USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1043 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 ASN : amide:sc= 0 X(o=-2.8,f=-2.8) USER MOD Set 1.2: A 91 SER OG : rot 150:sc= -2.83! USER MOD Set 2.1: A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 73 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.162) USER MOD Set 3.1: A 67 THR OG1 : rot 57:sc= -0.267 USER MOD Set 3.2: A 70 THR OG1 : rot -73:sc= 0.747 USER MOD Set 4.1: A 28 ASN : amide:sc= -4.19! C(o=-3.2!,f=-22!) USER MOD Set 4.2: A 30 GLN : amide:sc= 0.996 K(o=-3.2,f=-14!) USER MOD Set 5.1: A 19 HIS : no HE2:sc= 0.125 K(o=0.12,f=-3.1!) USER MOD Set 5.2: A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 140:sc= -1.05 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -127:sc= 0 (180deg=-0.0159) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 SER OG : rot -24:sc= 0.866 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= -0.488 USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.127 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -138:sc= -0.0135 (180deg=-0.675) USER MOD Single : A 66 ASN : amide:sc= -0.104 K(o=-0.1,f=-0.94) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -0.0678 X(o=-0.068,f=0) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.0081) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 89:sc= -0.926! USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 HIS : no HD1:sc= -1.72 X(o=-1.7,f=-1.5) USER MOD Single : A 99 TYR OH : rot 68:sc= 0.242 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 79:sc= 0.844 USER MOD Single : A 109 GLN : amide:sc= -0.0689 K(o=-0.069,f=-1.9) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot -179:sc= 0.00736 USER MOD Single : A 116 SER OG : rot 178:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc=-0.00318 X(o=-0.0032,f=0) USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 ASN : amide:sc= -0.201 K(o=-0.2,f=-2!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot -177:sc= -1.48 USER MOD Single : A 130 THR OG1 : rot -121:sc= -0.957 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 TYR OH : rot 77:sc= 0.0568 USER MOD Single : A 140 ASN : amide:sc= -3.39! C(o=-3.4!,f=-7.6!) USER MOD ----------------------------------------------------------------- ATOM 25 N GLU A 3 -1.448 -5.992 12.725 1.00 0.00 N ATOM 26 CA GLU A 3 -2.235 -7.253 12.775 1.00 0.00 C ATOM 27 C GLU A 3 -2.267 -7.907 11.390 1.00 0.00 C ATOM 28 O GLU A 3 -1.332 -7.796 10.622 1.00 0.00 O ATOM 29 CB GLU A 3 -3.638 -6.822 13.205 1.00 0.00 C ATOM 30 CG GLU A 3 -4.207 -7.848 14.187 1.00 0.00 C ATOM 31 CD GLU A 3 -4.481 -7.173 15.531 1.00 0.00 C ATOM 32 OE1 GLU A 3 -5.045 -6.091 15.525 1.00 0.00 O ATOM 33 OE2 GLU A 3 -4.123 -7.749 16.545 1.00 0.00 O ATOM 0 HA GLU A 3 -1.808 -7.986 13.460 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -3.601 -5.838 13.672 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.287 -6.737 12.334 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.127 -8.276 13.789 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -3.504 -8.670 14.318 1.00 0.00 H new ATOM 40 N SER A 4 -3.332 -8.584 11.064 1.00 0.00 N ATOM 41 CA SER A 4 -3.417 -9.240 9.727 1.00 0.00 C ATOM 42 C SER A 4 -4.428 -8.508 8.842 1.00 0.00 C ATOM 43 O SER A 4 -5.502 -8.142 9.280 1.00 0.00 O ATOM 44 CB SER A 4 -3.886 -10.665 10.014 1.00 0.00 C ATOM 45 OG SER A 4 -2.752 -11.503 10.199 1.00 0.00 O ATOM 0 H SER A 4 -4.147 -8.712 11.664 1.00 0.00 H new ATOM 0 HA SER A 4 -2.464 -9.225 9.198 1.00 0.00 H new ATOM 0 HB2 SER A 4 -4.514 -10.681 10.905 1.00 0.00 H new ATOM 0 HB3 SER A 4 -4.494 -11.034 9.188 1.00 0.00 H new ATOM 0 HG SER A 4 -2.924 -12.129 10.933 1.00 0.00 H new ATOM 51 N LEU A 5 -4.094 -8.292 7.600 1.00 0.00 N ATOM 52 CA LEU A 5 -5.036 -7.584 6.687 1.00 0.00 C ATOM 53 C LEU A 5 -6.327 -8.393 6.530 1.00 0.00 C ATOM 54 O LEU A 5 -7.393 -7.846 6.328 1.00 0.00 O ATOM 