 1.00 0.00 C ATOM 78 CD GLU A 6 -15.775 21.241 -0.844 1.00 0.00 C ATOM 79 OE1 GLU A 6 -15.089 22.108 -1.448 1.00 0.00 O ATOM 80 OE2 GLU A 6 -16.992 21.419 -0.570 1.00 0.00 O ATOM 0 H GLU A 6 -13.210 18.315 -0.574 1.00 0.00 H new ATOM 0 HA GLU A 6 -15.618 17.090 -0.383 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -14.586 19.247 -2.355 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -16.292 18.966 -2.067 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -15.872 19.487 0.406 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -14.243 19.960 -0.032 1.00 0.00 H new ATOM 87 N GLU A 7 -14.310 16.637 -3.306 1.00 0.00 N ATOM 88 CA GLU A 7 -14.246 15.882 -4.518 1.00 0.00 C ATOM 89 C GLU A 7 -14.053 14.412 -4.367 1.00 0.00 C ATOM 90 O GLU A 7 -14.350 13.653 -5.289 1.00 0.00 O ATOM 91 CB GLU A 7 -13.232 16.416 -5.544 1.00 0.00 C ATOM 92 CG GLU A 7 -11.724 16.212 -5.387 1.00 0.00 C ATOM 93 CD GLU A 7 -11.068 16.902 -4.200 1.00 0.00 C ATOM 94 OE1 GLU A 7 -11.764 17.719 -3.540 1.00 0.00 O ATOM 95 OE2 GLU A 7 -9.900 16.550 -3.886 1.00 0.00 O ATOM 0 H GLU A 7 -13.489 17.232 -3.191 1.00 0.00 H new ATOM 0 HA GLU A 7 -15.255 16.033 -4.901 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -13.507 15.987 -6.508 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -13.396 17.491 -5.615 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -11.530 15.142 -5.310 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -11.236 16.560 -6.297 1.00 0.00 H new ATOM 102 N GLN A 8 -13.540 13.948 -3.214 1.00 0.00 N ATOM 103 CA GLN A 8 -13.437 12.567 -2.857 1.00 0.00 C ATOM 104 C GLN A 8 -14.826 12.135 -2.534 1.00 0.00 C ATOM 105 O GLN A 8 -15.282 11.189 -3.174 1.00 0.00 O ATOM 106 CB GLN A 8 -12.346 12.379 -1.790 1.00 0.00 C ATOM 107 CG GLN A 8 -10.990 12.319 -2.495 1.00 0.00 C ATOM 108 CD GLN A 8 -9.813 11.941 -1.607 1.00 0.00 C ATOM 109 OE1 GLN A 8 -9.503 10.771 -1.385 1.00 0.00 O ATOM 110 NE2 GLN A 8 -8.982 12.936 -1.198 1.00 0.00 N ATOM 0 H GLN A 8 -13.177 14.570 -2.492 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.085 11.905 -3.648 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -12.367 13.203 -1.076 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.521 11.463 -1.225 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -11.054 11.599 -3.311 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -10.788 13.292 -2.943 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.227 13.910 -1.376 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.114 12.708 -0.714 1.00 0.00 H new ATOM 119 N ILE A 9 -15.635 12.817 -1.704 1.00 0.00 N ATOM 120 CA ILE A 9 -17.006 12.573 -1.380 1.00 0.00 C ATOM 121 C ILE A 9 -17.935 12.518 -2.543 1.00 0.00 C ATOM 122 O ILE A 9 -18.734 11.596 -2.705 1.00 0.00 O ATOM 123 CB ILE A 9 -17.637 13.462 -0.350 1.00 0.00 C ATOM 124 CG1 ILE A 9 -16.753 13.623 0.898 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.996 12.902 0.103 1.00 0.00 C ATOM 126 CD1 ILE A 9 -16.908 14.978 1.586 1.00 0.00 C ATOM 0 H ILE A 9 -15.284 13.634 -1.204 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.889 11.582 -0.942 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.765 14.433 -0.828 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -16.996 12.834 1.609 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.710 13.486 0.614 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -19.432 13.565 0.850 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.665 12.832 -0.755 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.855 11.911 0.535 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -16.255 15.020 2.458 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -16.637 15.772 0.891 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -17.943 15.110 1.901 1.00 0.00 H new ATOM 138 N ALA A 10 -17.895 13.424 -3.536 1.00 0.00 N ATOM 139 CA ALA A 10 -18.611 13.538 -4.768 1.00 0.00 C ATOM 140 C ALA A 10 -18.370 12.432 -5.736 1.00 0.00 C ATOM 141 O ALA A 10 -19.282 12.078 -6.482 1.00 0.00 O ATOM 142 CB ALA A 10 -18.191 14.864 -5.425 1.00 0.00 C ATOM 0 H ALA A 10 -17.246 14.207 -3.451 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.672 13.493 -4.524 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -18.719 14.985 -6.371 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -18.439 15.693 -4.762 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -17.117 14.855 -5.608 1.00 0.00 H new ATOM 148 N GLU A 11 -17.130 11.928 -5.859 1.00 0.00 N ATOM 149 CA GLU A 11 -16.808 10.686 -6.493 1.00 0.00 C ATOM 150 C GLU A 11 -17.247 9.467 -5.757 1.00 0.00 C ATOM 151 O GLU A 11 -17.805 8.512 -6.294 1.00 0.00 O ATOM 152 CB GLU A 11 -15.327 10.737 -6.901 1.00 0.00 C ATOM 153 CG GLU A 11 -14.916 11.815 -7.907 1.00 0.00 C ATOM 154 CD GLU A 11 -13.529 11.509 -8.452 1.00 0.00 C ATOM 155 OE1 GLU A 11 -12.859 10.519 -8.052 1.00 0.00 O ATOM 156 OE2 GLU A 11 -13.107 12.358 -9.282 1.00 0.00 O ATOM 0 H GLU A 11 -16.308 12.412 -5.497 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.406 10.574 -7.397 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -14.732 10.873 -5.998 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -15.057 9.766 -7.317 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.637 11.857 -8.724 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -14.921 12.794 -7.427 1.00 0.00 H new ATOM 163 N PHE A 12 -17.098 9.432 -4.421 1.00 0.00 N ATOM 164 CA PHE A 12 -17.529 8.322 -3.630 1.00 0.00 C ATOM 165 C PHE A 12 -18.986 8.009 -3.598 1.00 0.00 C ATOM 166 O PHE A 12 -19.464 6.878 -3.533 1.00 0.00 O ATOM 167 CB PHE A 12 -16.959 8.362 -2.202 1.00 0.00 C ATOM 168 CG PHE A 12 -15.478 8.480 -2.091 1.00 0.00 C ATOM 169 CD1 PHE A 12 -14.672 7.829 -2.995 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.942 9.018 -0.945 1.00 0.00 C ATOM 171 CE1 PHE A 12 -13.305 7.863 -2.852 1.00 0.00 C ATOM 172 CE2 PHE A 12 -13.575 9.168 -0.909 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.736 8.563 -1.814 1.00 0.00 C ATOM 0 H PHE A 12 -16.672 10.186 -3.882 1.00 0.00 H new ATOM 0 HA PHE A 12 -17.100 7.489 -4.187 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -17.411 9.203 -1.676 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -17.271 7.456 -1.682 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -15.114 7.289 -3.820 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.565 9.309 -0.112 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.676 7.339 -3.557 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -13.143 9.787 -0.137 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.663 8.635 -1.713 1.00 0.00 H new ATOM 183 N LYS A 13 -19.827 9.042 -3.407 1.00 0.00 N ATOM 184 CA LYS A 13 -21.219 8.773 -3.223 1.00 0.00 C ATOM 185 C LYS A 13 -21.891 8.252 -4.447 1.00 0.00 C ATOM 186 O LYS A 13 -22.792 7.415 -4.425 1.00 0.00 O ATOM 187 CB LYS A 13 -22.032 9.877 -2.526 1.00 0.00 C ATOM 188 CG LYS A 13 -22.017 11.269 -3.161 1.00 0.00 C ATOM 189 CD LYS A 13 -22.675 12.408 -2.378 1.00 0.00 C ATOM 190 CE LYS A 13 -23.114 13.630 -3.187 1.00 0.00 C ATOM 191 NZ LYS A 13 -24.181 14.410 -2.521 1.00 0.00 N ATOM 0 H LYS A 13 -19.558 10.026 -3.380 1.00 0.00 H new ATOM 0 HA LYS A 13 -21.210 7.960 -2.497 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -23.069 9.545 -2.466 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.667 9.969 -1.503 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -20.978 11.544 -3.346 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -22.507 11.201 -4.132 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -23.549 12.008 -1.864 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -21.977 12.741 -1.609 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -22.252 14.275 -3.357 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -23.466 13.304 -4.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -24.438 15.225 -3.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -25.016 13.807 -2.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -23.840 14.748 -1.598 1.00 0.00 H new ATOM 205 N GLU A 14 -21.330 8.618 -5.613 1.00 0.00 N ATOM 206 CA GLU A 14 -21.631 8.163 -6.935 1.00 0.00 C ATOM 207 C GLU A 14 -21.305 6.723 -7.135 1.00 0.00 C ATOM 208 O GLU A 14 -22.169 5.860 -7.281 1.00 0.00 O ATOM 209 CB GLU A 14 -20.940 9.071 -7.966 1.00 0.00 C ATOM 210 CG GLU A 14 -21.392 10.525 -8.110 1.00 0.00 C ATOM 211 CD GLU A 14 -22.715 10.814 -8.806 1.00 0.00 C ATOM 212 OE1 GLU A 14 -23.720 10.138 -8.460 1.00 0.00 O ATOM 213 OE2 GLU A 14 -22.705 11.704 -9.697 1.00 0.00 O ATOM 0 H GLU A 14 -20.582 9.311 -5.627 1.00 0.00 H new ATOM 0 HA GLU A 14 -22.709 8.234 -7.082 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.876 9.081 -7.731 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -21.046 8.597 -8.942 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -21.444 10.956 -7.110 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -20.611 11.062 -8.648 1.00 0.00 H new ATOM 220 N ALA A 15 -20.018 6.376 -6.954 1.00 0.00 N ATOM 221 CA ALA A 15 -19.422 5.078 -6.892 1.00 0.00 C ATOM 222 C ALA A 15 -20.112 4.034 -6.084 1.00 0.00 C ATOM 223 O ALA A 15 -20.545 2.999 -6.589 1.00 0.00 O ATOM 224 CB ALA A 15 -17.909 5.171 -6.629 1.00 0.00 C ATOM 0 H ALA A 15 -19.310 7.101 -6.837 1.00 0.00 H new ATOM 0 HA ALA A 15 -19.577 4.678 -7.894 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -17.485 4.168 -6.587 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -17.434 5.733 -7.433 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.735 5.678 -5.680 1.00 0.00 H new ATOM 230 N PHE A 16 -20.440 4.362 -4.822 1.00 0.00 N ATOM 231 CA PHE A 16 -21.231 3.632 -3.879 1.00 0.00 C ATOM 232 C PHE A 16 -22.547 3.183 -4.413 1.00 0.00 C ATOM 233 O PHE A 16 -22.945 2.024 -4.310 1.00 0.00 O ATOM 234 CB PHE A 16 -21.538 4.557 -2.690 1.00 0.00 C ATOM 235 CG PHE A 16 -22.197 3.965 -1.492 1.00 0.00 C ATOM 236 CD1 PHE A 16 -21.483 3.142 -0.653 1.00 0.00 C ATOM 237 CD2 PHE A 16 -23.484 4.296 -1.141 1.00 0.00 C ATOM 238 CE1 PHE A 16 -22.057 2.600 0.473 1.00 0.00 C ATOM 239 CE2 PHE A 16 -24.075 3.797 -0.004 1.00 0.00 C ATOM 240 CZ PHE A 16 -23.360 2.919 0.775 1.00 0.00 C ATOM 0 H PHE A 16 -20.112 5.240 -4.419 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.652 2.748 -3.613 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.599 5.006 -2.366 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -22.171 5.367 -3.052 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -20.452 2.917 -0.883 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -24.046 4.966 -1.775 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -21.493 1.934 1.110 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -25.078 4.088 0.271 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.829 2.472 1.639 1.00 0.00 H new ATOM 250 N SER A 17 -23.225 4.059 -5.177 1.00 0.00 N ATOM 251 CA SER A 17 -24.549 3.791 -5.647 1.00 0.00 C ATOM 252 C SER A 17 -24.530 2.977 -6.895 1.00 0.00 C ATOM 253 O SER A 17 -25.310 2.033 -7.007 1.00 0.00 O ATOM 254 CB SER A 17 -25.410 5.063 -5.732 1.00 0.00 C ATOM 255 OG SER A 17 -25.688 5.693 -4.490 1.00 0.00 O ATOM 0 H SER A 17 -22.851 4.961 -5.471 1.00 0.00 H new ATOM 0 HA SER A 17 -25.049 3.173 -4.902 1.00 0.00 H new ATOM 0 HB2 SER A 17 -24.906 5.780 -6.379 1.00 0.00 H new ATOM 0 HB3 SER A 17 -26.355 4.810 -6.212 1.00 0.00 H new ATOM 0 HG SER A 17 -26.237 6.490 -4.643 1.00 0.00 H new ATOM 261 N LEU A 18 -23.564 3.262 -7.786 1.00 0.00 N ATOM 262 CA LEU A 18 -23.297 2.457 -8.938 1.00 0.00 C ATOM 263 C LEU A 18 -22.886 1.037 -8.755 1.00 0.00 C ATOM 264 O LEU A 18 -23.231 0.161 -9.547 1.00 0.00 O ATOM 265 CB LEU A 18 -22.196 3.111 -9.790 1.00 0.00 C ATOM 266 CG LEU A 18 -22.802 4.177 -10.718 1.00 0.00 C ATOM 267 CD1 LEU A 18 -21.763 5.179 -11.247 1.00 0.00 C ATOM 268 CD2 LEU A 18 -23.633 3.609 -11.881 1.00 0.00 C ATOM 0 H LEU A 18 -22.952 4.074 -7.704 1.00 0.00 H new ATOM 0 HA LEU A 18 -24.285 2.415 -9.397 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -21.447 3.566 -9.142 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -21.685 2.351 -10.382 1.00 0.00 H new ATOM 0 HG LEU A 18 -23.494 4.714 -10.069 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -22.254 5.904 -11.895 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -21.298 5.698 -10.409 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -20.999 4.646 -11.813 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -24.022 4.429 -12.484 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -23.003 2.970 -12.500 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -24.463 3.025 -11.484 1.00 0.00 H new ATOM 280 N PHE A 19 -22.136 0.763 -7.673 1.00 0.00 N ATOM 281 CA PHE A 19 -21.654 -0.546 -7.358 1.00 0.00 C ATOM 282 C PHE A 19 -22.678 -1.380 -6.668 1.00 0.00 C ATOM 283 O PHE A 19 -22.623 -2.609 -6.658 1.00 0.00 O ATOM 284 CB PHE A 19 -20.330 -0.581 -6.576 1.00 0.00 C ATOM 285 CG PHE A 19 -19.185 -0.141 -7.421 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.939 -0.641 -8.678 1.00 0.00 C ATOM 287 CD2 PHE A 19 -18.316 0.781 -6.887 1.00 0.00 C ATOM 288 CE1 PHE A 19 -17.923 -0.130 -9.451 1.00 0.00 C ATOM 289 CE2 PHE A 19 -17.185 1.175 -7.563 1.00 0.00 C ATOM 290 CZ PHE A 19 -17.102 0.818 -8.888 1.00 0.00 C ATOM 0 H PHE A 19 -21.856 1.473 -6.997 1.00 0.00 H new ATOM 0 HA PHE A 19 -21.441 -0.979 -8.335 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.406 0.064 -5.700 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -20.148 -1.592 -6.212 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -19.550 -1.444 -9.062 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.526 1.205 -5.916 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.775 -0.463 -10.468 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.401 1.737 -7.077 1.00 0.00 H new ATOM 0 HZ PHE A 19 -16.363 1.301 -9.511 1.00 0.00 H new ATOM 300 N ASP A 20 -23.680 -0.831 -5.958 1.00 0.00 N ATOM 301 CA ASP A 20 -24.753 -1.511 -5.301 1.00 0.00 C ATOM 302 C ASP A 20 -25.646 -2.250 -6.237 1.00 0.00 C ATOM 303 O ASP A 20 -25.975 -1.728 -7.301 1.00 0.00 O ATOM 304 CB ASP A 20 -25.510 -0.562 -4.356 1.00 0.00 C ATOM 305 CG ASP A 20 -26.248 -1.338 -3.275 1.00 0.00 C ATOM 306 OD1 ASP A 20 -27.196 -2.096 -3.612 1.00 0.00 O ATOM 307 OD2 ASP A 20 -25.950 -1.226 -2.056 1.00 0.00 O ATOM 0 H ASP A 20 -23.743 0.179 -5.834 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.307 -2.290 -4.683 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.808 0.132 -3.894 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -26.220 0.035 -4.928 1.00 0.00 H new ATOM 312 N LYS A 21 -25.901 -3.549 -5.999 1.00 0.00 N ATOM 313 CA LYS A 21 -26.639 -4.421 -6.858 1.00 0.00 C ATOM 314 C LYS A 21 -28.104 -4.244 -6.655 1.00 0.00 C ATOM 315 O LYS A 21 -28.870 -4.113 -7.608 1.00 0.00 O ATOM 316 CB LYS A 21 -26.371 -5.904 -6.549 1.00 0.00 C ATOM 317 CG LYS A 21 -27.032 -6.949 -7.450 1.00 0.00 C ATOM 318 CD LYS A 21 -26.541 -6.973 -8.899 1.00 0.00 C ATOM 319 CE LYS A 21 -27.341 -7.975 -9.734 1.00 0.00 C ATOM 320 NZ LYS A 21 -27.090 -7.668 -11.160 1.00 0.00 N ATOM 0 H LYS A 21 -25.571 -4.018 -5.155 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.323 -4.167 -7.870 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -25.293 -6.064 -6.584 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.689 -6.096 -5.524 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -26.870 -7.935 -7.013 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -28.108 -6.774 -7.452 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -26.632 -5.978 -9.334 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -25.484 -7.236 -8.924 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -27.037 -8.996 -9.503 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -28.405 -7.900 -9.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -27.621 -8.334 -11.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -27.399 -6.696 -11.