55 CB LEU A 5 -4.297 -7.492 5.352 1.00 0.00 C ATOM 56 CG LEU A 5 -4.481 -6.093 4.761 1.00 0.00 C ATOM 57 CD1 LEU A 5 -3.671 -5.972 3.470 1.00 0.00 C ATOM 58 CD2 LEU A 5 -5.963 -5.861 4.457 1.00 0.00 C ATOM 0 H LEU A 5 -3.210 -8.575 7.177 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.320 -6.602 7.065 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -3.237 -7.701 5.496 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -4.679 -8.243 4.661 1.00 0.00 H new ATOM 0 HG LEU A 5 -4.134 -5.348 5.477 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -3.803 -4.975 3.050 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -2.616 -6.138 3.686 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -4.016 -6.717 2.753 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -6.096 -4.865 4.036 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -6.309 -6.607 3.741 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -6.541 -5.946 5.377 1.00 0.00 H new ATOM 70 N LYS A 6 -6.239 -9.691 6.619 1.00 0.00 N ATOM 71 CA LYS A 6 -7.461 -10.532 6.471 1.00 0.00 C ATOM 72 C LYS A 6 -8.285 -10.512 7.763 1.00 0.00 C ATOM 73 O LYS A 6 -9.456 -10.837 7.768 1.00 0.00 O ATOM 74 CB LYS A 6 -6.937 -11.942 6.191 1.00 0.00 C ATOM 75 CG LYS A 6 -6.456 -12.580 7.497 1.00 0.00 C ATOM 76 CD LYS A 6 -7.554 -13.486 8.058 1.00 0.00 C ATOM 77 CE LYS A 6 -7.848 -14.610 7.060 1.00 0.00 C ATOM 78 NZ LYS A 6 -8.170 -15.794 7.903 1.00 0.00 N ATOM 0 H LYS A 6 -5.375 -10.206 6.788 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.114 -10.172 5.676 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -7.723 -12.551 5.745 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -6.119 -11.901 5.472 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -5.549 -13.158 7.319 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -6.204 -11.805 8.221 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -7.240 -13.906 9.014 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.458 -12.906 8.246 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -8.682 -14.351 6.407 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -6.989 -14.804 6.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -8.384 -16.608 7.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -7.356 -16.021 8.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -8.996 -15.582 8.498 1.00 0.00 H new ATOM 92 N ASP A 7 -7.684 -10.134 8.859 1.00 0.00 N ATOM 93 CA ASP A 7 -8.438 -10.098 10.146 1.00 0.00 C ATOM 94 C ASP A 7 -8.707 -8.651 10.573 1.00 0.00 C ATOM 95 O ASP A 7 -9.552 -8.388 11.406 1.00 0.00 O ATOM 96 CB ASP A 7 -7.524 -10.792 11.157 1.00 0.00 C ATOM 97 CG ASP A 7 -8.346 -11.234 12.369 1.00 0.00 C ATOM 98 OD1 ASP A 7 -9.554 -11.063 12.336 1.00 0.00 O ATOM 99 OD2 ASP A 7 -7.754 -11.736 13.310 1.00 0.00 O ATOM 0 H ASP A 7 -6.706 -9.849 8.919 1.00 0.00 H new ATOM 0 HA ASP A 7 -9.409 -10.586 10.065 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -7.043 -11.655 10.696 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -6.730 -10.114 11.470 1.00 0.00 H new ATOM 104 N ALA A 8 -7.995 -7.709 10.014 1.00 0.00 N ATOM 105 CA ALA A 8 -8.213 -6.284 10.398 1.00 0.00 C ATOM 106 C ALA A 8 -9.314 -5.661 9.533 1.00 0.00 C ATOM 107 O ALA A 8 -9.987 -4.736 9.942 1.00 0.00 O ATOM 108 CB ALA A 8 -6.873 -5.595 10.139 1.00 0.00 C ATOM 0 H ALA A 8 -7.274 -7.864 9.310 1.00 0.00 H new ATOM 0 HA ALA A 8 -8.531 -6.181 11.435 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -6.951 -4.539 10.398 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -6.100 -6.062 10.749 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.612 -5.692 9.085 1.00 0.00 H new ATOM 114 N ILE A 9 -9.501 -6.157 8.340 1.00 0.00 N ATOM 115 CA ILE A 9 -10.557 -5.586 7.454 1.00 0.00 C ATOM 116 C ILE A 9 -11.949 -5.929 7.992 1.00 0.00 C ATOM 117 O ILE A 9 -12.927 -5.292 7.657 1.00 0.00 O ATOM 118 CB ILE A 9 -10.333 -6.241 6.092 