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -26.074 -7.758 -11.361 1.00 0.00 H new ATOM 334 N ASP A 22 -28.588 -4.167 -5.402 1.00 0.00 N ATOM 335 CA ASP A 22 -29.914 -3.750 -5.068 1.00 0.00 C ATOM 336 C ASP A 22 -30.234 -2.317 -5.320 1.00 0.00 C ATOM 337 O ASP A 22 -31.316 -1.855 -5.679 1.00 0.00 O ATOM 338 CB ASP A 22 -30.090 -3.967 -3.556 1.00 0.00 C ATOM 339 CG ASP A 22 -29.462 -5.237 -3.000 1.00 0.00 C ATOM 340 OD1 ASP A 22 -30.095 -6.320 -3.123 1.00 0.00 O ATOM 341 OD2 ASP A 22 -28.377 -5.199 -2.360 1.00 0.00 O ATOM 0 H ASP A 22 -28.028 -4.407 -4.584 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.574 -4.334 -5.709 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -29.664 -3.112 -3.032 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -31.156 -3.980 -3.330 1.00 0.00 H new ATOM 346 N GLY A 23 -29.291 -1.383 -5.098 1.00 0.00 N ATOM 347 CA GLY A 23 -29.417 0.039 -5.016 1.00 0.00 C ATOM 348 C GLY A 23 -29.997 0.368 -3.684 1.00 0.00 C ATOM 349 O GLY A 23 -30.813 1.288 -3.644 1.00 0.00 O ATOM 0 H GLY A 23 -28.321 -1.665 -4.959 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.445 0.516 -5.138 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.058 0.413 -5.815 1.00 0.00 H new ATOM 353 N ASP A 24 -29.647 -0.375 -2.619 1.00 0.00 N ATOM 354 CA ASP A 24 -30.264 -0.126 -1.353 1.00 0.00 C ATOM 355 C ASP A 24 -29.469 0.790 -0.488 1.00 0.00 C ATOM 356 O ASP A 24 -29.994 1.427 0.424 1.00 0.00 O ATOM 357 CB ASP A 24 -30.595 -1.436 -0.619 1.00 0.00 C ATOM 358 CG ASP A 24 -29.394 -2.120 0.018 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.322 -2.228 -0.637 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.471 -2.558 1.197 1.00 0.00 O ATOM 0 H ASP A 24 -28.958 -1.127 -2.630 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.201 0.388 -1.569 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.333 -1.228 0.156 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.059 -2.126 -1.324 1.00 0.00 H new ATOM 365 N GLY A 25 -28.161 0.908 -0.775 1.00 0.00 N ATOM 366 CA GLY A 25 -27.370 1.802 0.012 1.00 0.00 C ATOM 367 C GLY A 25 -26.513 1.109 1.015 1.00 0.00 C ATOM 368 O GLY A 25 -26.003 1.712 1.958 1.00 0.00 O ATOM 0 H GLY A 25 -27.668 0.410 -1.516 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -26.736 2.393 -0.650 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.029 2.499 0.529 1.00 0.00 H new ATOM 372 N THR A 26 -26.389 -0.229 0.972 1.00 0.00 N ATOM 373 CA THR A 26 -25.488 -0.982 1.788 1.00 0.00 C ATOM 374 C THR A 26 -24.719 -1.955 0.962 1.00 0.00 C ATOM 375 O THR A 26 -25.252 -2.772 0.212 1.00 0.00 O ATOM 376 CB THR A 26 -26.073 -1.669 2.987 1.00 0.00 C ATOM 377 OG1 THR A 26 -27.111 -2.604 2.732 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.641 -0.753 4.084 1.00 0.00 C ATOM 0 H THR A 26 -26.940 -0.811 0.342 1.00 0.00 H new ATOM 0 HA THR A 26 -24.832 -0.222 2.212 1.00 0.00 H new ATOM 0 HB THR A 26 -25.167 -2.173 3.325 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.781 -2.196 2.145 1.00 0.00 H new ATOM 0 HG21 THR A 26 -27.035 -1.361 4.898 1.00 0.00 H new ATOM 0 HG22 THR A 26 -25.850 -0.107 4.464 1.00 0.00 H new ATOM 0 HG23 THR A 26 -27.441 -0.141 3.668 1.00 0.00 H new ATOM 386 N ILE A 27 -23.404 -2.101 1.202 1.00 0.00 N ATOM 387 CA ILE A 27 -22.614 -3.077 0.518 1.00 0.00 C ATOM 388 C ILE A 27 -22.455 -4.318 1.327 1.00 0.00 C ATOM 389 O ILE A 27 -21.834 -4.362 2.388 1.00 0.00 O ATOM 390 CB ILE A 27 -21.243 -2.693 0.047 1.00 0.00 C ATOM 391 CG1 ILE A 27 -21.156 -1.175 -0.185 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.891 -3.496 -1.216 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.862 -0.766 -0.887 1.00 0.00 C ATOM 0 H ILE A 27 -22.884 -1.538 1.875 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.211 -3.212 -0.384 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.509 -2.936 0.815 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -22.008 -0.852 -0.783 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.225 -0.659 0.773 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.895 -3.217 -1.559 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.911 -4.561 -0.987 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.618 -3.280 -1.999 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.850 0.315 -1.027 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.008 -1.062 -0.278 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.803 -1.258 -1.858 1.00 0.00 H new ATOM 405 N THR A 28 -22.808 -5.475 0.738 1.00 0.00 N ATOM 406 CA THR A 28 -22.661 -6.774 1.316 1.00 0.00 C ATOM 407 C THR A 28 -21.370 -7.420 0.948 1.00 0.00 C ATOM 408 O THR A 28 -20.538 -6.859 0.237 1.00 0.00 O ATOM 409 CB THR A 28 -23.731 -7.738 0.897 1.00 0.00 C ATOM 410 OG1 THR A 28 -23.827 -7.735 -0.519 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.084 -7.264 1.454 1.00 0.00 C ATOM 0 H THR A 28 -23.219 -5.504 -0.195 1.00 0.00 H new ATOM 0 HA THR A 28 -22.719 -6.581 2.387 1.00 0.00 H new ATOM 0 HB THR A 28 -23.487 -8.733 1.269 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.413 -7.003 -0.806 1.00 0.00 H new ATOM 0 HG21 THR A 28 -25.866 -7.961 1.153 1.00 0.00 H new ATOM 0 HG22 THR A 28 -25.035 -7.222 2.542 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.311 -6.272 1.063 1.00 0.00 H new ATOM 419 N THR A 29 -21.094 -8.657 1.397 1.00 0.00 N ATOM 420 CA THR A 29 -19.974 -9.450 0.996 1.00 0.00 C ATOM 421 C THR A 29 -19.982 -9.836 -0.444 1.00 0.00 C ATOM 422 O THR A 29 -18.919 -9.824 -1.062 1.00 0.00 O ATOM 423 CB THR A 29 -19.664 -10.648 1.843 1.00 0.00 C ATOM 424 OG1 THR A 29 -20.762 -11.537 1.986 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.382 -10.263 3.305 1.00 0.00 C ATOM 0 H THR A 29 -21.687 -9.130 2.079 1.00 0.00 H new ATOM 0 HA THR A 29 -19.159 -8.746 1.165 1.00 0.00 H new ATOM 0 HB THR A 29 -18.817 -11.098 1.326 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.497 -12.297 2.546 1.00 0.00 H new ATOM 0 HG21 THR A 29 -19.162 -11.161 3.882 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.527 -9.588 3.345 1.00 0.00 H new ATOM 0 HG23 THR A 29 -20.256 -9.766 3.726 1.00 0.00 H new ATOM 433 N LYS A 30 -21.166 -10.034 -1.050 1.00 0.00 N ATOM 434 CA LYS A 30 -21.258 -10.473 -2.409 1.00 0.00 C ATOM 435 C LYS A 30 -21.032 -9.277 -3.269 1.00 0.00 C ATOM 436 O LYS A 30 -20.317 -9.400 -4.263 1.00 0.00 O ATOM 437 CB LYS A 30 -22.658 -10.980 -2.791 1.00 0.00 C ATOM 438 CG LYS A 30 -23.311 -12.002 -1.859 1.00 0.00 C ATOM 439 CD LYS A 30 -22.455 -13.253 -1.649 1.00 0.00 C ATOM 440 CE LYS A 30 -22.347 -14.339 -2.721 1.00 0.00 C ATOM 441 NZ LYS A 30 -23.674 -14.815 -3.172 1.00 0.00 N ATOM 0 H LYS A 30 -22.067 -9.889 -0.595 1.00 0.00 H new ATOM 0 HA LYS A 30 -20.538 -11.281 -2.538 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.321 -10.118 -2.864 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -22.598 -11.421 -3.786 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -23.503 -11.534 -0.894 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -24.277 -12.295 -2.270 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -21.441 -12.911 -1.441 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -22.820 -13.738 -0.743 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -21.793 -13.950 -3.575 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -21.776 -15.180 -2.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -23.551 -15.550 -3.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -24.194 -15.211 -2.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -24.211 -14.019 -3.572 1.00 0.00 H new ATOM 455 N GLU A 31 -21.453 -8.097 -2.782 1.00 0.00 N ATOM 456 CA GLU A 31 -21.294 -6.873 -3.504 1.00 0.00 C ATOM 457 C GLU A 31 -19.939 -6.263 -3.389 1.00 0.00 C ATOM 458 O GLU A 31 -19.418 -5.681 -4.339 1.00 0.00 O ATOM 459 CB GLU A 31 -22.283 -5.831 -2.956 1.00 0.00 C ATOM 460 CG GLU A 31 -23.707 -6.172 -3.401 1.00 0.00 C ATOM 461 CD GLU A 31 -24.674 -5.241 -2.685 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.843 -5.453 -1.454 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.245 -4.304 -3.304 1.00 0.00 O ATOM 0 H GLU A 31 -21.909 -7.990 -1.876 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.466 -7.130 -4.549 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.230 -5.805 -1.868 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -22.011 -4.837 -3.312 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.803 -6.060 -4.481 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.938 -7.211 -3.167 1.00 0.00 H new ATOM 470 N LEU A 32 -19.175 -6.417 -2.294 1.00 0.00 N ATOM 471 CA LEU A 32 -17.776 -6.157 -2.155 1.00 0.00 C ATOM 472 C LEU A 32 -16.918 -6.997 -3.037 1.00 0.00 C ATOM 473 O LEU A 32 -16.034 -6.543 -3.761 1.00 0.00 O ATOM 474 CB LEU A 32 -17.247 -6.076 -0.713 1.00 0.00 C ATOM 475 CG LEU A 32 -15.743 -5.786 -0.570 1.00 0.00 C ATOM 476 CD1 LEU A 32 -15.389 -4.350 -0.994 1.00 0.00 C ATOM 477 CD2 LEU A 32 -15.335 -6.089 0.881 1.00 0.00 C ATOM 0 H LEU A 32 -19.579 -6.757 -1.421 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.689 -5.134 -2.521 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.800 -5.299 -0.186 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.466 -7.019 -0.212 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.177 -6.429 -1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.317 -4.190 -0.877 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -15.666 -4.200 -2.037 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.932 -3.642 -0.369 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.271 -5.891 1.009 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.906 -5.455 1.559 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.539 -7.136 1.105 1.00 0.00 H new ATOM 489 N GLY A 33 -17.388 -8.242 -3.235 1.00 0.00 N ATOM 490 CA GLY A 33 -16.853 -9.112 -4.235 1.00 0.00 C ATOM 491 C GLY A 33 -16.969 -8.646 -5.645 1.00 0.00 C ATOM 492 O GLY A 33 -15.944 -8.668 -6.325 1.00 0.00 O ATOM 0 H GLY A 33 -18.150 -8.650 -2.693 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.798 -9.278 -4.015 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.352 -10.077 -4.151 1.00 0.00 H new ATOM 496 N THR A 34 -18.053 -7.956 -6.039 1.00 0.00 N ATOM 497 CA THR A 34 -18.081 -7.219 -7.265 1.00 0.00 C ATOM 498 C THR A 34 -17.111 -6.114 -7.500 1.00 0.00 C ATOM 499 O THR A 34 -16.510 -5.994 -8.566 1.00 0.00 O ATOM 500 CB THR A 34 -19.492 -6.778 -7.520 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.409 -7.862 -7.515 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.689 -5.982 -8.820 1.00 0.00 C ATOM 0 H THR A 34 -18.919 -7.908 -5.503 1.00 0.00 H new ATOM 0 HA THR A 34 -17.709 -7.938 -7.995 1.00 0.00 H new ATOM 0 HB THR A 34 -19.699 -6.108 -6.685 1.00 0.00 H new ATOM 0 HG1 THR A 34 -21.314 -7.526 -7.683 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.738 -5.705 -8.922 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.077 -5.080 -8.791 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.391 -6.595 -9.671 1.00 0.00 H new ATOM 510 N VAL A 35 -16.862 -5.358 -6.415 1.00 0.00 N ATOM 511 CA VAL A 35 -15.933 -4.271 -6.424 1.00 0.00 C ATOM 512 C VAL A 35 -14.521 -4.730 -6.543 1.00 0.00 C ATOM 513 O VAL A 35 -13.829 -4.275 -7.453 1.00 0.00 O ATOM 514 CB VAL A 35 -16.022 -3.345 -5.247 1.00 0.00 C ATOM 515 CG1 VAL A 35 -15.081 -2.128 -5.246 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.443 -2.774 -5.107 1.00 0.00 C ATOM 0 H VAL A 35 -17.316 -5.505 -5.513 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.231 -3.709 -7.309 1.00 0.00 H new ATOM 0 HB VAL A 35 -15.721 -3.993 -4.424 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.246 -1.541 -4.342 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -14.046 -2.468 -5.274 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -15.284 -1.511 -6.121 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.483 -2.105 -4.247 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.703 -2.221 -6.009 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.151 -3.591 -4.965 1.00 0.00 H new ATOM 526 N MET A 36 -14.070 -5.662 -5.685 1.00 0.00 N ATOM 527 CA MET A 36 -12.851 -6.410 -5.703 1.00 0.00 C ATOM 528 C MET A 36 -12.545 -7.083 -6.996 1.00 0.00 C ATOM 529 O MET A 36 -11.419 -7.110 -7.492 1.00 0.00 O ATOM 530 CB MET A 36 -12.865 -7.378 -4.508 1.00 0.00 C ATOM 531 CG MET A 36 -12.747 -6.734 -3.125 1.00 0.00 C ATOM 532 SD MET A 36 -11.059 -6.779 -2.450 1.00 0.00 S ATOM 533 CE MET A 36 -10.460 -5.093 -2.763 1.00 0.00 C ATOM 0 H MET A 36 -14.636 -5.921 -4.877 1.00 0.00 H new ATOM 0 HA MET A 36 -12.024 -5.706 -5.604 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.790 -7.953 -4.542 1.00 0.00 H new ATOM 0 HB3 MET A 36 -12.045 -8.086 -4.629 1.00 0.00 H new ATOM 0 HG2 MET A 36 -13.079 -5.697 -3.185 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.420 -7.244 -2.436 1.00 0.00 H new ATOM 0 HE1 MET A 36 -9.439 -4.996 -2.395 1.00 0.00 H new ATOM 0 HE2 MET A 36 -10.480 -4.893 -3.834 1.00 0.00 H new ATOM 0 HE3 MET A 36 -11.101 -4.378 -2.248 1.00 0.00 H new ATOM 543 N ARG A 37 -13.600 -7.617 -7.637 1.00 0.00 N ATOM 544 CA ARG A 37 -13.427 -8.255 -8.905 1.00 0.00 C ATOM 545 C ARG A 37 -13.210 -7.259 -9.992 1.00 0.00 C ATOM 546 O ARG A 37 -12.290 -7.387 -10.798 1.00 0.00 O ATOM 547 CB ARG A 37 -14.538 -9.295 -9.128 1.00 0.00 C ATOM 548 CG ARG A 37 -14.379 -10.133 -10.398 1.00 0.00 C ATOM 549 CD ARG A 37 -15.460 -11.190 -10.638 1.00 0.00 C ATOM 550 NE ARG A 37 -16.716 -10.444 -10.931 1.00 0.00 N ATOM 551 CZ ARG A 37 -17.644 -10.956 -11.791 1.00 0.00 C ATOM 552 NH1 ARG A 37 -17.982 -12.277 -11.854 1.00 0.00 N ATOM 553 NH2 ARG A 37 -18.371 -9.995 -12.433 1.00 0.00 N ATOM 0 H ARG A 37 -14.557 -7.608 -7.285 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.504 -8.835 -8.921 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -14.569 -9.964 -8.268 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -15.498 -8.780 -9.166 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -14.359 -9.460 -11.255 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -13.411 -10.632 -10.362 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -15.190 -11.840 -11.471 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -15.582 -11.828 -9.762 1.00 0.00 H new ATOM 0 HE ARG A 37 -16.884 -9.542 -10.485 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -17.531 -12.949 -11.233 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -18.685 -12.592 -12.522 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -18.191 -9.009 -12.245 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -19.094 -10.263 -13.100 1.00 0.00 H new ATOM 567 N SER A 38 -13.911 -6.111 -9.983 1.00 0.00 N ATOM 568 CA SER A 38 -13.644 -5.012 -10.858 1.00 0.00 C ATOM 569 C SER A 38 -12.396 -4.263 -10.535 1.00 0.00 C ATOM 570 O SER A 38 -11.864 -3.527 -11.365 1.00 0.00 O ATOM 571 CB SER A 38 -14.731 -3.927 -10.943 1.00 0.00 C ATOM 572 OG SER A 38 -15.852 -4.457 -11.634 1.00 0.00 O ATOM 0 H SER A 38 -14.689 -5.942 -9.346 1.00 0.00 H new ATOM 0 HA SER A 38 -13.575 -5.549 -11.804 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.022 -3.605 -9.943 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.348 -3.049 -11.462 1.00 0.00 H new ATOM 0 HG SER A 38 -16.553 -3.774 -11.693 1.00 0.00 H new ATOM 578 N LEU A 39 -11.749 -4.444 -9.371 1.00 0.00 N ATOM 579 CA LEU A 39 -10.385 -4.059 -9.179 1.00 0.00 C ATOM 580 C LEU A 39 -9.403 -5.033 -9.731 1.00 0.00 C ATOM 581 O LEU A 39 -8.275 -4.678 -10.071 1.00 0.00 O ATOM 582 CB LEU A 39 -10.122 -3.813 -7.684 1.00 0.00 C ATOM 583 CG LEU A 39 -8.856 -3.040 -7.278 1.00 0.00 C ATOM 584 CD1 LEU A 39 -8.721 -1.594 -7.785 1.00 0.00 C ATOM 585 CD2 LEU A 39 -8.693 -2.984 -5.749 1.00 0.00 C ATOM 0 H LEU A 39 -12.180 -4.865 -8.548 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.236 -3.138 -9.743 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.981 -3.277 -7.280 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -10.090 -4.784 -7.189 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.079 -3.624 -7.772 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.784 -1.168 -7.425 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -8.727 -1.589 -8.875 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.556 -0.999 -7.414 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.788 -2.430 -5.500 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.557 -2.485 -5.309 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.619 -3.997 -5.354 1.00 0.00 H new ATOM 597 N GLY A 40 -9.848 -6.281 -9.962 1.00 0.00 N ATOM 598 CA GLY A 40 -9.030 -7.356 -10.431 1.00 0.00 C ATOM 599 C GLY A 40 -8.370 -8.056 -9.294 1.00 0.00 C ATOM 600 O GLY A 40 -7.303 -8.638 -9.488 1.00 0.00 O ATOM 0 H GLY A 40 -10.820 -6.552 -9.815 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -9.639 -8.063 -10.994 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.274 -6.971 -11.115 1.00 0.00 H new ATOM 604 N GLN A 41 -8.907 -8.061 -8.061 1.00 0.00 N ATOM 605 CA GLN A 41 -8.605 -8.815 -6.884 1.00 0.00 C ATOM 606 C GLN A 41 -9.499 -9.998 -6.743 1.00 0.00 C ATOM 607 O GLN A 41 -10.548 -10.008 -7.385 1.00 0.00 O ATOM 608 CB GLN A 41 -8.516 -7.993 -5.587 1.00 0.00 C ATOM 609 CG GLN A 41 -7.529 -6.826 -5.505 1.00 0.00 C ATOM 610 CD GLN A 41 -6.053 -7.185 -5.612 1.00 0.00 C ATOM 611 OE1 GLN A 41 -5.478 -7.837 -4.742 1.00 0.00 O ATOM 612 NE2 GLN A 41 -5.388 -6.606 -6.647 1.00 0.00 N ATOM 0 H GLN A 41 -9.682 -7.427 -7.866 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.588 -9.176 -7.039 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.510 -7.596 -5.382 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.275 -8.683 -4.778 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.768 -6.119 -6.299 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.688 -6.309 -4.559 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.902 -6.073 -7.349 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.376 -6.705 -6.722 1.00 0.00 H new ATOM 621 N ASN A 42 -9.086 -10.982 -5.923 1.00 0.00 N ATOM 622 CA ASN A 42 -9.827 -12.197 -5.789 1.00 0.00 C ATOM 623 C ASN A 42 -9.835 -12.759 -4.409 1.00 0.00 C ATOM 624 O ASN A 42 -9.598 -13.962 -4.307 1.00 0.00 O ATOM 625 CB ASN A 42 -9.690 -13.206 -6.941 1.00 0.00 C ATOM 626 CG ASN A 42 -8.270 -13.609 -7.315 1.00 0.00 C ATOM 627 OD1 ASN A 42 -7.665 -14.591 -6.888 1.00 0.00 O ATOM 628 ND2 ASN A 42 -7.603 -12.844 -8.221 1.00 0.00 N ATOM 0 H ASN A 42 -8.241 -10.936 -5.354 1.00 0.00 H new ATOM 0 HA ASN A 42 -10.861 -11.882 -5.932 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -10.243 -14.107 -6.675 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.171 -12.785 -7.824 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -6.658 -13.100 -8.507 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -8.048 -12.015 -8.615 1.00 0.00 H new ATOM 635 N PRO A 43 -10.080 -12.195 -3.264 1.00 0.00 N ATOM 636 CA PRO A 43 -9.960 -12.859 -1.999 1.00 0.00 C ATOM 637 C PRO A 43 -11.099 -13.745 -1.629 1.00 0.00 C ATOM 638 O PRO A 43 -12.105 -13.740 -2.336 1.00 0.00 O ATOM 639 CB PRO A 43 -10.052 -11.763 -0.939 1.00 0.00 C ATOM 640 CG PRO A 43 -10.777 -10.597 -1.630 1.00 0.00 C ATOM 641 CD PRO A 43 -10.437 -10.792 -3.116 1.00 0.00 C ATOM 0 HA PRO A 43 -9.045 -13.449 -2.059 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -10.603 -12.107 -0.064 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -9.062 -11.463 -0.595 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -11.852 -10.634 -1.456 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -10.428 -9.632 -1.262 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -11.288 -10.537 -3.748 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -9.612 -10.146 -3.416 1.00 0.00 H new ATOM 649 N THR A 44 -10.870 -14.545 -0.572 1.00 0.00 N ATOM 650 CA THR A 44 -11.765 -15.588 -0.177 1.00 0.00 C ATOM 651 C THR A 44 -12.970 -15.119 0.564 1.00 0.00 C ATOM 652 O THR A 44 -12.917 -14.020 1.114 1.00 0.00 O ATOM 653 CB THR A 44 -11.156 -16.730 0.582 1.00 0.00 C ATOM 654 OG1 THR A 44 -10.562 -16.283 1.792 1.00 0.00 O ATOM 655 CG2 THR A 44 -10.040 -17.349 -0.276 1.00 0.00 C ATOM 0 H THR A 44 -10.044 -14.465 0.021 1.00 0.00 H new ATOM 0 HA THR A 44 -12.065 -15.968 -1.154 1.00 0.00 H new ATOM 0 HB THR A 44 -11.944 -17.449 0.808 1.00 0.00 H new ATOM 0 HG1 THR A 44 -9.856 -15.635 1.590 1.00 0.00 H new ATOM 0 HG21 THR A 44 -9.587 -18.181 0.262 1.00 0.00 H new ATOM 0 HG22 THR A 44 -10.460 -17.710 -1.215 1.00 0.00 H new ATOM 0 HG23 THR A 44 -9.281 -16.595 -0.484 1.00 0.00 H new ATOM 663 N GLU A 45 -14.079 -15.880 0.551 1.00 0.00 N ATOM 664 CA GLU A 45 -15.352 -15.580 1.131 1.00 0.00 C ATOM 665 C GLU A 45 -15.225 -15.201 2.566 1.00 0.00 C ATOM 666 O GLU A 45 -15.639 -14.139 3.028 1.00 0.00 O ATOM 667 CB GLU A 45 -16.386 -16.701 0.930 1.00 0.00 C ATOM 668 CG GLU A 45 -16.655 -17.114 -0.519 1.00 0.00 C ATOM 669 CD GLU A 45 -15.639 -18.044 -1.168 1.00 0.00 C ATOM 670 OE1 GLU A 45 -14.605 -18.307 -0.499 1.00 0.00 O ATOM 671 OE2 GLU A 45 -15.772 -18.560 -2.309 1.00 0.00 O ATOM 0 H GLU A 45 -14.083 -16.790 0.091 1.00 0.00 H new ATOM 0 HA GLU A 45 -15.735 -14.715 0.590 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -16.051 -17.580 1.481 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.328 -16.384 1.377 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.631 -17.597 -0.559 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -16.722 -16.209 -1.123 1.00 0.00 H new ATOM 678 N ALA A 46 -14.470 -15.971 3.370 1.00 0.00 N ATOM 679 CA ALA A 46 -14.106 -15.532 4.682 1.00 0.00 C ATOM 680 C ALA A 46 -13.312 -14.275 4.782 1.00 0.00 C ATOM 681 O ALA A 46 -13.459 -13.557 5.770 1.00 0.00 O ATOM 682 CB ALA A 46 -13.243 -16.675 5.242 1.00 0.00 C ATOM 0 H ALA A 46 -14.113 -16.892 3.114 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.029 -15.305 5.216 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -12.917 -16.424 6.251 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -13.829 -17.594 5.268 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -12.371 -16.819 4.604 1.00 0.00 H new ATOM 688 N GLU A 47 -12.418 -13.944 3.833 1.00 0.00 N ATOM 689 CA GLU A 47 -11.729 -12.694 3.748 1.00 0.00 C ATOM 690 C GLU A 47 -12.622 -11.555 3.391 1.00 0.00 C ATOM 691 O GLU A 47 -12.427 -10.466 3.928 1.00 0.00 O ATOM 692 CB GLU A 47 -10.530 -12.657 2.786 1.00 0.00 C ATOM 693 CG GLU A 47 -9.279 -13.453 3.165 1.00 0.00 C ATOM 694 CD GLU A 47 -8.329 -13.656 1.994 1.00 0.00 C ATOM 695 OE1 GLU A 47 -8.665 -14.394 1.030 1.00 0.00 O ATOM 696 OE2 GLU A 47 -7.160 -13.186 1.962 1.00 0.00 O ATOM 0 H GLU A 47 -12.162 -14.586 3.083 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.349 -12.585 4.764 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -10.871 -13.014 1.814 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.237 -11.615 2.658 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -8.754 -12.934 3.967 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.578 -14.425 3.557 1.00 0.00 H new ATOM 703 N LEU A 48 -13.583 -11.771 2.475 1.00 0.00 N ATOM 704 CA LEU A 48 -14.564 -10.782 2.154 1.00 0.00 C ATOM 705 C LEU A 48 -15.467 -10.489 3.302 1.00 0.00 C ATOM 706 O LEU A 48 -15.775 -9.358 3.676 1.00 0.00 O ATOM 707 CB LEU A 48 -15.492 -11.187 0.996 1.00 0.00 C ATOM 708 CG LEU A 48 -14.744 -11.240 -0.347 1.00 0.00 C ATOM 709 CD1 LEU A 48 -15.636 -11.928 -1.394 1.00 0.00 C ATOM 710 CD2 LEU A 48 -14.431 -9.879 -0.990 1.00 0.00 C ATOM 0 H LEU A 48 -13.680 -12.641 1.952 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.965 -9.914 1.877 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.930 -12.163 1.206 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.315 -10.476 0.925 1.00 0.00 H new ATOM 0 HG LEU A 48 -13.812 -11.750 -0.103 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -15.111 -11.969 -2.349 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -15.869 -12.941 -1.065 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -16.561 -11.363 -1.512 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.903 -10.034 -1.931 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -15.361 -9.344 -1.180 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -13.806 -9.293 -0.316 1.00 0.00 H new ATOM 722 N GLN A 49 -15.940 -11.513 4.034 1.00 0.00 N ATOM 723 CA GLN A 49 -16.516 -11.370 5.335 1.00 0.00 C ATOM 724 C GLN A 49 -15.688 -10.619 6.320 1.00 0.00 C ATOM 725 O GLN A 49 -16.171 -9.678 6.948 1.00 0.00 O ATOM 726 CB GLN A 49 -16.826 -12.745 5.951 1.00 0.00 C ATOM 727 CG GLN A 49 -17.531 -12.641 7.304 1.00 0.00 C ATOM 728 CD GLN A 49 -19.011 -12.327 7.138 1.00 0.00 C ATOM 729 OE1 GLN A 49 -19.783 -13.076 6.541 1.00 0.00 O ATOM 730 NE2 GLN A 49 -19.470 -11.214 7.770 1.00 0.00 N ATOM 0 H GLN A 49 -15.920 -12.479 3.707 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.418 -10.786 5.154 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.451 -13.314 5.263 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -15.897 -13.302 6.072 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -17.415 -13.578 7.849 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -17.058 -11.863 7.903 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -18.819 -10.601 8.261 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -20.465 -10.992 7.753 1.00 0.00 H new ATOM 739 N ASP A 50 -14.399 -10.967 6.476 1.00 0.00 N ATOM 740 CA ASP A 50 -13.494 -10.193 7.268 1.00 0.00 C ATOM 741 C ASP A 50 -13.305 -8.751 6.947 1.00 0.00 C ATOM 742 O ASP A 50 -13.264 -7.881 7.815 1.00 0.00 O ATOM 743 CB ASP A 50 -12.148 -10.936 7.265 1.00 0.00 C ATOM 744 CG ASP A 50 -11.510 -10.926 8.647 1.00 0.00 C ATOM 745 OD1 ASP A 50 -12.232 -11.166 9.651 1.00 0.00 O ATOM 746 OD2 ASP A 50 -10.298 -10.598 8.753 1.00 0.00 O ATOM 0 H ASP A 50 -13.980 -11.793 6.049 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.964 -10.121 8.249 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -12.299 -11.965 6.939 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.474 -10.469 6.547 1.00 0.00 H new ATOM 751 N MET A 51 -13.167 -8.301 5.687 1.00 0.00 N ATOM 752 CA MET A 51 -13.156 -6.935 5.265 1.00 0.00 C ATOM 753 C MET A 51 -14.421 -6.192 5.527 1.00 0.00 C ATOM 754 O MET A 51 -14.445 -4.973 5.688 1.00 0.00 O ATOM 755 CB MET A 51 -12.849 -6.719 3.774 1.00 0.00 C ATOM 756 CG MET A 51 -11.417 -7.018 3.326 1.00 0.00 C ATOM 757 SD MET A 51 -11.117 -6.600 1.583 1.00 0.00 S ATOM 758 CE MET A 51 -11.927 -8.091 0.936 1.00 0.00 C ATOM 0 H MET A 51 -13.054 -8.944 4.903 1.00 0.00 H new ATOM 0 HA MET A 51 -12.345 -6.545 5.880 1.00 0.00 H new ATOM 0 HB2 MET A 51 -13.527 -7.343 3.191 1.00 0.00 H new ATOM 0 HB3 MET A 51 -13.076 -5.682 3.525 1.00 0.00 H new ATOM 0 HG2 MET A 51 -10.722 -6.459 3.953 1.00 0.00 H new ATOM 0 HG3 MET A 51 -11.207 -8.076 3.482 1.00 0.00 H new ATOM 0 HE1 MET A 51 -11.775 -8.149 -0.142 1.00 0.00 H new ATOM 0 HE2 MET A 51 -11.498 -8.973 1.411 1.00 0.00 H new ATOM 0 HE3 MET A 51 -12.995 -8.047 1.150 1.00 0.00 H new ATOM 768 N ILE A 52 -15.555 -6.914 5.586 1.00 0.00 N ATOM 769 CA ILE A 52 -16.869 -6.479 5.946 1.00 0.00 C ATOM 770 C ILE A 52 -16.880 -6.272 7.421 1.00 0.00 C ATOM 771 O ILE A 52 -17.288 -5.214 7.899 1.00 0.00 O ATOM 772 CB ILE A 52 -17.949 -7.405 5.471 1.00 0.00 C ATOM 773 CG1 ILE A 52 -18.652 -6.856 4.219 1.00 0.00 C ATOM 774 CG2 ILE A 52 -19.040 -7.728 6.505 1.00 0.00 C ATOM 775 CD1 ILE A 52 -17.809 -6.722 2.952 1.00 0.00 C ATOM 0 H ILE A 52 -15.547 -7.908 5.356 1.00 0.00 H new ATOM 0 HA ILE A 52 -17.098 -5.541 5.440 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.409 -8.328 5.260 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -19.499 -7.504 3.995 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -19.057 -5.874 4.462 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.772 -8.404 6.063 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.587 -8.203 7.376 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -19.536 -6.807 6.811 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.425 -6.324 2.146 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -16.975 -6.045 3.140 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -17.424 -7.701 2.666 1.00 0.00 H new ATOM 787 N ASN A 53 -16.329 -7.236 8.180 1.00 0.00 N ATOM 788 CA ASN A 53 -16.326 -7.183 9.609 1.00 0.00 C ATOM 789 C ASN A 53 -15.429 -6.156 10.208 1.00 0.00 C ATOM 790 O ASN A 53 -15.624 -5.717 11.340 1.00 0.00 O ATOM 791 CB ASN A 53 -15.947 -8.484 10.335 1.00 0.00 C ATOM 792 CG ASN A 53 -16.822 -9.684 9.999 1.00 0.00 C ATOM 793 OD1 ASN A 53 -17.919 -9.696 9.443 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.427 -10.924 10.393 1.00 0.00 N ATOM 0 H ASN A 53 -15.878 -8.066 7.795 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.378 -6.942 9.764 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -14.912 -8.729 10.095 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.992 -8.309 11.410 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.025 -11.731 10.214 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.532 -11.048 10.867 1.00 0.00 H new ATOM 801 N GLU A 54 -14.399 -5.794 9.422 1.00 0.00 N ATOM 802 CA GLU A 54 -13.324 -4.934 9.809 1.00 0.00 C ATOM 803 C GLU A 54 -13.763 -3.512 9.870 1.00 0.00 C ATOM 804 O GLU A 54 -13.572 -2.866 10.899 1.00 0.00 O ATOM 805 CB GLU A 54 -12.120 -5.146 8.876 1.00 0.00 C ATOM 806 CG GLU A 54 -11.033 -4.069 8.840 1.00 0.00 C ATOM 807 CD GLU A 54 -10.298 -3.930 10.165 1.00 0.00 C ATOM 808 OE1 GLU A 54 -10.044 -4.946 10.866 1.00 0.00 O ATOM 809 OE2 GLU A 54 -9.971 -2.754 10.476 1.00 0.00 O ATOM 0 H GLU A 54 -14.312 -6.121 8.460 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.006 -5.194 10.819 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.646 -6.088 9.153 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.502 -5.267 7.862 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.316 -4.309 8.055 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.484 -3.112 8.578 1.00 0.00 H new ATOM 816 N VAL A 55 -14.587 -3.143 8.873 1.00 0.00 N ATOM 817 CA VAL A 55 -15.072 -1.804 8.741 1.00 0.00 C ATOM 818 C VAL A 55 -16.424 -1.487 9.281 1.00 0.00 C ATOM 819 O VAL A 55 -16.842 -0.330 9.262 1.00 0.00 O ATOM 820 CB VAL A 55 -15.075 -1.278 7.337 1.00 0.00 C ATOM 821 CG1 VAL A 55 -13.644 -1.429 6.794 1.00 0.00 C ATOM 822 CG2 VAL A 55 -16.015 -2.096 6.435 1.00 0.00 C ATOM 0 H VAL A 55 -14.921 -3.781 8.150 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.327 -1.317 9.370 1.00 0.00 H new ATOM 0 HB VAL A 55 -15.414 -0.242 7.340 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -13.602 -1.057 5.770 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.956 -0.857 7.417 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -13.358 -2.481 6.809 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.994 -1.689 5.424 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.687 -3.135 6.415 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -17.031 -2.044 6.826 1.00 0.00 H new ATOM 832 N ASP A 56 -17.049 -2.508 9.894 1.00 0.00 N ATOM 833 CA ASP A 56 -18.392 -2.453 10.382 1.00 0.00 C ATOM 834 C ASP A 56 -18.458 -1.928 11.775 1.00 0.00 C ATOM 835 O ASP A 56 -17.980 -2.531 12.735 1.00 0.00 O ATOM 836 CB ASP A 56 -19.159 -3.769 10.175 1.00 0.00 C ATOM 837 CG ASP A 56 -20.617 -3.515 10.531 1.00 0.00 C ATOM 838 OD1 ASP A 56 -21.191 -2.619 9.856 1.00 0.00 O ATOM 839 OD2 ASP A 56 -21.188 -4.037 11.526 1.00 0.00 O ATOM 0 H ASP A 56 -16.600 -3.409 10.056 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.923 -1.726 9.767 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -19.070 -4.105 9.142 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.743 -4.557 10.803 1.00 0.00 H new ATOM 844 N ALA A 57 -18.930 -0.679 11.942 1.00 0.00 N ATOM 845 CA ALA A 57 -18.735 0.184 13.065 1.00 0.00 C ATOM 846 C ALA A 57 -19.996 0.257 13.855 1.00 0.00 C ATOM 847 O ALA A 57 -19.866 0.151 15.073 1.00 0.00 O ATOM 848 CB ALA A 57 -18.331 1.558 12.503 1.00 0.00 C ATOM 0 H ALA A 57 -19.501 -0.235 11.223 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.957 -0.182 13.735 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.170 2.255 13.326 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -17.411 1.459 11.926 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.125 1.935 11.858 1.00 0.00 H new ATOM 854 N ASP A 58 -21.138 0.443 13.169 1.00 0.00 N ATOM 855 CA ASP A 58 -22.453 0.390 13.729 1.00 0.00 C ATOM 856 C ASP A 58 -22.980 -0.905 14.245 1.00 0.00 C ATOM 857 O ASP A 58 -23.404 -0.969 15.399 1.00 0.00 O ATOM 858 CB ASP A 58 -23.420 0.982 12.689 1.00 0.00 C ATOM 859 CG ASP A 58 -23.351 0.316 11.322 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.452 -0.934 11.200 1.00 0.00 O ATOM 861 OD2 ASP A 58 -23.198 1.086 10.337 1.00 0.00 O ATOM 0 H ASP A 58 -21.144 0.641 12.168 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.373 0.963 14.653 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -24.438 0.901 13.069 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.206 2.045 12.574 1.00 0.00 H new ATOM 866 N GLY A 59 -22.838 -2.034 13.529 1.00 0.00 N ATOM 867 CA GLY A 59 -23.353 -3.292 13.973 1.00 0.00 C ATOM 868 C GLY A 59 -24.031 -4.063 12.893 1.00 0.00 C ATOM 869 O GLY A 59 -24.322 -5.237 13.118 1.00 0.00 O ATOM 0 H GLY A 59 -22.359 -2.075 12.629 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -22.536 -3.889 14.379 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -24.058 -3.122 14.787 1.00 0.00 H new ATOM 873 N ASN A 60 -24.434 -3.544 11.720 1.00 0.00 N ATOM 874 CA ASN A 60 -25.249 -4.347 10.863 1.00 0.00 C ATOM 875 C ASN A 60 -24.557 -5.398 10.065 1.00 0.00 C ATOM 876 O ASN A 60 -25.214 -6.286 9.524 1.00 0.00 O ATOM 877 CB ASN A 60 -26.044 -3.482 9.870 1.00 0.00 C ATOM 878 CG ASN A 60 -25.294 -2.481 9.003 1.00 0.00 C ATOM 879 OD1 ASN A 60 -24.105 -2.491 8.687 1.00 0.00 O ATOM 880 ND2 ASN A 60 -26.116 -1.516 8.512 1.00 0.00 N ATOM 0 H ASN A 60 -24.209 -2.611 11.375 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.887 -4.863 11.580 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.583 -4.156 9.204 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.792 -2.930 10.439 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.747 -0.803 7.883 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -27.102 -1.505 8.772 1.00 0.00 H new ATOM 887 N GLY A 61 -23.223 -5.355 9.896 1.00 0.00 N ATOM 888 CA GLY A 61 -22.558 -6.342 9.104 1.00 0.00 C ATOM 889 C GLY A 61 -22.529 -6.006 7.653 1.00 0.00 C ATOM 890 O GLY A 61 -22.221 -6.871 6.834 1.00 0.00 O ATOM 0 H GLY A 61 -22.612 -4.646 10.302 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.536 -6.459 9.464 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -23.056 -7.302 9.238 1.00 0.00 H new ATOM 894 N THR A 62 -22.822 -4.762 7.233 1.00 0.00 N ATOM 895 CA THR A 62 -22.640 -4.376 5.868 1.00 0.00 C ATOM 896 C THR A 62 -22.020 -3.022 5.832 1.00 0.00 C ATOM 897 O THR A 62 -22.087 -2.342 6.855 1.00 0.00 O ATOM 898 CB THR A 62 -23.908 -4.250 5.077 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.969 -3.506 5.657 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.390 -5.673 4.744 1.00 0.00 C ATOM 0 H THR A 62 -23.184 -4.025 7.837 1.00 0.00 H new ATOM 0 HA THR A 62 -22.032 -5.166 5.428 1.00 0.00 H new ATOM 0 HB THR A 62 -23.646 -3.659 4.200 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.735 -3.497 5.045 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.313 -5.619 4.167 1.00 0.00 H new ATOM 0 HG22 THR A 62 -23.627 -6.188 4.160 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.571 -6.221 5.668 1.00 0.00 H new ATOM 908 N ILE A 63 -21.428 -2.591 4.703 1.00 0.00 N ATOM 909 CA ILE A 63 -20.700 -1.362 4.645 1.00 0.00 C ATOM 910 C ILE A 63 -21.693 -0.315 4.274 1.00 0.00 C ATOM 911 O ILE A 63 -22.238 -0.315 3.171 1.00 0.00 O ATOM 912 CB ILE A 63 -19.619 -1.410 3.606 1.00 0.00 C ATOM 913 CG1 ILE A 63 -18.865 -2.742 3.766 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.708 -0.177 3.736 1.00 0.00 C ATOM 915 CD1 ILE A 63 -17.566 -2.803 2.965 1.00 0.00 C ATOM 0 H ILE A 63 -21.455 -3.102 3.820 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.217 -1.161 5.601 1.00 0.00 H new ATOM 0 HB ILE A 63 -20.032 -1.373 2.598 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -18.641 -2.900 4.821 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -19.515 -3.559 3.453 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.926 -0.221 2.978 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.299 0.728 3.596 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.253 -0.164 4.726 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -17.086 -3.769 3.123 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -17.786 -2.677 1.905 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -16.898 -2.007 3.294 1.00 0.00 H new ATOM 927 N ASP A 64 -21.907 0.668 5.166 1.00 0.00 N ATOM 928 CA ASP A 64 -22.699 1.839 4.945 1.00 0.00 C ATOM 929 C ASP A 64 -21.815 2.938 4.465 1.00 0.00 C ATOM 930 O ASP A 64 -20.632 2.780 4.168 1.00 0.00 O ATOM 931 CB ASP A 64 -23.405 2.269 6.242 1.00 0.00 C ATOM 932 CG ASP A 64 -24.435 1.294 6.795 1.00 0.00 C ATOM 933 OD1 ASP A 64 -24.102 0.231 7.384 1.00 0.00 O ATOM 934 OD2 ASP A 64 -25.629 1.643 6.594 1.00 0.00 O ATOM 0 H ASP A 64 -21.501 0.643 6.101 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.461 1.619 4.197 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -22.647 2.438 7.006 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -23.897 3.225 6.065 1.00 0.00 H new ATOM 939 N PHE A 65 -22.348 4.136 4.164 1.00 0.00 N ATOM 940 CA PHE A 65 -21.607 5.244 3.646 1.00 0.00 C ATOM 941 C PHE A 65 -20.517 5.785 4.506 1.00 0.00 C ATOM 942 O PHE A 65 -19.396 5.806 4.000 1.00 0.00 O ATOM 943 CB PHE A 65 -22.572 6.333 3.145 1.00 0.00 C ATOM 944 CG PHE A 65 -21.822 7.275 2.267 1.00 0.00 C ATOM 945 CD1 PHE A 65 -21.215 6.891 1.095 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.706 8.585 2.667 1.00 0.00 C ATOM 947 CE1 PHE A 65 -20.521 7.779 0.307 1.00 0.00 C ATOM 948 CE2 PHE A 65 -20.946 9.474 1.943 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.423 9.083 0.733 1.00 0.00 C ATOM 0 H PHE A 65 -23.340 4.341 4.287 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.041 4.839 2.807 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -23.398 5.881 2.595 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -23.007 6.869 3.989 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -21.285 5.859 0.783 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.216 8.919 3.558 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -20.066 7.462 -0.620 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -20.762 10.469 2.321 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.928 9.811 0.108 1.00 0.00 H new ATOM 959 N PRO A 66 -20.620 6.032 5.778 1.00 0.00 N ATOM 960 CA PRO A 66 -19.526 6.525 6.563 1.00 0.00 C ATOM 961 C PRO A 66 -18.416 5.543 6.721 1.00 0.00 C ATOM 962 O PRO A 66 -17.364 6.015 7.149 1.00 0.00 O ATOM 963 CB PRO A 66 -20.021 7.004 7.926 1.00 0.00 C ATOM 964 CG PRO A 66 -21.554 6.950 7.827 1.00 0.00 C ATOM 965 CD PRO A 66 -21.848 6.146 6.551 1.00 0.00 C ATOM 0 HA PRO A 66 -19.108 7.367 6.012 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -19.653 6.364 8.728 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -19.674 8.015 8.140 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -21.988 6.470 8.704 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -21.980 7.951 7.768 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.227 5.156 6.807 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.621 6.641 5.962 1.00 0.00 H new ATOM 973 N GLU A 67 -18.556 4.220 6.522 1.00 0.00 N ATOM 974 CA GLU A 67 -17.587 3.177 6.660 1.00 0.00 C ATOM 975 C GLU A 67 -17.045 2.932 5.295 1.00 0.00 C ATOM 976 O GLU A 67 -15.911 2.490 5.113 1.00 0.00 O ATOM 977 CB GLU A 67 -18.174 1.835 7.130 1.00 0.00 C ATOM 978 CG GLU A 67 -19.070 1.933 8.367 1.00 0.00 C ATOM 979 CD GLU A 67 -20.119 0.838 8.500 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.908 0.534 7.566 1.00 0.00 O ATOM 981 OE2 GLU A 67 -20.267 0.267 9.614 1.00 0.00 O ATOM 0 H GLU A 67 -19.457 3.841 6.230 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.858 3.500 7.403 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -18.750 1.399 6.314 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.354 1.149 7.344 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -18.438 1.917 9.255 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -19.576 2.898 8.353 1.00 0.00 H new ATOM 988 N PHE A 68 -17.752 3.304 4.213 1.00 0.00 N ATOM 989 CA PHE A 68 -17.337 3.243 2.846 1.00 0.00 C ATOM 990 C PHE A 68 -16.369 4.347 2.597 1.00 0.00 C ATOM 991 O PHE A 68 -15.316 4.241 1.970 1.00 0.00 O ATOM 992 CB PHE A 68 -18.551 3.433 1.920 1.00 0.00 C ATOM 993 CG PHE A 68 -18.170 3.327 0.484 1.00 0.00 C ATOM 994 CD1 PHE A 68 -17.650 2.159 -0.022 1.00 0.00 C ATOM 995 CD2 PHE A 68 -18.098 4.463 -0.289 1.00 0.00 C ATOM 996 CE1 PHE A 68 -17.258 2.068 -1.337 1.00 0.00 C ATOM 997 CE2 PHE A 68 -17.741 4.366 -1.613 1.00 0.00 C ATOM 998 CZ PHE A 68 -17.394 3.156 -2.166 1.00 0.00 C ATOM 0 H PHE A 68 -18.696 3.680 4.305 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.879 2.274 2.646 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -19.307 2.683 2.152 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -19.002 4.408 2.106 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.548 1.299 0.624 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -18.321 5.427 0.143 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.845 1.145 -1.717 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -17.733 5.254 -2.228 1.00 0.00 H new ATOM 0 HZ PHE A 68 -17.232 3.062 -3.230 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.561 5.499 3.264 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.624 6.574 3.368 1.00 0.00 C ATOM 1010 C LEU A 69 -14.382 6.207 4.105 1.00 0.00 C ATOM 1011 O LEU A 69 -13.300 6.535 3.620 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.322 7.788 4.004 1.00 0.00 C ATOM 1013 CG LEU A 69 -17.415 8.460 3.158 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -17.879 9.733 3.885 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -16.900 8.895 1.775 1.00 0.00 C ATOM 0 H LEU A 69 -17.429 5.691 3.764 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.292 6.826 2.361 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -16.765 7.473 4.949 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.564 8.535 4.241 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.217 7.734 3.024 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -18.656 10.224 3.299 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.277 9.468 4.865 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.034 10.410 4.008 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.710 9.364 1.216 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -16.084 9.607 1.898 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.541 8.022 1.229 1.00 0.00 H new ATOM 1027 N THR A 70 -14.464 5.359 5.146 1.00 0.00 N ATOM 1028 CA THR A 70 -13.401 4.838 5.949 1.00 0.00 C ATOM 1029 C THR A 70 -12.657 3.874 5.090 1.00 0.00 C ATOM 1030 O THR A 70 -11.440 3.980 4.951 1.00 0.00 O ATOM 1031 CB THR A 70 -13.837 4.248 7.258 1.00 0.00 C ATOM 1032 OG1 THR A 70 -14.512 5.262 7.987 1.00 0.00 O ATOM 1033 CG2 THR A 70 -12.672 3.731 8.118 1.00 0.00 C ATOM 0 H THR A 70 -15.369 5.004 5.455 1.00 0.00 H new ATOM 0 HA THR A 70 -12.755 5.655 6.270 1.00 0.00 H new ATOM 0 HB THR A 70 -14.473 3.391 7.035 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.406 5.397 7.609 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.062 3.319 9.049 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.135 2.954 7.574 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.992 4.553 8.342 1.00 0.00 H new ATOM 1041 N MET A 71 -13.335 3.072 4.251 1.00 0.00 N ATOM 1042 CA MET A 71 -12.687 2.134 3.387 1.00 0.00 C ATOM 1043 C MET A 71 -11.921 2.742 2.263 1.00 0.00 C ATOM 1044 O MET A 71 -10.963 2.162 1.755 1.00 0.00 O ATOM 1045 CB MET A 71 -13.658 1.075 2.838 1.00 0.00 C ATOM 1046 CG MET A 71 -13.187 -0.158 2.065 1.00 0.00 C ATOM 1047 SD MET A 71 -12.339 -1.402 3.085 1.00 0.00 S ATOM 1048 CE MET A 71 -12.268 -2.863 2.009 1.00 0.00 C ATOM 0 H MET A 71 -14.352 3.074 4.171 1.00 0.00 H new ATOM 0 HA MET A 71 -11.956 1.653 4.037 1.00 0.00 H new ATOM 0 HB2 MET A 71 -14.231 0.708 3.690 1.00 0.00 H new ATOM 0 HB3 MET A 71 -14.356 1.601 2.187 1.00 0.00 H new ATOM 0 HG2 MET A 71 -14.049 -0.624 1.587 1.00 0.00 H new ATOM 0 HG3 MET A 71 -12.515 0.162 1.269 1.00 0.00 H new ATOM 0 HE1 MET A 71 -11.770 -3.678 2.535 1.00 0.00 H new ATOM 0 HE2 MET A 71 -13.280 -3.168 1.742 1.00 0.00 H new ATOM 0 HE3 MET A 71 -11.711 -2.621 1.104 1.00 0.00 H new ATOM 1058 N MET A 72 -12.490 3.863 1.784 1.00 0.00 N ATOM 1059 CA MET A 72 -11.808 4.644 0.799 1.00 0.00 C ATOM 1060 C MET A 72 -10.607 5.402 1.249 1.00 0.00 C ATOM 1061 O MET A 72 -9.654 5.489 0.476 1.00 0.00 O ATOM 1062 CB MET A 72 -12.686 5.609 -0.014 1.00 0.00 C ATOM 1063 CG MET A 72 -13.659 4.825 -0.898 1.00 0.00 C ATOM 1064 SD MET A 72 -13.098 3.781 -2.276 1.00 0.00 S ATOM 1065 CE MET A 72 -13.170 2.233 -1.329 1.00 0.00 C ATOM 0 H MET A 72 -13.401 4.223 2.070 1.00 0.00 H new ATOM 0 HA MET A 72 -11.473 3.827 0.160 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.241 6.262 0.660 1.00 0.00 H new ATOM 0 HB3 MET A 72 -12.058 6.250 -0.633 1.00 0.00 H new ATOM 0 HG2 MET A 72 -14.236 4.182 -0.233 1.00 0.00 H new ATOM 0 HG3 MET A 72 -14.353 5.552 -1.319 1.00 0.00 H new ATOM 0 HE1 MET A 72 -12.201 1.735 -1.371 1.00 0.00 H new ATOM 0 HE2 MET A 72 -13.420 2.453 -0.291 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.932 1.581 -1.755 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.510 5.796 2.531 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.323 6.427 3.018 1.00 0.00 C ATOM 1077 C ALA A 73 -8.191 5.494 3.279 1.00 0.00 C ATOM 1078 O ALA A 73 -7.036 5.917 3.314 1.00 0.00 O ATOM 1079 CB ALA A 73 -9.844 7.068 4.315 1.00 0.00 C ATOM 0 H ALA A 73 -11.247 5.679 3.226 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.888 7.119 2.297 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.031 7.599 4.811 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.644 7.769 4.078 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.227 6.291 4.977 1.00 0.00 H new ATOM 1085 N ARG A 74 -8.510 4.200 3.459 1.00 0.00 N ATOM 1086 CA ARG A 74 -7.585 3.110 3.503 1.00 0.00 C ATOM 1087 C ARG A 74 -6.968 2.806 2.181 1.00 0.00 C ATOM 1088 O ARG A 74 -5.920 2.179 2.036 1.00 0.00 O ATOM 1089 CB ARG A 74 -8.197 1.892 4.215 1.00 0.00 C ATOM 1090 CG ARG A 74 -8.863 2.036 5.584 1.00 0.00 C ATOM 1091 CD ARG A 74 -8.915 0.680 6.290 1.00 0.00 C ATOM 1092 NE ARG A 74 -9.147 1.039 7.718 1.00 0.00 N ATOM 1093 CZ ARG A 74 -9.363 0.048 8.632 1.00 0.00 C ATOM 1094 NH1 ARG A 74 -9.434 -1.271 8.289 1.00 0.00 N ATOM 1095 NH2 ARG A 74 -9.656 0.460 9.900 1.00 0.00 N ATOM 0 H ARG A 74 -9.476 3.896 3.582 1.00 0.00 H new ATOM 0 HA ARG A 74 -6.738 3.424 4.114 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -8.941 1.468 3.541 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.404 1.152 4.321 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -8.309 2.750 6.193 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -9.872 2.432 5.466 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -9.717 0.054 5.898 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.986 0.125 6.162 1.00 0.00 H new ATOM 0 HE ARG A 74 -9.144 2.016 8.010 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -9.324 -1.551 7.314 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.597 -1.977 9.007 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -9.702 1.456 10.115 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.829 -0.228 10.633 1.00 0.00 H new ATOM 1109 N LYS A 75 -7.648 3.185 1.085 1.00 0.00 N ATOM 1110 CA LYS A 75 -7.373 3.021 -0.309 1.00 0.00 C ATOM 1111 C LYS A 75 -6.397 4.098 -0.638 1.00 0.00 C ATOM 1112 O LYS A 75 -5.264 3.852 -1.048 1.00 0.00 O ATOM 1113 CB LYS A 75 -8.589 3.057 -1.249 1.00 0.00 C ATOM 1114 CG LYS A 75 -8.220 2.828 -2.716 1.00 0.00 C ATOM 1115 CD LYS A 75 -9.443 3.090 -3.598 1.00 0.00 C ATOM 1116 CE LYS A 75 -9.214 2.710 -5.062 1.00 0.00 C ATOM 1117 NZ LYS A 75 -9.194 1.246 -5.277 1.00 0.00 N ATOM 0 H LYS A 75 -8.529 3.685 1.203 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.989 2.015 -0.476 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.304 2.296 -0.937 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.087 4.022 -1.152 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.403 3.489 -3.004 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.868 1.806 -2.858 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -10.292 2.527 -3.210 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -9.708 4.146 -3.539 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -10.000 3.152 -5.675 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -8.269 3.135 -5.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -9.036 1.045 -6.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -8.428 0.823 -4.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -10.105 0.839 -4.982 1.00 0.00 H new ATOM 1131 N MET A 76 -6.805 5.355 -0.392 1.00 0.00 N ATOM 1132 CA MET A 76 -6.028 6.530 -0.636 1.00 0.00 C ATOM 1133 C MET A 76 -4.849 6.856 0.215 1.00 0.00 C ATOM 1134 O MET A 76 -4.005 7.692 -0.102 1.00 0.00 O ATOM 1135 CB MET A 76 -6.915 7.782 -0.741 1.00 0.00 C ATOM 1136 CG MET A 76 -7.987 7.645 -1.823 1.00 0.00 C ATOM 1137 SD MET A 76 -7.477 7.207 -3.512 1.00 0.00 S ATOM 1138 CE MET A 76 -7.739 8.929 -4.026 1.00 0.00 C ATOM 0 H MET A 76 -7.725 5.562 -0.003 1.00 0.00 H new ATOM 0 HA MET A 76 -5.567 6.235 -1.579 1.00 0.00 H new ATOM 0 HB2 MET A 76 -7.394 7.967 0.221 1.00 0.00 H new ATOM 0 HB3 MET A 76 -6.291 8.649 -0.958 1.00 0.00 H new ATOM 0 HG2 MET A 76 -8.700 6.891 -1.488 1.00 0.00 H new ATOM 0 HG3 MET A 76 -8.525 8.591 -1.876 1.00 0.00 H new ATOM 0 HE1 MET A 76 -7.404 9.056 -5.055 1.00 0.00 H new ATOM 0 HE2 MET A 76 -8.799 9.172 -3.957 1.00 0.00 H new ATOM 0 HE3 MET A 76 -7.171 9.594 -3.375 1.00 0.00 H new ATOM 1148 N LYS A 77 -4.701 5.991 1.235 1.00 0.00 N ATOM 1149 CA LYS A 77 -3.549 5.781 2.056 1.00 0.00 C ATOM 1150 C LYS A 77 -2.303 5.451 1.309 1.00 0.00 C ATOM 1151 O LYS A 77 -1.250 6.045 1.538 1.00 0.00 O ATOM 1152 CB LYS A 77 -3.862 4.724 3.128 1.00 0.00 C ATOM 1153 CG LYS A 77 -2.686 4.286 4.004 1.00 0.00 C ATOM 1154 CD LYS A 77 -3.080 3.381 5.174 1.00 0.00 C ATOM 1155 CE LYS A 77 -1.849 2.794 5.866 1.00 0.00 C ATOM 1156 NZ LYS A 77 -2.376 1.818 6.847 1.00 0.00 N ATOM 0 H LYS A 77 -5.468 5.378 1.510 1.00 0.00 H new ATOM 0 HA LYS A 77 -3.332 6.738 2.531 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -4.646 5.115 3.776 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.268 3.842 2.632 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -1.959 3.762 3.383 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.189 5.173 4.396 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.667 3.950 5.895 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.716 2.573 4.812 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.188 2.310 5.147 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -1.268 3.572 6.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.700 1.035 6.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -2.512 2.288 7.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -3.286 1.445 6.510 1.00 0.00 H new ATOM 1170 N ASP A 78 -2.370 4.536 0.325 1.00 0.00 N ATOM 1171 CA ASP A 78 -1.413 3.837 -0.476 1.00 0.00 C ATOM 1172 C ASP A 78 -0.128 4.487 -0.858 1.00 0.00 C ATOM 1173 O ASP A 78 0.958 4.178 -0.371 1.00 0.00 O ATOM 1174 CB ASP A 78 -2.106 3.190 -1.687 1.00 0.00 C ATOM 1175 CG ASP A 78 -1.232 2.120 -2.328 1.00 0.00 C ATOM 1176 OD1 ASP A 78 -0.938 1.075 -1.688 1.00 0.00 O ATOM 1177 OD2 ASP A 78 -0.837 2.284 -3.513 1.00 0.00 O ATOM 0 H ASP A 78 -3.301 4.230 0.041 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.037 3.099 0.232 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -3.051 2.748 -1.373 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.342 3.957 -2.424 1.00 0.00 H new ATOM 1182 N THR A 79 -0.102 5.540 -1.695 1.00 0.00 N ATOM 1183 CA THR A 79 1.078 6.247 -2.085 1.00 0.00 C ATOM 1184 C THR A 79 1.774 6.888 -0.933 1.00 0.00 C ATOM 1185 O THR A 79 2.919 6.542 -0.647 1.00 0.00 O ATOM 1186 CB THR A 79 0.923 7.270 -3.171 1.00 0.00 C ATOM 1187 OG1 THR A 79 0.176 6.751 -4.261 1.00 0.00 O ATOM 1188 CG2 THR A 79 2.243 7.846 -3.711 1.00 0.00 C ATOM 0 H THR A 79 -0.948 5.917 -2.121 1.00 0.00 H new ATOM 0 HA THR A 79 1.680 5.441 -2.504 1.00 0.00 H new ATOM 0 HB THR A 79 0.392 8.091 -2.689 1.00 0.00 H new ATOM 0 HG1 THR A 79 0.088 7.438 -4.954 1.00 0.00 H new ATOM 0 HG21 THR A 79 2.029 8.576 -4.491 1.00 0.00 H new ATOM 0 HG22 THR A 79 2.787 8.330 -2.900 1.00 0.00 H new ATOM 0 HG23 THR A 79 2.849 7.040 -4.125 1.00 0.00 H new ATOM 1196 N ASP A 80 1.142 7.809 -0.184 1.00 0.00 N ATOM 1197 CA ASP A 80 1.618 8.464 0.995 1.00 0.00 C ATOM 1198 C ASP A 80 2.018 7.583 2.129 1.00 0.00 C ATOM 1199 O ASP A 80 2.783 8.006 2.994 1.00 0.00 O ATOM 1200 CB ASP A 80 0.525 9.361 1.600 1.00 0.00 C ATOM 1201 CG ASP A 80 0.183 10.448 0.591 1.00 0.00 C ATOM 1202 OD1 ASP A 80 0.911 11.442 0.328 1.00 0.00 O ATOM 1203 OD2 ASP A 80 -0.837 10.248 -0.121 1.00 0.00 O ATOM 0 H ASP A 80 0.204 8.125 -0.431 1.00 0.00 H new ATOM 0 HA ASP A 80 2.496 8.991 0.622 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.361 8.772 1.838 1.00 0.00 H new ATOM 0 HB3 ASP A 80 0.872 9.805 2.533 1.00 0.00 H new ATOM 1208 N SER A 81 1.587 6.310 2.174 1.00 0.00 N ATOM 1209 CA SER A 81 1.925 5.418 3.240 1.00 0.00 C ATOM 1210 C SER A 81 3.350 5.292 3.655 1.00 0.00 C ATOM 1211 O SER A 81 3.694 5.487 4.820 1.00 0.00 O ATOM 1212 CB SER A 81 1.490 3.987 2.880 1.00 0.00 C ATOM 1213 OG SER A 81 1.429 3.110 3.995 1.00 0.00 O ATOM 0 H SER A 81 0.993 5.892 1.458 1.00 0.00 H new ATOM 0 HA SER A 81 1.403 5.885 4.076 1.00 0.00 H new ATOM 0 HB2 SER A 81 0.510 4.024 2.404 1.00 0.00 H new ATOM 0 HB3 SER A 81 2.185 3.579 2.146 1.00 0.00 H new ATOM 0 HG SER A 81 1.146 2.221 3.697 1.00 0.00 H new ATOM 1219 N GLU A 82 4.218 4.955 2.685 1.00 0.00 N ATOM 1220 CA GLU A 82 5.601 4.767 2.995 1.00 0.00 C ATOM 1221 C GLU A 82 6.312 5.891 3.667 1.00 0.00 C ATOM 1222 O GLU A 82 7.177 5.689 4.518 1.00 0.00 O ATOM 1223 CB GLU A 82 6.447 4.329 1.788 1.00 0.00 C ATOM 1224 CG GLU A 82 5.823 3.119 1.088 1.00 0.00 C ATOM 1225 CD GLU A 82 6.773 2.600 0.018 1.00 0.00 C ATOM 1226 OE1 GLU A 82 7.953 2.278 0.322 1.00 0.00 O ATOM 1227 OE2 GLU A 82 6.302 2.523 -1.148 1.00 0.00 O ATOM 0 H GLU A 82 3.970 4.815 1.706 1.00 0.00 H new ATOM 0 HA GLU A 82 5.521 3.966 3.730 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.535 5.155 1.083 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.456 4.082 2.118 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.614 2.334 1.815 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.870 3.398 0.638 1.00 0.00 H new ATOM 1234 N GLU A 83 5.931 7.155 3.409 1.00 0.00 N ATOM 1235 CA GLU A 83 6.433 8.301 4.101 1.00 0.00 C ATOM 1236 C GLU A 83 5.770 8.458 5.426 1.00 0.00 C ATOM 1237 O GLU A 83 6.333 8.718 6.489 1.00 0.00 O ATOM 1238 CB GLU A 83 6.142 9.498 3.181 1.00 0.00 C ATOM 1239 CG GLU A 83 6.780 10.817 3.621 1.00 0.00 C ATOM 1240 CD GLU A 83 8.297 10.697 3.640 1.00 0.00 C ATOM 1241 OE1 GLU A 83 8.982 10.528 2.596 1.00 0.00 O ATOM 1242 OE2 GLU A 83 8.887 10.804 4.748 1.00 0.00 O ATOM 0 H GLU A 83 5.246 7.388 2.690 1.00 0.00 H new ATOM 0 HA GLU A 83 7.499 8.212 4.310 1.00 0.00 H new ATOM 0 HB2 GLU A 83 6.491 9.259 2.176 1.00 0.00 H new ATOM 0 HB3 GLU A 83 5.063 9.636 3.119 1.00 0.00 H new ATOM 0 HG2 GLU A 83 6.481 11.616 2.942 1.00 0.00 H new ATOM 0 HG3 GLU A 83 6.419 11.089 4.613 1.00 0.00 H new ATOM 1249 N GLU A 84 4.440 8.259 5.438 1.00 0.00 N ATOM 1250 CA GLU A 84 3.786 8.241 6.710 1.00 0.00 C ATOM 1251 C GLU A 84 4.255 7.255 7.724 1.00 0.00 C ATOM 1252 O GLU A 84 4.748 7.561 8.809 1.00 0.00 O ATOM 1253 CB GLU A 84 2.288 7.990 6.467 1.00 0.00 C ATOM 1254 CG GLU A 84 1.455 9.104 5.832 1.00 0.00 C ATOM 1255 CD GLU A 84 1.192 10.288 6.751 1.00 0.00 C ATOM 1256 OE1 GLU A 84 0.174 10.197 7.488 1.00 0.00 O ATOM 1257 OE2 GLU A 84 1.851 11.361 6.759 1.00 0.00 O ATOM 0 H GLU A 84 3.846 8.118 4.621 1.00 0.00 H new ATOM 0 HA GLU A 84 4.027 9.210 7.147 1.00 0.00 H new ATOM 0 HB2 GLU A 84 2.198 7.107 5.834 1.00 0.00 H new ATOM 0 HB3 GLU A 84 1.834 7.742 7.426 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.966 9.459 4.937 1.00 0.00 H new ATOM 0 HG3 GLU A 84 0.500 8.689 5.510 1.00 0.00 H new ATOM 1264 N ILE A 85 4.250 5.953 7.386 1.00 0.00 N ATOM 1265 CA ILE A 85 4.862 4.896 8.129 1.00 0.00 C ATOM 1266 C ILE A 85 6.323 5.025 8.389 1.00 0.00 C ATOM 1267 O ILE A 85 6.755 4.597 9.458 1.00 0.00 O ATOM 1268 CB ILE A 85 4.473 3.539 7.619 1.00 0.00 C ATOM 1269 CG1 ILE A 85 5.347 3.082 6.438 1.00 0.00 C ATOM 1270 CG2 ILE A 85 2.987 3.572 7.224 1.00 0.00 C ATOM 1271 CD1 ILE A 85 4.690 2.072 5.499 1.00 0.00 C ATOM 0 H ILE A 85 3.789 5.618 6.540 1.00 0.00 H new ATOM 0 HA ILE A 85 4.435 5.010 9.125 1.00 0.00 H new ATOM 0 HB ILE A 85 4.634 2.810 8.413 1.00 0.00 H new ATOM 0 HG12 ILE A 85 5.635 3.959 5.859 1.00 0.00 H new ATOM 0 HG13 ILE A 85 6.264 2.645 6.833 1.00 0.00 H new ATOM 0 HG21 ILE A 85 2.688 2.593 6.851 1.00 0.00 H new ATOM 0 HG22 ILE A 85 2.384 3.828 8.096 1.00 0.00 H new ATOM 0 HG23 ILE A 85 2.834 4.319 6.445 1.00 0.00 H new ATOM 0 HD11 ILE A 85 5.385 1.812 4.700 1.00 0.00 H new ATOM 0 HD12 ILE A 85 4.427 1.174 6.057 1.00 0.00 H new ATOM 0 HD13 ILE A 85 3.789 2.508 5.068 1.00 0.00 H new ATOM 1283 N ARG A 86 7.211 5.621 7.573 1.00 0.00 N ATOM 1284 CA ARG A 86 8.562 5.858 7.976 1.00 0.00 C ATOM 1285 C ARG A 86 8.634 6.836 9.098 1.00 0.00 C ATOM 1286 O ARG A 86 9.317 6.650 10.104 1.00 0.00 O ATOM 1287 CB ARG A 86 9.385 6.375 6.783 1.00 0.00 C ATOM 1288 CG ARG A 86 10.829 6.614 7.229 1.00 0.00 C ATOM 1289 CD ARG A 86 11.712 6.666 5.981 1.00 0.00 C ATOM 1290 NE ARG A 86 11.251 7.943 5.367 1.00 0.00 N ATOM 1291 CZ ARG A 86 11.917 8.529 4.330 1.00 0.00 C ATOM 1292 NH1 ARG A 86 13.134 8.072 3.913 1.00 0.00 N ATOM 1293 NH2 ARG A 86 11.485 9.756 3.917 1.00 0.00 N ATOM 0 H ARG A 86 6.991 5.940 6.629 1.00 0.00 H new ATOM 0 HA ARG A 86 8.976 4.912 8.324 1.00 0.00 H new ATOM 0 HB2 ARG A 86 9.359 5.652 5.968 1.00 0.00 H new ATOM 0 HB3 ARG A 86 8.952 7.300 6.402 1.00 0.00 H new ATOM 0 HG2 ARG A 86 10.905 7.547 7.788 1.00 0.00 H new ATOM 0 HG3 ARG A 86 11.158 5.816 7.895 1.00 0.00 H new ATOM 0 HD2 ARG A 86 12.774 6.685 6.226 1.00 0.00 H new ATOM 0 HD3 ARG A 86 11.552 5.810 5.325 1.00 0.00 H new ATOM 0 HE ARG A 86 10.412 8.393 5.733 1.00 0.00 H new ATOM 0 HH11 ARG A 86 13.566 7.274 4.379 1.00 0.00 H new ATOM 0 HH12 ARG A 86 13.611 8.528 3.135 1.00 0.00 H new ATOM 0 HH21 ARG A 86 10.692 10.200 4.380 1.00 0.00 H new ATOM 0 HH22 ARG A 86 11.955 10.229 3.145 1.00 0.00 H new ATOM 1307 N GLU A 87 7.848 7.926 9.141 1.00 0.00 N ATOM 1308 CA GLU A 87 7.830 8.884 10.203 1.00 0.00 C ATOM 1309 C GLU A 87 7.124 8.303 11.380 1.00 0.00 C ATOM 1310 O GLU A 87 7.582 8.589 12.485 1.00 0.00 O ATOM 1311 CB GLU A 87 7.242 10.242 9.785 1.00 0.00 C ATOM 1312 CG GLU A 87 7.182 11.167 11.003 1.00 0.00 C ATOM 1313 CD GLU A 87 6.697 12.581 10.721 1.00 0.00 C ATOM 1314 OE1 GLU A 87 7.324 13.325 9.920 1.00 0.00 O ATOM 1315 OE2 GLU A 87 5.659 13.010 11.293 1.00 0.00 O ATOM 0 H GLU A 87 7.190 8.151 8.395 1.00 0.00 H new ATOM 0 HA GLU A 87 8.862 9.100 10.478 1.00 0.00 H new ATOM 0 HB2 GLU A 87 7.855 10.691 9.004 1.00 0.00 H new ATOM 0 HB3 GLU A 87 6.244 10.106 9.369 1.00 0.00 H new ATOM 0 HG2 GLU A 87 6.526 10.717 11.748 1.00 0.00 H new ATOM 0 HG3 GLU A 87 8.176 11.223 11.446 1.00 0.00 H new ATOM 1322 N ALA A 88 6.053 7.518 11.168 1.00 0.00 N ATOM 1323 CA ALA A 88 5.396 6.863 12.256 1.00 0.00 C ATOM 1324 C ALA A 88 6.159 5.875 13.070 1.00 0.00 C ATOM 1325 O ALA A 88 5.938 5.642 14.258 1.00 0.00 O ATOM 1326 CB ALA A 88 4.033 6.297 11.824 1.00 0.00 C ATOM 0 H ALA A 88 5.644 7.338 10.251 1.00 0.00 H new ATOM 0 HA ALA A 88 5.274 7.682 12.965 1.00 0.00 H new ATOM 0 HB1 ALA A 88 3.558 5.805 12.673 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.397 7.109 11.472 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.177 5.575 11.020 1.00 0.00 H new ATOM 1332 N PHE A 89 7.119 5.153 12.466 1.00 0.00 N ATOM 1333 CA PHE A 89 7.931 4.098 12.989 1.00 0.00 C ATOM 1334 C PHE A 89 8.752 4.511 14.162 1.00 0.00 C ATOM 1335 O PHE A 89 8.972 3.766 15.116 1.00 0.00 O ATOM 1336 CB PHE A 89 8.747 3.442 11.863 1.00 0.00 C ATOM 1337 CG PHE A 89 9.579 2.310 12.359 1.00 0.00 C ATOM 1338 CD1 PHE A 89 8.924 1.162 12.739 1.00 0.00 C ATOM 1339 CD2 PHE A 89 10.915 2.489 12.629 1.00 0.00 C ATOM 1340 CE1 PHE A 89 9.623 0.109 13.281 1.00 0.00 C ATOM 1341 CE2 PHE A 89 11.610 1.426 13.157 1.00 0.00 C ATOM 1342 CZ PHE A 89 10.981 0.240 13.454 1.00 0.00 C ATOM 0 H PHE A 89 7.352 5.335 11.490 1.00 0.00 H new ATOM 0 HA PHE A 89 7.265 3.335 13.392 1.00 0.00 H new ATOM 0 HB2 PHE A 89 8.070 3.081 11.088 1.00 0.00 H new ATOM 0 HB3 PHE A 89 9.392 4.189 11.400 1.00 0.00 H new ATOM 0 HD1 PHE A 89 7.854 1.087 12.611 1.00 0.00 H new ATOM 0 HD2 PHE A 89 11.402 3.433 12.433 1.00 0.00 H new ATOM 0 HE1 PHE A 89 9.116 -0.802 13.565 1.00 0.00 H new ATOM 0 HE2 PHE A 89 12.669 1.525 13.342 1.00 0.00 H new ATOM 0 HZ PHE A 89 11.557 -0.594 13.826 1.00 0.00 H new ATOM 1352 N ARG A 90 9.224 5.760 14.000 1.00 0.00 N ATOM 1353 CA ARG A 90 10.060 6.397 14.969 1.00 0.00 C ATOM 1354 C ARG A 90 9.295 7.351 15.821 1.00 0.00 C ATOM 1355 O ARG A 90 9.711 7.607 16.950 1.00 0.00 O ATOM 1356 CB ARG A 90 11.156 7.082 14.134 1.00 0.00 C ATOM 1357 CG ARG A 90 12.304 7.616 14.993 1.00 0.00 C ATOM 1358 CD ARG A 90 13.467 8.155 14.159 1.00 0.00 C ATOM 1359 NE ARG A 90 12.989 9.494 13.713 1.00 0.00 N ATOM 1360 CZ ARG A 90 13.757 10.370 13.001 1.00 0.00 C ATOM 1361 NH1 ARG A 90 15.090 10.184 12.775 1.00 0.00 N ATOM 1362 NH2 ARG A 90 13.096 11.425 12.441 1.00 0.00 N ATOM 0 H ARG A 90 9.022 6.337 13.183 1.00 0.00 H new ATOM 0 HA ARG A 90 10.485 5.692 15.684 1.00 0.00 H new ATOM 0 HB2 ARG A 90 11.551 6.372 13.407 1.00 0.00 H new ATOM 0 HB3 ARG A 90 10.717 7.904 13.570 1.00 0.00 H new ATOM 0 HG2 ARG A 90 11.929 8.409 15.640 1.00 0.00 H new ATOM 0 HG3 ARG A 90 12.667 6.819 15.642 1.00 0.00 H new ATOM 0 HD2 ARG A 90 14.381 8.232 14.748 1.00 0.00 H new ATOM 0 HD3 ARG A 90 13.687 7.506 13.312 1.00 0.00 H new ATOM 0 HE ARG A 90 12.037 9.771 13.952 1.00 0.00 H new ATOM 0 HH11 ARG A 90 15.560 9.358 13.145 1.00 0.00 H new ATOM 0 HH12 ARG A 90 15.617 10.871 12.236 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.088 11.521 12.568 1.00 0.00 H new ATOM 0 HH22 ARG A 90 13.610 12.117 11.896 1.00 0.00 H new ATOM 1376 N VAL A 91 8.087 7.794 15.429 1.00 0.00 N ATOM 1377 CA VAL A 91 7.178 8.396 16.354 1.00 0.00 C ATOM 1378 C VAL A 91 6.794 7.417 17.409 1.00 0.00 C ATOM 1379 O VAL A 91 6.961 7.568 18.618 1.00 0.00 O ATOM 1380 CB VAL A 91 5.961 9.009 15.727 1.00 0.00 C ATOM 1381 CG1 VAL A 91 4.927 9.557 16.724 1.00 0.00 C ATOM 1382 CG2 VAL A 91 6.507 10.297 15.089 1.00 0.00 C ATOM 0 H VAL A 91 7.740 7.735 14.472 1.00 0.00 H new ATOM 0 HA VAL A 91 7.719 9.231 16.799 1.00 0.00 H new ATOM 0 HB VAL A 91 5.486 8.254 15.101 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.084 9.980 16.178 1.00 0.00 H new ATOM 0 HG12 VAL A 91 4.576 8.748 17.365 1.00 0.00 H new ATOM 0 HG13 VAL A 91 5.388 10.332 17.337 1.00 0.00 H new ATOM 0 HG21 VAL A 91 5.695 10.832 14.597 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.942 10.930 15.862 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.272 10.044 14.355 1.00 0.00 H new ATOM 1392 N PHE A 92 6.250 6.260 16.991 1.00 0.00 N ATOM 1393 CA PHE A 92 5.659 5.223 17.779 1.00 0.00 C ATOM 1394 C PHE A 92 6.613 4.493 18.659 1.00 0.00 C ATOM 1395 O PHE A 92 6.208 3.909 19.663 1.00 0.00 O ATOM 1396 CB PHE A 92 5.078 4.125 16.872 1.00 0.00 C ATOM 1397 CG PHE A 92 3.814 4.502 16.178 1.00 0.00 C ATOM 1398 CD1 PHE A 92 3.301 5.777 16.222 1.00 0.00 C ATOM 1399 CD2 PHE A 92 3.126 3.476 15.575 1.00 0.00 C ATOM 1400 CE1 PHE A 92 2.042 6.003 15.716 1.00 0.00 C ATOM 1401 CE2 PHE A 92 1.862 3.741 15.102 1.00 0.00 C ATOM 1402 CZ PHE A 92 1.314 5.002 15.117 1.00 0.00 C ATOM 0 H PHE A 92 6.223 6.030 15.998 1.00 0.00 H new ATOM 0 HA PHE A 92 4.918 5.748 18.382 1.00 0.00 H new ATOM 0 HB2 PHE A 92 5.823 3.858 16.123 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.896 3.234 17.473 1.00 0.00 H new ATOM 0 HD1 PHE A 92 3.876 6.587 16.646 1.00 0.00 H new ATOM 0 HD2 PHE A 92 3.564 2.494 15.476 1.00 0.00 H new ATOM 0 HE1 PHE A 92 1.614 6.992 15.791 1.00 0.00 H new ATOM 0 HE2 PHE A 92 1.276 2.926 14.703 1.00 0.00 H new ATOM 0 HZ PHE A 92 0.348 5.199 14.675 1.00 0.00 H new ATOM 1412 N ASP A 93 7.899 4.489 18.263 1.00 0.00 N ATOM 1413 CA ASP A 93 8.945 3.870 19.015 1.00 0.00 C ATOM 1414 C ASP A 93 9.150 4.797 20.164 1.00 0.00 C ATOM 1415 O ASP A 93 9.768 5.853 20.035 1.00 0.00 O ATOM 1416 CB ASP A 93 10.253 3.762 18.213 1.00 0.00 C ATOM 1417 CG ASP A 93 11.446 3.149 18.932 1.00 0.00 C ATOM 1418 OD1 ASP A 93 11.345 2.785 20.135 1.00 0.00 O ATOM 1419 OD2 ASP A 93 12.500 3.184 18.243 1.00 0.00 O ATOM 0 H ASP A 93 8.219 4.927 17.399 1.00 0.00 H new ATOM 0 HA ASP A 93 8.680 2.852 19.301 1.00 0.00 H new ATOM 0 HB2 ASP A 93 10.056 3.173 17.318 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.532 4.762 17.881 1.00 0.00 H new ATOM 1424 N LYS A 94 8.791 4.366 21.386 1.00 0.00 N ATOM 1425 CA LYS A 94 8.733 5.314 22.455 1.00 0.00 C ATOM 1426 C LYS A 94 10.045 5.769 22.993 1.00 0.00 C ATOM 1427 O LYS A 94 10.316 6.969 22.990 1.00 0.00 O ATOM 1428 CB LYS A 94 7.968 4.750 23.664 1.00 0.00 C ATOM 1429 CG LYS A 94 6.471 4.937 23.408 1.00 0.00 C ATOM 1430 CD LYS A 94 5.658 4.362 24.570 1.00 0.00 C ATOM 1431 CE LYS A 94 5.666 5.033 25.945 1.00 0.00 C ATOM 1432 NZ LYS A 94 4.960 6.331 25.865 1.00 0.00 N ATOM 0 H LYS A 94 8.550 3.405 21.629 1.00 0.00 H new ATOM 0 HA LYS A 94 8.236 6.163 21.986 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.201 3.694 23.804 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.265 5.266 24.577 1.00 0.00 H new ATOM 0 HG2 LYS A 94 6.245 5.996 23.286 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.189 4.442 22.478 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.619 4.318 24.242 1.00 0.00 H new ATOM 0 HD3 LYS A 94 5.990 3.334 24.714 1.00 0.00 H new ATOM 0 HE2 LYS A 94 5.182 4.388 26.679 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.692 5.185 26.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 5.178 6.897 26.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 5.270 6.843 25.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.934 6.166 25.814 1.00 0.00 H new ATOM 1446 N ASP A 95 10.948 4.881 23.448 1.00 0.00 N ATOM 1447 CA ASP A 95 12.222 5.261 23.975 1.00 0.00 C ATOM 1448 C ASP A 95 13.143 5.837 22.955 1.00 0.00 C ATOM 1449 O ASP A 95 13.713 6.907 23.166 1.00 0.00 O ATOM 1450 CB ASP A 95 12.849 4.034 24.658 1.00 0.00 C ATOM 1451 CG ASP A 95 12.980 2.729 23.886 1.00 0.00 C ATOM 1452 OD1 ASP A 95 12.522 2.571 22.723 1.00 0.00 O ATOM 1453 OD2 ASP A 95 13.487 1.720 24.445 1.00 0.00 O ATOM 0 H ASP A 95 10.788 3.874 23.449 1.00 0.00 H new ATOM 0 HA ASP A 95 12.062 6.063 24.696 1.00 0.00 H new ATOM 0 HB2 ASP A 95 13.848 4.319 24.988 1.00 0.00 H new ATOM 0 HB3 ASP A 95 12.265 3.826 25.554 1.00 0.00 H new ATOM 1458 N GLY A 96 13.314 5.146 21.814 1.00 0.00 N ATOM 1459 CA GLY A 96 13.910 5.608 20.599 1.00 0.00 C ATOM 1460 C GLY A 96 15.091 4.732 20.357 1.00 0.00 C ATOM 1461 O GLY A 96 16.201 5.256 20.282 1.00 0.00 O ATOM 0 H GLY A 96 13.007 4.176 21.737 1.00 0.00 H new ATOM 0 HA2 GLY A 96 13.204 5.547 19.771 1.00 0.00 H new ATOM 0 HA3 GLY A 96 14.211 6.652 20.685 1.00 0.00 H new ATOM 1465 N ASN A 97 14.929 3.412 20.151 1.00 0.00 N ATOM 1466 CA ASN A 97 15.973 2.492 19.823 1.00 0.00 C ATOM 1467 C ASN A 97 16.013 2.115 18.382 1.00 0.00 C ATOM 1468 O ASN A 97 17.061 1.859 17.791 1.00 0.00 O ATOM 1469 CB ASN A 97 16.007 1.443 20.946 1.00 0.00 C ATOM 1470 CG ASN A 97 14.838 0.469 20.922 1.00 0.00 C ATOM 1471 OD1 ASN A 97 13.745 0.579 20.368 1.00 0.00 O ATOM 1472 ND2 ASN A 97 14.974 -0.677 21.641 1.00 0.00 N ATOM 0 H ASN A 97 14.016 2.962 20.218 1.00 0.00 H new ATOM 0 HA ASN A 97 16.975 2.921 19.833 1.00 0.00 H new ATOM 0 HB2 ASN A 97 16.937 0.879 20.874 1.00 0.00 H new ATOM 0 HB3 ASN A 97 16.019 1.956 21.908 1.00 0.00 H new ATOM 0 HD21 ASN A 97 14.207 -1.348 21.681 1.00 0.00 H new ATOM 0 HD22 ASN A 97 15.843 -0.866 22.140 1.00 0.00 H new ATOM 1479 N GLY A 98 14.841 1.991 17.733 1.00 0.00 N ATOM 1480 CA GLY A 98 14.705 1.581 16.370 1.00 0.00 C ATOM 1481 C GLY A 98 13.986 0.277 16.303 1.00 0.00 C ATOM 1482 O GLY A 98 13.878 -0.311 15.228 1.00 0.00 O ATOM 0 H GLY A 98 13.946 2.186 18.181 1.00 0.00 H new ATOM 0 HA2 GLY A 98 14.159 2.337 15.806 1.00 0.00 H new ATOM 0 HA3 GLY A 98 15.688 1.488 15.909 1.00 0.00 H new ATOM 1486 N TYR A 99 13.314 -0.107 17.403 1.00 0.00 N ATOM 1487 CA TYR A 99 12.373 -1.183 17.411 1.00 0.00 C ATOM 1488 C TYR A 99 11.151 -0.773 18.159 1.00 0.00 C ATOM 1489 O TYR A 99 11.191 -0.072 19.169 1.00 0.00 O ATOM 1490 CB TYR A 99 13.010 -2.348 18.187 1.00 0.00 C ATOM 1491 CG TYR A 99 14.281 -2.754 17.523 1.00 0.00 C ATOM 1492 CD1 TYR A 99 14.070 -3.473 16.371 1.00 0.00 C ATOM 1493 CD2 TYR A 99 15.558 -2.325 17.799 1.00 0.00 C ATOM 1494 CE1 TYR A 99 15.126 -3.748 15.534 1.00 0.00 C ATOM 1495 CE2 TYR A 99 16.620 -2.664 16.994 1.00 0.00 C ATOM 1496 CZ TYR A 99 16.406 -3.329 15.809 1.00 0.00 C ATOM 1497 OH TYR A 99 17.446 -3.539 14.879 1.00 0.00 O ATOM 0 H TYR A 99 13.428 0.343 18.311 1.00 0.00 H new ATOM 0 HA TYR A 99 12.115 -1.459 16.389 1.00 0.00 H new ATOM 0 HB2 TYR A 99 13.205 -2.049 19.217 1.00 0.00 H new ATOM 0 HB3 TYR A 99 12.322 -3.192 18.225 1.00 0.00 H new ATOM 0 HD1 TYR A 99 13.078 -3.821 16.124 1.00 0.00 H new ATOM 0 HD2 TYR A 99 15.731 -1.708 18.668 1.00 0.00 H new ATOM 0 HE1 TYR A 99 14.944 -4.312 14.631 1.00 0.00 H new ATOM 0 HE2 TYR A 99 17.626 -2.407 17.293 1.00 0.00 H new ATOM 0 HH TYR A 99 18.284 -3.178 15.238 1.00 0.00 H new ATOM 1507 N ILE A 100 9.973 -1.250 17.718 1.00 0.00 N ATOM 1508 CA ILE A 100 8.728 -1.151 18.414 1.00 0.00 C ATOM 1509 C ILE A 100 8.490 -2.450 19.104 1.00 0.00 C ATOM 1510 O ILE A 100 8.109 -3.414 18.441 1.00 0.00 O ATOM 1511 CB ILE A 100 7.526 -0.771 17.602 1.00 0.00 C ATOM 1512 CG1 ILE A 100 7.758 0.316 16.539 1.00 0.00 C ATOM 1513 CG2 ILE A 100 6.534 -0.202 18.630 1.00 0.00 C ATOM 1514 CD1 ILE A 100 6.586 0.543 15.586 1.00 0.00 C ATOM 0 H ILE A 100 9.886 -1.733 16.824 1.00 0.00 H new ATOM 0 HA ILE A 100 8.838 -0.313 19.103 1.00 0.00 H new ATOM 0 HB ILE A 100 7.198 -1.650 17.048 1.00 0.00 H new ATOM 0 HG12 ILE A 100 7.984 1.255 17.044 1.00 0.00 H new ATOM 0 HG13 ILE A 100 8.638 0.049 15.953 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.619 0.104 18.122 1.00 0.00 H new ATOM 0 HG22 ILE A 100 6.300 -0.966 19.371 1.00 0.00 H new ATOM 0 HG23 ILE A 100 6.979 0.660 19.126 1.00 0.00 H new ATOM 0 HD11 ILE A 100 6.843 1.327 14.873 1.00 0.00 H new ATOM 0 HD12 ILE A 100 6.370 -0.380 15.048 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.707 0.845 16.156 1.00 0.00 H new ATOM 1526 N SER A 101 8.621 -2.644 20.428 1.00 0.00 N ATOM 1527 CA SER A 101 8.231 -3.812 21.156 1.00 0.00 C ATOM 1528 C SER A 101 6.760 -4.022 21.048 1.00 0.00 C ATOM 1529 O SER A 101 5.986 -3.085 20.861 1.00 0.00 O ATOM 1530 CB SER A 101 8.839 -3.943 22.563 1.00 0.00 C ATOM 1531 OG SER A 101 8.354 -2.917 23.416 1.00 0.00 O ATOM 0 H SER A 101 9.030 -1.932 21.033 1.00 0.00 H new ATOM 0 HA SER A 101 8.696 -4.671 20.671 1.00 0.00 H new ATOM 0 HB2 SER A 101 8.592 -4.918 22.982 1.00 0.00 H new ATOM 0 HB3 SER A 101 9.926 -3.888 22.502 1.00 0.00 H new ATOM 0 HG SER A 101 8.589 -2.042 23.042 1.00 0.00 H new ATOM 1537 N ALA A 102 6.271 -5.275 21.081 1.00 0.00 N ATOM 1538 CA ALA A 102 4.863 -5.526 21.106 1.00 0.00 C ATOM 1539 C ALA A 102 4.125 -4.847 22.207 1.00 0.00 C ATOM 1540 O ALA A 102 3.045 -4.287 22.029 1.00 0.00 O ATOM 1541 CB ALA A 102 4.563 -7.020 21.313 1.00 0.00 C ATOM 0 H ALA A 102 6.851 -6.114 21.090 1.00 0.00 H new ATOM 0 HA ALA A 102 4.532 -5.143 20.141 1.00 0.00 H new ATOM 0 HB1 ALA A 102 3.484 -7.176 21.327 1.00 0.00 H new ATOM 0 HB2 ALA A 102 5.002 -7.596 20.498 1.00 0.00 H new ATOM 0 HB3 ALA A 102 4.990 -7.349 22.261 1.00 0.00 H new ATOM 1547 N ALA A 103 4.751 -4.721 23.391 1.00 0.00 N ATOM 1548 CA ALA A 103 4.348 -3.863 24.462 1.00 0.00 C ATOM 1549 C ALA A 103 4.144 -2.437 24.081 1.00 0.00 C ATOM 1550 O ALA A 103 3.184 -1.778 24.475 1.00 0.00 O ATOM 1551 CB ALA A 103 5.465 -3.954 25.515 1.00 0.00 C ATOM 0 H ALA A 103 5.592 -5.253 23.614 1.00 0.00 H new ATOM 0 HA ALA A 103 3.374 -4.196 24.820 1.00 0.00 H new ATOM 0 HB1 ALA A 103 5.217 -3.318 26.364 1.00 0.00 H new ATOM 0 HB2 ALA A 103 5.565 -4.986 25.852 1.00 0.00 H new ATOM 0 HB3 ALA A 103 6.406 -3.623 25.076 1.00 0.00 H new ATOM 1557 N GLU A 104 5.089 -1.907 23.284 1.00 0.00 N ATOM 1558 CA GLU A 104 4.864 -0.566 22.841 1.00 0.00 C ATOM 1559 C GLU A 104 3.738 -0.501 21.867 1.00 0.00 C ATOM 1560 O GLU A 104 2.863 0.343 22.056 1.00 0.00 O ATOM 1561 CB GLU A 104 6.094 0.121 22.224 1.00 0.00 C ATOM 1562 CG GLU A 104 7.226 0.445 23.201 1.00 0.00 C ATOM 1563 CD GLU A 104 8.582 0.504 22.513 1.00 0.00 C ATOM 1564 OE1 GLU A 104 9.145 -0.586 22.224 1.00 0.00 O ATOM 1565 OE2 GLU A 104 9.105 1.615 22.229 1.00 0.00 O ATOM 0 H GLU A 104 5.944 -2.362 22.966 1.00 0.00 H new ATOM 0 HA GLU A 104 4.618 -0.019 23.751 1.00 0.00 H new ATOM 0 HB2 GLU A 104 6.490 -0.520 21.436 1.00 0.00 H new ATOM 0 HB3 GLU A 104 5.771 1.047 21.749 1.00 0.00 H new ATOM 0 HG2 GLU A 104 7.024 1.401 23.684 1.00 0.00 H new ATOM 0 HG3 GLU A 104 7.252 -0.310 23.987 1.00 0.00 H new ATOM 1572 N LEU A 105 3.658 -1.394 20.864 1.00 0.00 N ATOM 1573 CA LEU A 105 2.651 -1.388 19.848 1.00 0.00 C ATOM 1574 C LEU A 105 1.231 -1.516 20.280 1.00 0.00 C ATOM 1575 O LEU A 105 0.337 -0.865 19.740 1.00 0.00 O ATOM 1576 CB LEU A 105 3.126 -2.325 18.724 1.00 0.00 C ATOM 1577 CG LEU A 105 2.602 -2.030 17.308 1.00 0.00 C ATOM 1578 CD1 LEU A 105 3.646 -2.332 16.220 1.00 0.00 C ATOM 1579 CD2 LEU A 105 1.330 -2.816 16.950 1.00 0.00 C ATOM 0 H LEU A 105 4.327 -2.156 20.757 1.00 0.00 H new ATOM 0 HA LEU A 105 2.565 -0.374 19.457 1.00 0.00 H new ATOM 0 HB2 LEU A 105 4.215 -2.297 18.696 1.00 0.00 H new ATOM 0 HB3 LEU A 105 2.840 -3.343 18.987 1.00 0.00 H new ATOM 0 HG LEU A 105 2.374 -0.964 17.332 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.226 -2.107 15.240 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.531 -1.718 16.385 1.00 0.00 H new ATOM 0 HD13 LEU A 105 3.922 -3.386 16.263 1.00 0.00 H new ATOM 0 HD21 LEU A 105 1.016 -2.559 15.938 1.00 0.00 H new ATOM 0 HD22 LEU A 105 1.535 -3.885 17.006 1.00 0.00 H new ATOM 0 HD23 LEU A 105 0.536 -2.562 17.652 1.00 0.00 H new ATOM 1591 N ARG A 106 0.952 -2.178 21.417 1.00 0.00 N ATOM 1592 CA ARG A 106 -0.328 -2.304 22.041 1.00 0.00 C ATOM 1593 C ARG A 106 -0.781 -1.091 22.779 1.00 0.00 C ATOM 1594 O ARG A 106 -1.894 -0.610 22.575 1.00 0.00 O ATOM 1595 CB ARG A 106 -0.273 -3.532 22.965 1.00 0.00 C ATOM 1596 CG ARG A 106 -1.366 -3.520 24.036 1.00 0.00 C ATOM 1597 CD ARG A 106 -1.349 -4.835 24.817 1.00 0.00 C ATOM 1598 NE ARG A 106 -2.744 -5.007 25.311 1.00 0.00 N ATOM 1599 CZ ARG A 106 -3.279 -4.439 26.431 1.00 0.00 C ATOM 1600 NH1 ARG A 106 -2.514 -3.709 27.294 1.00 0.00 N ATOM 1601 NH2 ARG A 106 -4.594 -4.655 26.731 1.00 0.00 N ATOM 0 H ARG A 106 1.681 -2.663 21.940 1.00 0.00 H new ATOM 0 HA ARG A 106 -1.074 -2.427 21.256 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -0.369 -4.437 22.365 1.00 0.00 H new ATOM 0 HB3 ARG A 106 0.703 -3.573 23.449 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -1.211 -2.682 24.716 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -2.341 -3.377 23.570 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.050 -5.668 24.181 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -0.640 -4.794 25.644 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.358 -5.606 24.760 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -1.520 -3.578 27.108 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -2.937 -3.294 28.124 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -5.168 -5.237 26.120 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -5.002 -4.235 27.566 1.00 0.00 H new ATOM 1615 N HIS A 107 0.163 -0.481 23.517 1.00 0.00 N ATOM 1616 CA HIS A 107 0.126 0.845 24.052 1.00 0.00 C ATOM 1617 C HIS A 107 -0.086 1.891 23.013 1.00 0.00 C ATOM 1618 O HIS A 107 -1.035 2.657 23.176 1.00 0.00 O ATOM 1619 CB HIS A 107 1.454 1.021 24.807 1.00 0.00 C ATOM 1620 CG HIS A 107 1.519 2.367 25.467 1.00 0.00 C ATOM 1621 ND1 HIS A 107 1.148 2.684 26.758 1.00 0.00 N ATOM 1622 CD2 HIS A 107 2.063 3.492 24.930 1.00 0.00 C ATOM 1623 CE1 HIS A 107 1.500 3.986 26.933 1.00 0.00 C ATOM 1624 NE2 HIS A 107 2.066 4.510 25.862 1.00 0.00 N ATOM 0 H HIS A 107 1.030 -0.961 23.760 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.729 0.971 24.716 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.557 0.238 25.558 1.00 0.00 H new ATOM 0 HB3 HIS A 107 2.288 0.910 24.114 1.00 0.00 H new ATOM 0 HD1 HIS A 107 0.702 2.069 27.439 1.00 0.00 H new ATOM 0 HD2 HIS A 107 2.438 3.576 23.921 1.00 0.00 H new ATOM 0 HE1 HIS A 107 1.334 4.532 27.850 1.00 0.00 H new ATOM 1632 N VAL A 108 0.653 1.923 21.890 1.00 0.00 N ATOM 1633 CA VAL A 108 0.549 2.909 20.859 1.00 0.00 C ATOM 1634 C VAL A 108 -0.675 2.779 20.018 1.00 0.00 C ATOM 1635 O VAL A 108 -1.273 3.825 19.771 1.00 0.00 O ATOM 1636 CB VAL A 108 1.746 2.857 19.957 1.00 0.00 C ATOM 1637 CG1 VAL A 108 1.643 4.089 19.042 1.00 0.00 C ATOM 1638 CG2 VAL A 108 3.087 3.015 20.693 1.00 0.00 C ATOM 0 H VAL A 108 1.364 1.220 21.690 1.00 0.00 H new ATOM 0 HA VAL A 108 0.490 3.863 21.382 1.00 0.00 H new ATOM 0 HB VAL A 108 1.739 1.889 19.456 1.00 0.00 H new ATOM 0 HG11 VAL A 108 2.492 4.107 18.358 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.717 4.040 18.469 1.00 0.00 H new ATOM 0 HG13 VAL A 108 1.647 4.994 19.649 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.905 2.967 19.974 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.110 3.977 21.205 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.198 2.213 21.423 1.00 0.00 H new ATOM 1648 N MET A 109 -1.039 1.558 19.588 1.00 0.00 N ATOM 1649 CA MET A 109 -2.292 1.296 18.950 1.00 0.00 C ATOM 1650 C MET A 109 -3.509 1.389 19.804 1.00 0.00 C ATOM 1651 O MET A 109 -4.560 1.780 19.299 1.00 0.00 O ATOM 1652 CB MET A 109 -2.209 -0.055 18.219 1.00 0.00 C ATOM 1653 CG MET A 109 -1.526 -0.050 16.850 1.00 0.00 C ATOM 1654 SD MET A 109 0.069 0.804 16.662 1.00 0.00 S ATOM 1655 CE MET A 109 0.091 0.318 14.912 1.00 0.00 C ATOM 0 H MET A 109 -0.448 0.732 19.686 1.00 0.00 H new ATOM 0 HA MET A 109 -2.438 2.115 18.246 1.00 0.00 H new ATOM 0 HB2 MET A 109 -1.680 -0.759 18.862 1.00 0.00 H new ATOM 0 HB3 MET A 109 -3.222 -0.438 18.093 1.00 0.00 H new ATOM 0 HG2 MET A 109 -1.380 -1.088 16.551 1.00 0.00 H new ATOM 0 HG3 MET A 109 -2.222 0.392 16.137 1.00 0.00 H new ATOM 0 HE1 MET A 109 1.005 0.684 14.444 1.00 0.00 H new ATOM 0 HE2 MET A 109 0.054 -0.769 14.836 1.00 0.00 H new ATOM 0 HE3 MET A 109 -0.773 0.747 14.404 1.00 0.00 H new ATOM 1665 N THR A 110 -3.429 1.270 21.142 1.00 0.00 N ATOM 1666 CA THR A 110 -4.446 1.635 22.078 1.00 0.00 C ATOM 1667 C THR A 110 -4.740 3.095 22.114 1.00 0.00 C ATOM 1668 O THR A 110 -5.897 3.510 22.076 1.00 0.00 O ATOM 1669 CB THR A 110 -4.240 1.202 23.499 1.00 0.00 C ATOM 1670 OG1 THR A 110 -4.289 -0.213 23.605 1.00 0.00 O ATOM 1671 CG2 THR A 110 -5.299 1.777 24.455 1.00 0.00 C ATOM 0 H THR A 110 -2.598 0.894 21.599 1.00 0.00 H new ATOM 0 HA THR A 110 -5.286 1.073 21.669 1.00 0.00 H new ATOM 0 HB THR A 110 -3.260 1.583 23.785 1.00 0.00 H new ATOM 0 HG1 THR A 110 -3.561 -0.606 23.079 1.00 0.00 H new ATOM 0 HG21 THR A 110 -5.100 1.430 25.469 1.00 0.00 H new ATOM 0 HG22 THR A 110 -5.259 2.866 24.429 1.00 0.00 H new ATOM 0 HG23 THR A 110 -6.289 1.443 24.145 1.00 0.00 H new ATOM 1679 N ASN A 111 -3.649 3.877 22.209 1.00 0.00 N ATOM 1680 CA ASN A 111 -3.738 5.277 22.486 1.00 0.00 C ATOM 1681 C ASN A 111 -3.896 6.163 21.298 1.00 0.00 C ATOM 1682 O ASN A 111 -3.881 7.376 21.496 1.00 0.00 O ATOM 1683 CB ASN A 111 -2.497 5.593 23.338 1.00 0.00 C ATOM 1684 CG ASN A 111 -2.650 5.070 24.759 1.00 0.00 C ATOM 1685 OD1 ASN A 111 -3.695 4.672 25.272 1.00 0.00 O ATOM 1686 ND2 ASN A 111 -1.486 4.873 25.434 1.00 0.00 N ATOM 0 H ASN A 111 -2.695 3.534 22.092 1.00 0.00 H new ATOM 0 HA ASN A 111 -4.665 5.495 23.017 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -1.615 5.147 22.878 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -2.335 6.671 23.361 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -1.495 4.406 26.341 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -0.604 5.192 25.033 1.00 0.00 H new ATOM 1693 N LEU A 112 -4.124 5.635 20.082 1.00 0.00 N ATOM 1694 CA LEU A 112 -4.177 6.328 18.832 1.00 0.00 C ATOM 1695 C LEU A 112 -5.534 6.937 18.737 1.00 0.00 C ATOM 1696 O LEU A 112 -5.641 8.160 18.665 1.00 0.00 O ATOM 1697 CB LEU A 112 -3.647 5.525 17.632 1.00 0.00 C ATOM 1698 CG LEU A 112 -2.962 6.273 16.476 1.00 0.00 C ATOM 1699 CD1 LEU A 112 -1.874 7.299 16.834 1.00 0.00 C ATOM 1700 CD2 LEU A 112 -2.404 5.234 15.488 1.00 0.00 C ATOM 0 H LEU A 112 -4.285 4.635 19.966 1.00 0.00 H new ATOM 0 HA LEU A 112 -3.455 7.144 18.791 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -2.938 4.791 18.015 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -4.485 4.969 17.213 1.00 0.00 H new ATOM 0 HG LEU A 112 -3.747 6.895 16.046 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -1.481 7.746 15.921 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -2.302 8.078 17.465 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -1.066 6.801 17.370 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -1.914 5.746 14.660 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -1.682 4.597 15.999 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -3.220 4.622 15.104 1.00 0.00 H new ATOM 1712 N GLY A 113 -6.623 6.150 18.680 1.00 0.00 N ATOM 1713 CA GLY A 113 -7.965 6.642 18.668 1.00 0.00 C ATOM 1714 C GLY A 113 -9.050 5.628 18.534 1.00 0.00 C ATOM 1715 O GLY A 113 -9.911 5.474 19.398 1.00 0.00 O ATOM 0 H GLY A 113 -6.566 5.132 18.641 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -8.131 7.198 19.590 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -8.060 7.352 17.846 1.00 0.00 H new ATOM 1719 N GLU A 114 -9.039 4.744 17.521 1.00 0.00 N ATOM 1720 CA GLU A 114 -10.071 3.777 17.307 1.00 0.00 C ATOM 1721 C GLU A 114 -9.679 2.445 17.846 1.00 0.00 C ATOM 1722 O GLU A 114 -8.522 2.168 18.158 1.00 0.00 O ATOM 1723 CB GLU A 114 -10.244 3.651 15.784 1.00 0.00 C ATOM 1724 CG GLU A 114 -10.610 4.937 15.039 1.00 0.00 C ATOM 1725 CD GLU A 114 -10.983 4.672 13.587 1.00 0.00 C ATOM 1726 OE1 GLU A 114 -11.373 3.514 13.278 1.00 0.00 O ATOM 1727 OE2 GLU A 114 -10.627 5.547 12.753 1.00 0.00 O ATOM 0 H GLU A 114 -8.290 4.700 16.830 1.00 0.00 H new ATOM 0 HA GLU A 114 -10.986 4.092 17.809 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -9.316 3.264 15.364 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -11.017 2.908 15.587 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -11.445 5.423 15.544 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -9.769 5.629 15.076 1.00 0.00 H new ATOM 1734 N LYS A 115 -10.662 1.602 18.210 1.00 0.00 N ATOM 1735 CA LYS A 115 -10.379 0.499 19.075 1.00 0.00 C ATOM 1736 C LYS A 115 -9.988 -0.701 18.284 1.00 0.00 C ATOM 1737 O LYS A 115 -10.537 -1.045 17.238 1.00 0.00 O ATOM 1738 CB LYS A 115 -11.593 0.181 19.965 1.00 0.00 C ATOM 1739 CG LYS A 115 -11.882 1.208 21.062 1.00 0.00 C ATOM 1740 CD LYS A 115 -13.126 0.801 21.854 1.00 0.00 C ATOM 1741 CE LYS A 115 -13.158 -0.583 22.507 1.00 0.00 C ATOM 1742 NZ LYS A 115 -12.232 -0.610 23.661 1.00 0.00 N ATOM 0 H LYS A 115 -11.634 1.681 17.912 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.544 0.777 19.718 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -12.475 0.092 19.331 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -11.437 -0.792 20.432 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -11.025 1.286 21.732 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -12.031 2.192 20.618 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -13.275 1.541 22.640 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.983 0.871 21.184 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -14.171 -0.818 22.835 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -12.873 -1.345 21.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -12.255 -1.551 24.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -11.266 -0.404 23.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -12.523 0.106 24.356 1.00 0.00 H new ATOM 1756 N LEU A 116 -8.909 -1.347 18.761 1.00 0.00 N ATOM 1757 CA LEU A 116 -8.373 -2.584 18.283 1.00 0.00 C ATOM 1758 C LEU A 116 -8.473 -3.577 19.389 1.00 0.00 C ATOM 1759 O LEU A 116 -8.144 -3.254 20.530 1.00 0.00 O ATOM 1760 CB LEU A 116 -6.949 -2.456 17.716 1.00 0.00 C ATOM 1761 CG LEU A 116 -6.838 -1.845 16.309 1.00 0.00 C ATOM 1762 CD1 LEU A 116 -6.741 -0.311 16.363 1.00 0.00 C ATOM 1763 CD2 LEU A 116 -5.571 -2.204 15.514 1.00 0.00 C ATOM 0 H LEU A 116 -8.370 -0.974 19.542 1.00 0.00 H new ATOM 0 HA LEU A 116 -8.957 -2.924 17.428 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -6.359 -1.849 18.402 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -6.496 -3.447 17.697 1.00 0.00 H new ATOM 0 HG LEU A 116 -7.732 -2.248 15.833 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -6.664 0.085 15.350 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -7.632 0.093 16.844 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -5.858 -0.022 16.933 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -5.603 -1.717 14.539 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.691 -1.865 16.060 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -5.520 -3.284 15.378 1.00 0.00 H new ATOM 1775 N THR A 117 -8.730 -4.870 19.122 1.00 0.00 N ATOM 1776 CA THR A 117 -8.835 -5.790 20.212 1.00 0.00 C ATOM 1777 C THR A 117 -7.548 -6.509 20.429 1.00 0.00 C ATOM 1778 O THR A 117 -6.744 -6.756 19.531 1.00 0.00 O ATOM 1779 CB THR A 117 -9.834 -6.895 20.039 1.00 0.00 C ATOM 1780 OG1 THR A 117 -9.777 -7.724 18.888 1.00 0.00 O ATOM 1781 CG2 THR A 117 -11.226 -6.242 19.999 1.00 0.00 C ATOM 0 H THR A 117 -8.861 -5.267 18.192 1.00 0.00 H new ATOM 0 HA THR A 117 -9.139 -5.143 21.034 1.00 0.00 H new ATOM 0 HB THR A 117 -9.605 -7.561 20.871 1.00 0.00 H new ATOM 0 HG1 THR A 117 -10.493 -8.392 18.930 1.00 0.00 H new ATOM 0 HG21 THR A 117 -11.986 -7.013 19.874 1.00 0.00 H new ATOM 0 HG22 THR A 117 -11.403 -5.706 20.931 1.00 0.00 H new ATOM 0 HG23 THR A 117 -11.276 -5.544 19.164 1.00 0.00 H new ATOM 1789 N ASP A 118 -7.293 -6.925 21.683 1.00 0.00 N ATOM 1790 CA ASP A 118 -6.100 -7.591 22.105 1.00 0.00 C ATOM 1791 C ASP A 118 -5.792 -8.865 21.395 1.00 0.00 C ATOM 1792 O ASP A 118 -4.601 -9.124 21.230 1.00 0.00 O ATOM 1793 CB ASP A 118 -6.247 -7.903 23.604 1.00 0.00 C ATOM 1794 CG ASP A 118 -5.994 -6.790 24.611 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -5.542 -5.706 24.155 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -6.224 -6.936 25.841 1.00 0.00 O ATOM 0 H ASP A 118 -7.958 -6.788 22.445 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.276 -6.916 21.873 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -7.260 -8.272 23.767 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -5.567 -8.722 23.839 1.00 0.00 H new ATOM 1801 N GLU A 119 -6.800 -9.625 20.931 1.00 0.00 N ATOM 1802 CA GLU A 119 -6.593 -10.788 20.125 1.00 0.00 C ATOM 1803 C GLU A 119 -6.140 -10.503 18.734 1.00 0.00 C ATOM 1804 O GLU A 119 -5.206 -11.030 18.133 1.00 0.00 O ATOM 1805 CB GLU A 119 -7.890 -11.606 20.005 1.00 0.00 C ATOM 1806 CG GLU A 119 -7.847 -12.952 19.279 1.00 0.00 C ATOM 1807 CD GLU A 119 -9.035 -13.894 19.404 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -9.459 -14.190 20.553 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -9.549 -14.417 18.379 1.00 0.00 O ATOM 0 H GLU A 119 -7.782 -9.426 21.121 1.00 0.00 H new ATOM 0 HA GLU A 119 -5.803 -11.334 20.642 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.261 -11.787 21.014 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.628 -10.982 19.501 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.697 -12.750 18.218 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -6.964 -13.487 19.629 1.00 0.00 H new ATOM 1816 N GLU A 120 -6.795 -9.497 18.128 1.00 0.00 N ATOM 1817 CA GLU A 120 -6.442 -9.048 16.817 1.00 0.00 C ATOM 1818 C GLU A 120 -5.070 -8.467 16.781 1.00 0.00 C ATOM 1819 O GLU A 120 -4.319 -8.649 15.825 1.00 0.00 O ATOM 1820 CB GLU A 120 -7.453 -7.993 16.339 1.00 0.00 C ATOM 1821 CG GLU A 120 -7.151 -7.508 14.919 1.00 0.00 C ATOM 1822 CD GLU A 120 -8.188 -6.479 14.491 1.00 0.00 C ATOM 1823 OE1 GLU A 120 -9.365 -6.929 14.505 1.00 0.00 O ATOM 1824 OE2 GLU A 120 -7.949 -5.364 13.954 1.00 0.00 O ATOM 0 H GLU A 120 -7.574 -8.991 18.549 1.00 0.00 H new ATOM 0 HA GLU A 120 -6.460 -9.914 16.156 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -8.458 -8.414 16.372 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -7.440 -7.144 17.022 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.154 -7.070 14.879 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -7.156 -8.351 14.229 1.00 0.00 H new ATOM 1831 N VAL A 121 -4.610 -7.768 17.835 1.00 0.00 N ATOM 1832 CA VAL A 121 -3.373 -7.059 17.939 1.00 0.00 C ATOM 1833 C VAL A 121 -2.233 -8.016 18.006 1.00 0.00 C ATOM 1834 O VAL A 121 -1.259 -7.941 17.257 1.00 0.00 O ATOM 1835 CB VAL A 121 -3.483 -6.014 19.009 1.00 0.00 C ATOM 1836 CG1 VAL A 121 -2.124 -5.454 19.462 1.00 0.00 C ATOM 1837 CG2 VAL A 121 -4.187 -4.845 18.299 1.00 0.00 C ATOM 0 H VAL A 121 -5.157 -7.694 18.693 1.00 0.00 H new ATOM 0 HA VAL A 121 -3.146 -6.482 17.043 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.978 -6.438 19.883 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.280 -4.703 20.237 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -1.511 -6.263 19.859 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -1.617 -4.998 18.612 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -4.318 -4.020 18.999 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -3.581 -4.513 17.456 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -5.162 -5.173 17.938 1.00 0.00 H new ATOM 1847 N ASP A 122 -2.343 -9.063 18.842 1.00 0.00 N ATOM 1848 CA ASP A 122 -1.433 -10.160 18.962 1.00 0.00 C ATOM 1849 C ASP A 122 -1.307 -10.911 17.682 1.00 0.00 C ATOM 1850 O ASP A 122 -0.224 -11.300 17.247 1.00 0.00 O ATOM 1851 CB ASP A 122 -1.746 -11.131 20.114 1.00 0.00 C ATOM 1852 CG ASP A 122 -1.381 -10.500 21.450 1.00 0.00 C ATOM 1853 OD1 ASP A 122 -0.878 -9.350 21.568 1.00 0.00 O ATOM 1854 OD2 ASP A 122 -1.516 -11.270 22.438 1.00 0.00 O ATOM 0 H ASP A 122 -3.131 -9.148 19.484 1.00 0.00 H new ATOM 0 HA ASP A 122 -0.479 -9.694 19.208 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -2.805 -11.390 20.103 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -1.190 -12.059 19.978 1.00 0.00 H new ATOM 1859 N GLU A 123 -2.454 -11.198 17.040 1.00 0.00 N ATOM 1860 CA GLU A 123 -2.466 -11.823 15.754 1.00 0.00 C ATOM 1861 C GLU A 123 -1.724 -11.007 14.752 1.00 0.00 C ATOM 1862 O GLU A 123 -0.957 -11.490 13.921 1.00 0.00 O ATOM 1863 CB GLU A 123 -3.874 -12.106 15.204 1.00 0.00 C ATOM 1864 CG GLU A 123 -3.950 -12.807 13.847 1.00 0.00 C ATOM 1865 CD GLU A 123 -5.359 -13.057 13.327 1.00 0.00 C ATOM 1866 OE1 GLU A 123 -6.088 -12.030 13.289 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -5.677 -14.193 12.884 1.00 0.00 O ATOM 0 H GLU A 123 -3.380 -10.995 17.416 1.00 0.00 H new ATOM 0 HA GLU A 123 -1.975 -12.783 15.911 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -4.408 -12.715 15.933 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -4.407 -11.158 15.128 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -3.410 -12.207 13.115 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -3.431 -13.763 13.920 1.00 0.00 H new ATOM 1874 N MET A 124 -1.859 -9.669 14.782 1.00 0.00 N ATOM 1875 CA MET A 124 -1.227 -8.694 13.949 1.00 0.00 C ATOM 1876 C MET A 124 0.249 -8.583 14.120 1.00 0.00 C ATOM 1877 O MET A 124 0.994 -8.496 13.145 1.00 0.00 O ATOM 1878 CB MET A 124 -1.938 -7.336 14.078 1.00 0.00 C ATOM 1879 CG MET A 124 -1.329 -6.257 13.180 1.00 0.00 C ATOM 1880 SD MET A 124 -2.170 -4.646 13.191 1.00 0.00 S ATOM 1881 CE MET A 124 -1.671 -3.979 14.805 1.00 0.00 C ATOM 0 H MET A 124 -2.477 -9.227 15.463 1.00 0.00 H new ATOM 0 HA MET A 124 -1.340 -9.054 12.927 1.00 0.00 H new ATOM 0 HB2 MET A 124 -2.992 -7.458 13.827 1.00 0.00 H new ATOM 0 HB3 MET A 124 -1.894 -7.005 15.116 1.00 0.00 H new ATOM 0 HG2 MET A 124 -0.292 -6.106 13.479 1.00 0.00 H new ATOM 0 HG3 MET A 124 -1.314 -6.630 12.156 1.00 0.00 H new ATOM 0 HE1 MET A 124 -2.115 -2.994 14.945 1.00 0.00 H new ATOM 0 HE2 MET A 124 -2.013 -4.647 15.596 1.00 0.00 H new ATOM 0 HE3 MET A 124 -0.585 -3.896 14.844 1.00 0.00 H new ATOM 1891 N ILE A 125 0.712 -8.554 15.383 1.00 0.00 N ATOM 1892 CA ILE A 125 2.065 -8.623 15.840 1.00 0.00 C ATOM 1893 C ILE A 125 2.669 -9.932 15.462 1.00 0.00 C ATOM 1894 O ILE A 125 3.821 -9.932 15.033 1.00 0.00 O ATOM 1895 CB ILE A 125 2.232 -8.412 17.315 1.00 0.00 C ATOM 1896 CG1 ILE A 125 1.972 -6.925 17.612 1.00 0.00 C ATOM 1897 CG2 ILE A 125 3.622 -8.805 17.841 1.00 0.00 C ATOM 1898 CD1 ILE A 125 1.341 -6.490 18.934 1.00 0.00 C ATOM 0 H ILE A 125 0.064 -8.473 16.167 1.00 0.00 H new ATOM 0 HA ILE A 125 2.580 -7.797 15.348 1.00 0.00 H new ATOM 0 HB ILE A 125 1.521 -9.062 17.826 1.00 0.00 H new ATOM 0 HG12 ILE A 125 2.929 -6.410 17.529 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.335 -6.545 16.813 1.00 0.00 H new ATOM 0 HG21 ILE A 125 3.669 -8.625 18.915 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.801 -9.862 17.642 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.383 -8.207 17.339 1.00 0.00 H new ATOM 0 HD11 ILE A 125 1.241 -5.405 18.950 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.356 -6.946 19.035 1.00 0.00 H new ATOM 0 HD13 ILE A 125 1.975 -6.808 19.762 1.00 0.00 H new ATOM 1910 N ARG A 126 1.961 -11.058 15.668 1.00 0.00 N ATOM 1911 CA ARG A 126 2.600 -12.337 15.643 1.00 0.00 C ATOM 1912 C ARG A 126 2.880 -12.765 14.243 1.00 0.00 C ATOM 1913 O ARG A 126 3.873 -13.384 13.866 1.00 0.00 O ATOM 1914 CB ARG A 126 1.766 -13.421 16.348 1.00 0.00 C ATOM 1915 CG ARG A 126 2.435 -14.773 16.603 1.00 0.00 C ATOM 1916 CD ARG A 126 1.593 -15.632 17.549 1.00 0.00 C ATOM 1917 NE ARG A 126 2.293 -16.903 17.890 1.00 0.00 N ATOM 1918 CZ ARG A 126 3.545 -16.942 18.432 1.00 0.00 C ATOM 1919 NH1 ARG A 126 3.884 -16.083 19.438 1.00 0.00 N ATOM 1920 NH2 ARG A 126 4.493 -17.871 18.112 1.00 0.00 N ATOM 0 H ARG A 126 0.958 -11.083 15.850 1.00 0.00 H new ATOM 0 HA ARG A 126 3.538 -12.223 16.186 1.00 0.00 H new ATOM 0 HB2 ARG A 126 1.438 -13.022 17.308 1.00 0.00 H new ATOM 0 HB3 ARG A 126 0.870 -13.596 15.753 1.00 0.00 H new ATOM 0 HG2 ARG A 126 2.575 -15.297 15.658 1.00 0.00 H new ATOM 0 HG3 ARG A 126 3.425 -14.618 17.031 1.00 0.00 H new ATOM 0 HD2 ARG A 126 1.383 -15.074 18.461 1.00 0.00 H new ATOM 0 HD3 ARG A 126 0.633 -15.856 17.084 1.00 0.00 H new ATOM 0 HE ARG A 126 1.814 -17.785 17.710 1.00 0.00 H new ATOM 0 HH11 ARG A 126 3.201 -15.410 19.786 1.00 0.00 H new ATOM 0 HH12 ARG A 126 4.820 -16.114 19.841 1.00 0.00 H new ATOM 0 HH21 ARG A 126 4.285 -18.597 17.427 1.00 0.00 H new ATOM 0 HH22 ARG A 126 5.410 -17.839 18.558 1.00 0.00 H new ATOM 1934 N GLU A 127 1.892 -12.420 13.398 1.00 0.00 N ATOM 1935 CA GLU A 127 2.043 -12.603 11.988 1.00 0.00 C ATOM 1936 C GLU A 127 3.185 -11.818 11.440 1.00 0.00 C ATOM 1937 O GLU A 127 4.050 -12.301 10.711 1.00 0.00 O ATOM 1938 CB GLU A 127 0.655 -12.434 11.349 1.00 0.00 C ATOM 1939 CG GLU A 127 -0.266 -13.648 11.491 1.00 0.00 C ATOM 1940 CD GLU A 127 0.185 -14.869 10.703 1.00 0.00 C ATOM 1941 OE1 GLU A 127 0.214 -14.757 9.448 1.00 0.00 O ATOM 1942 OE2 GLU A 127 0.590 -15.895 11.313 1.00 0.00 O ATOM 0 H GLU A 127 0.999 -12.019 13.686 1.00 0.00 H new ATOM 0 HA GLU A 127 2.362 -13.610 11.721 1.00 0.00 H new ATOM 0 HB2 GLU A 127 0.166 -11.569 11.798 1.00 0.00 H new ATOM 0 HB3 GLU A 127 0.782 -12.213 10.289 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -0.336 -13.916 12.545 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -1.268 -13.370 11.166 1.00 0.00 H new ATOM 1949 N ALA A 128 3.274 -10.520 11.783 1.00 0.00 N ATOM 1950 CA ALA A 128 4.293 -9.605 11.371 1.00 0.00 C ATOM 1951 C ALA A 128 5.635 -10.011 11.874 1.00 0.00 C ATOM 1952 O ALA A 128 6.633 -9.767 11.198 1.00 0.00 O ATOM 1953 CB ALA A 128 3.763 -8.190 11.662 1.00 0.00 C ATOM 0 H ALA A 128 2.584 -10.080 12.392 1.00 0.00 H new ATOM 0 HA ALA A 128 4.498 -9.614 10.300 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.509 -7.453 11.363 1.00 0.00 H new ATOM 0 HB2 ALA A 128 2.843 -8.023 11.101 1.00 0.00 H new ATOM 0 HB3 ALA A 128 3.561 -8.089 12.728 1.00 0.00 H new ATOM 1959 N ASP A 129 5.746 -10.584 13.086 1.00 0.00 N ATOM 1960 CA ASP A 129 7.049 -10.686 13.667 1.00 0.00 C ATOM 1961 C ASP A 129 7.625 -11.996 13.252 1.00 0.00 C ATOM 1962 O ASP A 129 7.417 -13.043 13.863 1.00 0.00 O ATOM 1963 CB ASP A 129 6.983 -10.507 15.193 1.00 0.00 C ATOM 1964 CG ASP A 129 8.384 -10.578 15.784 1.00 0.00 C ATOM 1965 OD1 ASP A 129 9.344 -10.295 15.019 1.00 0.00 O ATOM 1966 OD2 ASP A 129 8.580 -11.097 16.916 1.00 0.00 O ATOM 0 H ASP A 129 4.977 -10.960 13.641 1.00 0.00 H new ATOM 0 HA ASP A 129 7.703 -9.889 13.313 1.00 0.00 H new ATOM 0 HB2 ASP A 129 6.525 -9.548 15.436 1.00 0.00 H new ATOM 0 HB3 ASP A 129 6.354 -11.282 15.632 1.00 0.00 H new ATOM 1971 N ILE A 130 8.338 -11.947 12.113 1.00 0.00 N ATOM 1972 CA ILE A 130 9.039 -13.066 11.565 1.00 0.00 C ATOM 1973 C ILE A 130 10.239 -13.567 12.293 1.00 0.00 C ATOM 1974 O ILE A 130 10.521 -14.759 12.186 1.00 0.00 O ATOM 1975 CB ILE A 130 9.326 -12.929 10.099 1.00 0.00 C ATOM 1976 CG1 ILE A 130 9.313 -14.235 9.286 1.00 0.00 C ATOM 1977 CG2 ILE A 130 10.634 -12.210 9.726 1.00 0.00 C ATOM 1978 CD1 ILE A 130 9.140 -14.069 7.777 1.00 0.00 C ATOM 0 H ILE A 130 8.430 -11.099 11.554 1.00 0.00 H new ATOM 0 HA ILE A 130 8.299 -13.852 11.719 1.00 0.00 H new ATOM 0 HB ILE A 130 8.472 -12.308 9.828 1.00 0.00 H new ATOM 0 HG12 ILE A 130 10.246 -14.767 9.471 1.00 0.00 H new ATOM 0 HG13 ILE A 130 8.507 -14.867 9.659 1.00 0.00 H new ATOM 0 HG21 ILE A 130 10.732 -12.172 8.641 1.00 0.00 H new ATOM 0 HG22 ILE A 130 10.618 -11.196 10.125 1.00 0.00 H new ATOM 0 HG23 ILE A 130 11.480 -12.752 10.148 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.145 -15.049 7.300 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.193 -13.570 7.572 1.00 0.00 H new ATOM 0 HD13 ILE A 130 9.959 -13.469 7.381 1.00 0.00 H new ATOM 1990 N ASP A 131 10.889 -12.681 13.069 1.00 0.00 N ATOM 1991 CA ASP A 131 11.993 -13.122 13.864 1.00 0.00 C ATOM 1992 C ASP A 131 11.642 -14.051 14.974 1.00 0.00 C ATOM 1993 O ASP A 131 12.515 -14.788 15.430 1.00 0.00 O ATOM 1994 CB ASP A 131 12.775 -11.939 14.461 1.00 0.00 C ATOM 1995 CG ASP A 131 13.148 -10.877 13.436 1.00 0.00 C ATOM 1996 OD1 ASP A 131 13.939 -11.114 12.484 1.00 0.00 O ATOM 1997 OD2 ASP A 131 12.502 -9.798 13.513 1.00 0.00 O ATOM 0 H ASP A 131 10.660 -11.690 13.146 1.00 0.00 H new ATOM 0 HA ASP A 131 12.606 -13.679 13.155 1.00 0.00 H new ATOM 0 HB2 ASP A 131 12.177 -11.479 15.248 1.00 0.00 H new ATOM 0 HB3 ASP A 131 13.684 -12.315 14.930 1.00 0.00 H new ATOM 2002 N GLY A 132 10.399 -13.873 15.456 1.00 0.00 N ATOM 2003 CA GLY A 132 10.009 -14.260 16.777 1.00 0.00 C ATOM 2004 C GLY A 132 10.674 -13.532 17.894 1.00 0.00 C ATOM 2005 O GLY A 132 10.857 -14.047 18.997 1.00 0.00 O ATOM 0 H GLY A 132 9.646 -13.449 14.914 1.00 0.00 H new ATOM 0 HA2 GLY A 132 8.932 -14.123 16.871 1.00 0.00 H new ATOM 0 HA3 GLY A 132 10.207 -15.325 16.895 1.00 0.00 H new ATOM 2009 N ASP A 133 11.231 -12.331 17.657 1.00 0.00 N ATOM 2010 CA ASP A 133 12.072 -11.673 18.609 1.00 0.00 C ATOM 2011 C ASP A 133 11.229 -10.887 19.554 1.00 0.00 C ATOM 2012 O ASP A 133 11.653 -10.484 20.636 1.00 0.00 O ATOM 2013 CB ASP A 133 13.075 -10.729 17.923 1.00 0.00 C ATOM 2014 CG ASP A 133 12.621 -9.378 17.391 1.00 0.00 C ATOM 2015 OD1 ASP A 133 11.595 -9.264 16.669 1.00 0.00 O ATOM 2016 OD2 ASP A 133 13.409 -8.395 17.421 1.00 0.00 O ATOM 0 H ASP A 133 11.096 -11.808 16.792 1.00 0.00 H new ATOM 0 HA ASP A 133 12.635 -12.437 19.145 1.00 0.00 H new ATOM 0 HB2 ASP A 133 13.879 -10.541 18.634 1.00 0.00 H new ATOM 0 HB3 ASP A 133 13.511 -11.275 17.086 1.00 0.00 H new ATOM 2021 N GLY A 134 9.994 -10.540 19.151 1.00 0.00 N ATOM 2022 CA GLY A 134 9.055 -9.945 20.050 1.00 0.00 C ATOM 2023 C GLY A 134 8.905 -8.485 19.792 1.00 0.00 C ATOM 2024 O GLY A 134 8.088 -7.734 20.322 1.00 0.00 O ATOM 0 H GLY A 134 9.645 -10.672 18.202 1.00 0.00 H new ATOM 0 HA2 GLY A 134 8.087 -10.436 19.945 1.00 0.00 H new ATOM 0 HA3 GLY A 134 9.383 -10.103 21.078 1.00 0.00 H new ATOM 2028 N GLN A 135 9.674 -7.982 18.810 1.00 0.00 N ATOM 2029 CA GLN A 135 9.620 -6.600 18.447 1.00 0.00 C ATOM 2030 C GLN A 135 9.193 -6.441 17.028 1.00 0.00 C ATOM 2031 O GLN A 135 9.339 -7.389 16.259 1.00 0.00 O ATOM 2032 CB GLN A 135 11.043 -6.025 18.537 1.00 0.00 C ATOM 2033 CG GLN A 135 11.569 -6.130 19.970 1.00 0.00 C ATOM 2034 CD GLN A 135 12.972 -5.544 20.053 1.00 0.00 C ATOM 2035 OE1 GLN A 135 13.148 -4.498 20.676 1.00 0.00 O ATOM 2036 NE2 GLN A 135 13.951 -6.145 19.325 1.00 0.00 N ATOM 0 H GLN A 135 10.336 -8.535 18.265 1.00 0.00 H new ATOM 0 HA GLN A 135 8.918 -6.096 19.111 1.00 0.00 H new ATOM 0 HB2 GLN A 135 11.704 -6.565 17.859 1.00 0.00 H new ATOM 0 HB3 GLN A 135 11.042 -4.983 18.218 1.00 0.00 H new ATOM 0 HG2 GLN A 135 10.903 -5.599 20.651 1.00 0.00 H new ATOM 0 HG3 GLN A 135 11.582 -7.173 20.286 1.00 0.00 H new ATOM 0 HE21 GLN A 135 13.755 -7.012 18.825 1.00 0.00 H new ATOM 0 HE22 GLN A 135 14.881 -5.728 19.279 1.00 0.00 H new ATOM 2045 N VAL A 136 8.626 -5.299 16.601 1.00 0.00 N ATOM 2046 CA VAL A 136 8.287 -4.896 15.271 1.00 0.00 C ATOM 2047 C VAL A 136 9.357 -3.932 14.888 1.00 0.00 C ATOM 2048 O VAL A 136 9.694 -3.054 15.681 1.00 0.00 O ATOM 2049 CB VAL A 136 6.873 -4.405 15.176 1.00 0.00 C ATOM 2050 CG1 VAL A 136 6.607 -3.440 14.008 1.00 0.00 C ATOM 2051 CG2 VAL A 136 5.980 -5.654 15.266 1.00 0.00 C ATOM 0 H VAL A 136 8.376 -4.573 17.272 1.00 0.00 H new ATOM 0 HA VAL A 136 8.273 -5.714 14.551 1.00 0.00 H new ATOM 0 HB VAL A 136 6.627 -3.740 16.004 1.00 0.00 H new ATOM 0 HG11 VAL A 136 5.560 -3.137 14.018 1.00 0.00 H new ATOM 0 HG12 VAL A 136 7.241 -2.559 14.112 1.00 0.00 H new ATOM 0 HG13 VAL A 136 6.832 -3.939 13.065 1.00 0.00 H new ATOM 0 HG21 VAL A 136 4.933 -5.358 15.202 1.00 0.00 H new ATOM 0 HG22 VAL A 136 6.217 -6.330 14.445 1.00 0.00 H new ATOM 0 HG23 VAL A 136 6.157 -6.160 16.215 1.00 0.00 H new ATOM 2061 N ASN A 137 9.979 -4.168 13.719 1.00 0.00 N ATOM 2062 CA ASN A 137 10.961 -3.366 13.057 1.00 0.00 C ATOM 2063 C ASN A 137 10.364 -2.672 11.882 1.00 0.00 C ATOM 2064 O ASN A 137 9.148 -2.662 11.695 1.00 0.00 O ATOM 2065 CB ASN A 137 12.291 -4.083 12.768 1.00 0.00 C ATOM 2066 CG ASN A 137 12.201 -5.040 11.588 1.00 0.00 C ATOM 2067 OD1 ASN A 137 11.638 -4.848 10.511 1.00 0.00 O ATOM 2068 ND2 ASN A 137 12.974 -6.134 11.820 1.00 0.00 N ATOM 0 H ASN A 137 9.770 -5.010 13.183 1.00 0.00 H new ATOM 0 HA ASN A 137 11.267 -2.595 13.764 1.00 0.00 H new ATOM 0 HB2 ASN A 137 13.063 -3.340 12.569 1.00 0.00 H new ATOM 0 HB3 ASN A 137 12.601 -4.635 13.655 1.00 0.00 H new ATOM 0 HD21 ASN A 137 13.104 -6.832 11.087 1.00 0.00 H new ATOM 0 HD22 ASN A 137 13.424 -6.257 12.727 1.00 0.00 H new ATOM 2075 N TYR A 138 11.225 -1.948 11.145 1.00 0.00 N ATOM 2076 CA TYR A 138 10.711 -1.120 10.099 1.00 0.00 C ATOM 2077 C TYR A 138 10.064 -1.922 9.022 1.00 0.00 C ATOM 2078 O TYR A 138 8.937 -1.640 8.618 1.00 0.00 O ATOM 2079 CB TYR A 138 11.665 -0.004 9.642 1.00 0.00 C ATOM 2080 CG TYR A 138 11.000 0.829 8.600 1.00 0.00 C ATOM 2081 CD1 TYR A 138 9.792 1.441 8.833 1.00 0.00 C ATOM 2082 CD2 TYR A 138 11.486 0.920 7.317 1.00 0.00 C ATOM 2083 CE1 TYR A 138 9.088 2.100 7.853 1.00 0.00 C ATOM 2084 CE2 TYR A 138 10.786 1.514 6.293 1.00 0.00 C ATOM 2085 CZ TYR A 138 9.577 2.109 6.568 1.00 0.00 C ATOM 2086 OH TYR A 138 8.884 2.750 5.520 1.00 0.00 O ATOM 0 H TYR A 138 12.238 -1.933 11.265 1.00 0.00 H new ATOM 0 HA TYR A 138 9.897 -0.536 10.529 1.00 0.00 H new ATOM 0 HB2 TYR A 138 11.948 0.617 10.492 1.00 0.00 H new ATOM 0 HB3 TYR A 138 12.583 -0.437 9.244 1.00 0.00 H new ATOM 0 HD1 TYR A 138 9.377 1.403 9.830 1.00 0.00 H new ATOM 0 HD2 TYR A 138 12.461 0.507 7.104 1.00 0.00 H new ATOM 0 HE1 TYR A 138 8.163 2.604 8.090 1.00 0.00 H new ATOM 0 HE2 TYR A 138 11.180 1.513 5.287 1.00 0.00 H new ATOM 0 HH TYR A 138 9.387 2.649 4.685 1.00 0.00 H new ATOM 2096 N GLU A 139 10.670 -3.013 8.521 1.00 0.00 N ATOM 2097 CA GLU A 139 10.070 -3.812 7.498 1.00 0.00 C ATOM 2098 C GLU A 139 8.852 -4.575 7.889 1.00 0.00 C ATOM 2099 O GLU A 139 8.028 -4.933 7.048 1.00 0.00 O ATOM 2100 CB GLU A 139 11.097 -4.668 6.738 1.00 0.00 C ATOM 2101 CG GLU A 139 11.944 -3.813 5.794 1.00 0.00 C ATOM 2102 CD GLU A 139 13.209 -4.495 5.292 1.00 0.00 C ATOM 2103 OE1 GLU A 139 13.094 -5.748 5.222 1.00 0.00 O ATOM 2104 OE2 GLU A 139 14.217 -3.915 4.806 1.00 0.00 O ATOM 0 H GLU A 139 11.585 -3.344 8.828 1.00 0.00 H new ATOM 0 HA GLU A 139 9.680 -3.073 6.798 1.00 0.00 H new ATOM 0 HB2 GLU A 139 11.746 -5.179 7.450 1.00 0.00 H new ATOM 0 HB3 GLU A 139 10.580 -5.439 6.168 1.00 0.00 H new ATOM 0 HG2 GLU A 139 11.335 -3.528 4.936 1.00 0.00 H new ATOM 0 HG3 GLU A 139 12.221 -2.893 6.308 1.00 0.00 H new ATOM 2111 N GLU A 140 8.744 -4.858 9.200 1.00 0.00 N ATOM 2112 CA GLU A 140 7.538 -5.461 9.676 1.00 0.00 C ATOM 2113 C GLU A 140 6.423 -4.482 9.808 1.00 0.00 C ATOM 2114 O GLU A 140 5.283 -4.795 9.472 1.00 0.00 O ATOM 2115 CB GLU A 140 7.956 -6.072 11.025 1.00 0.00 C ATOM 2116 CG GLU A 140 9.060 -7.126 10.931 1.00 0.00 C ATOM 2117 CD GLU A 140 9.510 -7.606 12.303 1.00 0.00 C ATOM 2118 OE1 GLU A 140 9.818 -6.748 13.174 1.00 0.00 O ATOM 2119 OE2 GLU A 140 9.567 -8.830 12.595 1.00 0.00 O ATOM 0 H GLU A 140 9.459 -4.679 9.905 1.00 0.00 H new ATOM 0 HA GLU A 140 7.138 -6.205 8.986 1.00 0.00 H new ATOM 0 HB2 GLU A 140 8.292 -5.271 11.684 1.00 0.00 H new ATOM 0 HB3 GLU A 140 7.080 -6.523 11.492 1.00 0.00 H new ATOM 0 HG2 GLU A 140 8.701 -7.975 10.350 1.00 0.00 H new ATOM 0 HG3 GLU A 140 9.913 -6.710 10.395 1.00 0.00 H new ATOM 2126 N PHE A 141 6.655 -3.233 10.251 1.00 0.00 N ATOM 2127 CA PHE A 141 5.774 -2.107 10.202 1.00 0.00 C ATOM 2128 C PHE A 141 5.320 -1.740 8.832 1.00 0.00 C ATOM 2129 O PHE A 141 4.176 -1.309 8.701 1.00 0.00 O ATOM 2130 CB PHE A 141 6.331 -0.905 10.983 1.00 0.00 C ATOM 2131 CG PHE A 141 5.345 0.125 11.414 1.00 0.00 C ATOM 2132 CD1 PHE A 141 4.460 -0.055 12.451 1.00 0.00 C ATOM 2133 CD2 PHE A 141 5.234 1.297 10.704 1.00 0.00 C ATOM 2134 CE1 PHE A 141 3.723 1.003 12.929 1.00 0.00 C ATOM 2135 CE2 PHE A 141 4.525 2.379 11.171 1.00 0.00 C ATOM 2136 CZ PHE A 141 3.738 2.219 12.287 1.00 0.00 C ATOM 0 H PHE A 141 7.546 -2.991 10.685 1.00 0.00 H new ATOM 0 HA PHE A 141 4.867 -2.432 10.711 1.00 0.00 H new ATOM 0 HB2 PHE A 141 6.840 -1.282 11.870 1.00 0.00 H new ATOM 0 HB3 PHE A 141 7.085 -0.417 10.365 1.00 0.00 H new ATOM 0 HD1 PHE A 141 4.343 -1.034 12.893 1.00 0.00 H new ATOM 0 HD2 PHE A 141 5.722 1.371 9.743 1.00 0.00 H new ATOM 0 HE1 PHE A 141 3.125 0.877 13.820 1.00 0.00 H new ATOM 0 HE2 PHE A 141 4.585 3.335 10.671 1.00 0.00 H new ATOM 0 HZ PHE A 141 3.139 3.039 12.655 1.00 0.00 H new ATOM 2146 N VAL A 142 6.141 -1.910 7.780 1.00 0.00 N ATOM 2147 CA VAL A 142 5.730 -1.687 6.428 1.00 0.00 C ATOM 2148 C VAL A 142 4.731 -2.732 6.068 1.00 0.00 C ATOM 2149 O VAL A 142 3.589 -2.478 5.687 1.00 0.00 O ATOM 2150 CB VAL A 142 6.878 -1.762 5.465 1.00 0.00 C ATOM 2151 CG1 VAL A 142 6.420 -1.630 4.003 1.00 0.00 C ATOM 2152 CG2 VAL A 142 7.867 -0.607 5.698 1.00 0.00 C ATOM 0 H VAL A 142 7.112 -2.209 7.871 1.00 0.00 H new ATOM 0 HA VAL A 142 5.308 -0.684 6.360 1.00 0.00 H new ATOM 0 HB VAL A 142 7.339 -2.735 5.638 1.00 0.00 H new ATOM 0 HG11 VAL A 142 7.286 -1.690 3.344 1.00 0.00 H new ATOM 0 HG12 VAL A 142 5.726 -2.436 3.765 1.00 0.00 H new ATOM 0 HG13 VAL A 142 5.923 -0.670 3.863 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.690 -0.684 4.988 1.00 0.00 H new ATOM 0 HG22 VAL A 142 7.354 0.345 5.558 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.258 -0.662 6.714 1.00 0.00 H new ATOM 2162 N GLN A 143 5.015 -4.034 6.246 1.00 0.00 N ATOM 2163 CA GLN A 143 4.090 -5.074 5.919 1.00 0.00 C ATOM 2164 C GLN A 143 2.881 -5.107 6.790 1.00 0.00 C ATOM 2165 O GLN A 143 1.774 -5.427 6.360 1.00 0.00 O ATOM 2166 CB GLN A 143 4.855 -6.409 5.932 1.00 0.00 C ATOM 2167 CG GLN A 143 3.975 -7.466 5.260 1.00 0.00 C ATOM 2168 CD GLN A 143 4.784 -8.747 5.123 1.00 0.00 C ATOM 2169 OE1 GLN A 143 5.722 -9.063 5.854 1.00 0.00 O ATOM 2170 NE2 GLN A 143 4.649 -9.565 4.045 1.00 0.00 N ATOM 0 H GLN A 143 5.901 -4.370 6.623 1.00 0.00 H new ATOM 0 HA GLN A 143 3.687 -4.878 4.925 1.00 0.00 H new ATOM 0 HB2 GLN A 143 5.803 -6.310 5.403 1.00 0.00 H new ATOM 0 HB3 GLN A 143 5.090 -6.703 6.955 1.00 0.00 H new ATOM 0 HG2 GLN A 143 3.078 -7.645 5.853 1.00 0.00 H new ATOM 0 HG3 GLN A 143 3.646 -7.119 4.281 1.00 0.00 H new ATOM 0 HE21 GLN A 143 3.904 -9.399 3.369 1.00 0.00 H new ATOM 0 HE22 GLN A 143 5.293 -10.345 3.913 1.00 0.00 H new ATOM 2179 N MET A 144 3.057 -4.762 8.078 1.00 0.00 N ATOM 2180 CA MET A 144 1.917 -4.466 8.889 1.00 0.00 C ATOM 2181 C MET A 144 1.029 -3.365 8.420 1.00 0.00 C ATOM 2182 O MET A 144 -0.178 -3.601 8.401 1.00 0.00 O ATOM 2183 CB MET A 144 2.426 -4.295 10.330 1.00 0.00 C ATOM 2184 CG MET A 144 1.267 -4.180 11.321 1.00 0.00 C ATOM 2185 SD MET A 144 1.779 -3.720 13.004 1.00 0.00 S ATOM 2186 CE MET A 144 2.741 -5.202 13.422 1.00 0.00 C ATOM 0 H MET A 144 3.960 -4.689 8.547 1.00 0.00 H new ATOM 0 HA MET A 144 1.223 -5.304 8.817 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.054 -5.144 10.599 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.051 -3.404 10.394 1.00 0.00 H new ATOM 0 HG2 MET A 144 0.559 -3.438 10.952 1.00 0.00 H new ATOM 0 HG3 MET A 144 0.739 -5.133 11.360 1.00 0.00 H new ATOM 0 HE1 MET A 144 2.704 -5.368 14.499 1.00 0.00 H new ATOM 0 HE2 MET A 144 2.320 -6.066 12.907 1.00 0.00 H new ATOM 0 HE3 MET A 144 3.777 -5.063 13.111 1.00 0.00 H new ATOM 2196 N MET A 145 1.529 -2.179 8.030 1.00 0.00 N ATOM 2197 CA MET A 145 0.735 -1.054 7.644 1.00 0.00 C ATOM 2198 C MET A 145 0.259 -1.052 6.232 1.00 0.00 C ATOM 2199 O MET A 145 -0.619 -0.230 5.974 1.00 0.00 O ATOM 2200 CB MET A 145 1.348 0.323 7.950 1.00 0.00 C ATOM 2201 CG MET A 145 1.676 0.543 9.428 1.00 0.00 C ATOM 2202 SD MET A 145 0.241 0.894 10.488 1.00 0.00 S ATOM 2203 CE MET A 145 0.101 -0.790 11.152 1.00 0.00 C ATOM 0 H MET A 145 2.531 -1.996 7.982 1.00 0.00 H new ATOM 0 HA MET A 145 -0.127 -1.203 8.294 1.00 0.00 H new ATOM 0 HB2 MET A 145 2.260 0.442 7.364 1.00 0.00 H new ATOM 0 HB3 MET A 145 0.656 1.099 7.623 1.00 0.00 H new ATOM 0 HG2 MET A 145 2.182 -0.344 9.809 1.00 0.00 H new ATOM 0 HG3 MET A 145 2.380 1.371 9.509 1.00 0.00 H new ATOM 0 HE1 MET A 145 -0.327 -0.752 12.154 1.00 0.00 H new ATOM 0 HE2 MET A 145 -0.544 -1.384 10.504 1.00 0.00 H new ATOM 0 HE3 MET A 145 1.090 -1.247 11.197 1.00 0.00 H new ATOM 2213 N THR A 146 0.866 -1.864 5.349 1.00 0.00 N ATOM 2214 CA THR A 146 0.434 -2.015 3.994 1.00 0.00 C ATOM 2215 C THR A 146 -0.715 -2.958 3.887 1.00 0.00 C ATOM 2216 O THR A 146 -1.307 -3.077 2.816 1.00 0.00 O ATOM 2217 CB THR A 146 1.551 -2.325 3.042 1.00 0.00 C ATOM 2218 OG1 THR A 146 2.254 -3.528 3.313 1.00 0.00 O ATOM 2219 CG2 THR A 146 2.559 -1.166 2.962 1.00 0.00 C ATOM 0 H THR A 146 1.680 -2.432 5.584 1.00 0.00 H new ATOM 0 HA THR A 146 0.068 -1.040 3.674 1.00 0.00 H new ATOM 0 HB THR A 146 1.049 -2.464 2.085 1.00 0.00 H new ATOM 0 HG1 THR A 146 2.961 -3.651 2.645 1.00 0.00 H new ATOM 0 HG21 THR A 146 3.355 -1.424 2.264 1.00 0.00 H new ATOM 0 HG22 THR A 146 2.051 -0.265 2.617 1.00 0.00 H new ATOM 0 HG23 THR A 146 2.986 -0.986 3.949 1.00 0.00 H new ATOM 2227 N ALA A 147 -1.171 -3.589 4.984 1.00 0.00 N ATOM 2228 CA ALA A 147 -2.427 -4.274 4.993 1.00 0.00 C ATOM 2229 C ALA A 147 -3.592 -3.350 5.100 1.00 0.00 C ATOM 2230 O ALA A 147 -4.243 -2.906 4.156 1.00 0.00 O ATOM 2231 CB ALA A 147 -2.386 -5.445 5.989 1.00 0.00 C ATOM 0 H ALA A 147 -0.667 -3.625 5.870 1.00 0.00 H new ATOM 0 HA ALA A 147 -2.595 -4.734 4.019 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -3.348 -5.958 5.987 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -1.601 -6.143 5.698 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -2.180 -5.065 6.990 1.00 0.00 H new ATOM 2237 N LYS A 148 -3.992 -2.964 6.325 1.00 0.00 N ATOM 2238 CA LYS A 148 -4.964 -1.971 6.662 1.00 0.00 C ATOM 2239 C LYS A 148 -4.442 -0.542 6.726 1.00 0.00 C ATOM 2240 O LYS A 148 -4.598 0.150 7.767 1.00 0.00 O ATOM 2241 CB LYS A 148 -5.639 -2.421 7.969 1.00 0.00 C ATOM 2242 CG LYS A 148 -6.256 -3.819 7.887 1.00 0.00 C ATOM 2243 CD LYS A 148 -6.842 -4.210 9.245 1.00 0.00 C ATOM 2244 CE LYS A 148 -7.261 -5.677 9.365 1.00 0.00 C ATOM 2245 NZ LYS A 148 -7.596 -5.843 10.797 1.00 0.00 N ATOM 2246 OXT LYS A 148 -4.022 0.030 5.685 1.00 0.00 O ATOM 0 H LYS A 148 -3.593 -3.392 7.161 1.00 0.00 H new ATOM 0 HA LYS A 148 -5.688 -1.911 5.849 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -4.903 -2.404 8.773 1.00 0.00 H new ATOM 0 HB3 LYS A 148 -6.417 -1.704 8.233 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -7.036 -3.838 7.126 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -5.499 -4.543 7.586 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -6.106 -3.993 10.019 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -7.710 -3.581 9.445 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -8.116 -5.900 8.727 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -6.456 -6.347 9.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -7.647 -6.856 11.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -6.862 -5.393 11.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -8.515 -5.397 10.993 1.00 0.00 H new TER 2260 LYS A 148 HETATM 2261 CA CA A 151 -26.691 -3.555 -1.580 1.00 0.00 CA HETATM 2262 CA CA A 152 -22.423 -0.718 8.885 1.00 0.00 CA HETATM 2263 CA CA A 153 11.352 0.901 21.524 1.00 0.00 CA HETATM 2264 CA CA A 154 10.829 -8.438 14.625 1.00 0.00 CA