1.00 0.00 C ATOM 119 CG1 ILE A 9 -10.372 -7.763 6.246 1.00 0.00 C ATOM 120 CG2 ILE A 9 -8.971 -5.820 5.539 1.00 0.00 C ATOM 121 CD1 ILE A 9 -11.637 -8.310 5.583 1.00 0.00 C ATOM 0 H ILE A 9 -8.970 -6.931 7.941 1.00 0.00 H new ATOM 0 HA ILE A 9 -10.500 -4.499 7.398 1.00 0.00 H new ATOM 0 HB ILE A 9 -11.117 -5.924 5.404 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -9.488 -8.208 5.790 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -10.356 -8.033 7.302 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -8.812 -6.288 4.567 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.942 -4.736 5.429 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.186 -6.136 6.226 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -11.665 -9.394 5.692 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -12.515 -7.874 6.059 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -11.633 -8.052 4.524 1.00 0.00 H new ATOM 133 N LYS A 10 -12.048 -6.933 8.821 1.00 0.00 N ATOM 134 CA LYS A 10 -13.381 -7.312 9.374 1.00 0.00 C ATOM 135 C LYS A 10 -13.829 -6.295 10.426 1.00 0.00 C ATOM 136 O LYS A 10 -13.912 -6.598 11.600 1.00 0.00 O ATOM 137 CB LYS A 10 -13.170 -8.686 10.010 1.00 0.00 C ATOM 138 CG LYS A 10 -13.293 -9.769 8.936 1.00 0.00 C ATOM 139 CD LYS A 10 -14.696 -9.730 8.327 1.00 0.00 C ATOM 140 CE LYS A 10 -15.334 -11.117 8.422 1.00 0.00 C ATOM 141 NZ LYS A 10 -14.689 -11.912 7.340 1.00 0.00 N ATOM 0 H LYS A 10 -11.266 -7.506 9.139 1.00 0.00 H new ATOM 0 HA LYS A 10 -14.155 -7.333 8.606 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -12.188 -8.734 10.480 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -13.907 -8.852 10.795 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -12.544 -9.612 8.160 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -13.101 -10.750 9.371 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -15.311 -8.999 8.851 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -14.643 -9.413 7.285 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -15.159 -11.566 9.400 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -16.414 -11.065 8.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -15.422 -12.343 6.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -14.091 -11.289 6.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -14.102 -12.660 7.762 1.00 0.00 H new ATOM 155 N ASP A 11 -14.120 -5.091 10.014 1.00 0.00 N ATOM 156 CA ASP A 11 -14.565 -4.056 10.990 1.00 0.00 C ATOM 157 C ASP A 11 -15.803 -3.326 10.457 1.00 0.00 C ATOM 158 O ASP A 11 -15.964 -3.171 9.263 1.00 0.00 O ATOM 159 CB ASP A 11 -13.383 -3.094 11.111 1.00 0.00 C ATOM 160 CG ASP A 11 -12.343 -3.681 12.067 1.00 0.00 C ATOM 161 OD1 ASP A 11 -11.936 -4.810 11.846 1.00 0.00 O ATOM 162 OD2 ASP A 11 -11.970 -2.993 13.002 1.00 0.00 O ATOM 0 H ASP A 11 -14.069 -4.780 9.044 1.00 0.00 H new ATOM 0 HA ASP A 11 -14.841 -4.485 11.953 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -12.937 -2.924 10.131 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -13.724 -2.126 11.478 1.00 0.00 H new ATOM 167 N PRO A 12 -16.637 -2.902 11.368 1.00 0.00 N ATOM 168 CA PRO A 12 -17.877 -2.181 10.989 1.00 0.00 C ATOM 169 C PRO A 12 -17.553 -0.757 10.528 1.00 0.00 C ATOM 170 O PRO A 12 -18.325 -0.130 9.828 1.00 0.00 O ATOM 171 CB PRO A 12 -18.687 -2.161 12.282 1.00 0.00 C ATOM 172 CG PRO A 12 -17.676 -2.282 13.378 1.00 0.00 C ATOM 173 CD PRO A 12 -16.507 -3.055 12.821 1.00 0.00 C ATOM 0 HA PRO A 12 -18.409 -2.652 10.163 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -19.260 -1.238 12.374 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -19.401 -2.984 12.312 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -17.358 -1.297 13.719 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -18.102 -2.796 14.240 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -15.558 -2.657 13.180 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -16.545 -4.103 13.116 1.00 0.00 H new ATOM 181 N ALA A 13 -16.420 -0.239 10.915 1.00 0.00 N ATOM 182 CA ALA A 13 -16.051 1.145 10.500 1.00 0.00 C ATOM 183 C ALA A 13 -15.362 1.124 9.132 1.00 0.00 C ATOM 184 O ALA A 13 -15.728 1.852 8.231 1.00 0.00 O ATOM 185 CB ALA A 13 -15.086 1.637 11.578 1.00 0.00 C ATOM 0 H ALA A 13 -15.733 -0.714 11.501 1.00 0.00 H new ATOM 0 HA ALA A 13 -16.922 1.793 10.405 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -14.767 2.653 11.344 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -15.587 1.627 12.546 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -14.215 0.982 11.613 1.00 0.00 H new ATOM 191 N LEU A 14 -14.365 0.297 8.973 1.00 0.00 N ATOM 192 CA LEU A 14 -13.650 0.232 7.666 1.00 0.00 C ATOM 193 C LEU A 14 -14.621 -0.152 6.546 1.00 0.00 C ATOM 194 O LEU A 14 -14.430 0.200 5.399 1.00 0.00 O ATOM 195 CB LEU A 14 -12.588 -0.848 7.852 1.00 0.00 C ATOM 196 CG LEU A 14 -11.312 -0.213 8.405 1.00 0.00 C ATOM 197 CD1 LEU A 14 -10.778 0.816 7.408 1.00 0.00 C ATOM 198 CD2 LEU A 14 -11.625 0.480 9.733 1.00 0.00 C ATOM 0 H LEU A 14 -14.014 -0.337 9.691 1.00 0.00 H new ATOM 0 HA LEU A 14 -13.212 1.190 7.386 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -12.950 -1.617 8.534 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -12.381 -1.338 6.901 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.561 -0.987 8.564 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -9.868 1.268 7.804 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -10.557 0.324 6.461 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -11.528 1.591 7.248 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -10.717 0.934 10.130 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -12.376 1.253 9.572 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -12.005 -0.253 10.445 1.00 0.00 H new ATOM 210 N GLU A 15 -15.661 -0.871 6.868 1.00 0.00 N ATOM 211 CA GLU A 15 -16.641 -1.275 5.819 1.00 0.00 C ATOM 212 C GLU A 15 -17.100 -0.048 5.026 1.00 0.00 C ATOM 213 O GLU A 15 -17.950 0.702 5.463 1.00 0.00 O ATOM 214 CB GLU A 15 -17.811 -1.889 6.586 1.00 0.00 C ATOM 215 CG GLU A 15 -18.847 -2.423 5.595 1.00 0.00 C ATOM 216 CD GLU A 15 -20.249 -2.258 6.184 1.00 0.00 C ATOM 217 OE1 GLU A 15 -20.463 -2.721 7.291 1.00 0.00 O ATOM 218 OE2 GLU A 15 -21.085 -1.672 5.516 1.00 0.00 O ATOM 0 H GLU A 15 -15.875 -1.196 7.811 1.00 0.00 H new ATOM 0 HA GLU A 15 -16.214 -1.975 5.101 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.456 -2.696 7.227 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.266 -1.142 7.236 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -18.773 -1.885 4.650 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -18.653 -3.474 5.380 1.00 0.00 H new ATOM 225 N ASN A 16 -16.543 0.163 3.865 1.00 0.00 N ATOM 226 CA ASN A 16 -16.945 1.343 3.046 1.00 0.00 C ATOM 227 C ASN A 16 -16.918 2.613 3.900 1.00 0.00 C ATOM 228 O ASN A 16 -17.926 3.042 4.424 1.00 0.00 O ATOM 229 CB ASN A 16 -18.371 1.039 2.582 1.00 0.00 C ATOM 230 CG ASN A 16 -18.392 0.896 1.059 1.00 0.00 C ATOM 231 OD1 ASN A 16 -18.626 1.854 0.350 1.00 0.00 O ATOM 232 ND2 ASN A 16 -18.154 -0.270 0.523 1.00 0.00 N ATOM 0 H ASN A 16 -15.826 -0.431 3.447 1.00 0.00 H new ATOM 0 HA ASN A 16 -16.271 1.510 2.206 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -18.729 0.122 3.049 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -19.044 1.838 2.892 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -18.164 -0.377 -0.491 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -17.957 -1.074 1.118 1.00 0.00 H new ATOM 239 N LYS A 17 -15.771 3.216 4.045 1.00 0.00 N ATOM 240 CA LYS A 17 -15.680 4.457 4.866 1.00 0.00 C ATOM 241 C LYS A 17 -15.505 5.679 3.959 1.00 0.00 C ATOM 242 O LYS A 17 -15.912 5.678 2.815 1.00 0.00 O ATOM 243 CB LYS A 17 -14.444 4.262 5.744 1.00 0.00 C ATOM 244 CG LYS A 17 -14.757 4.703 7.174 1.00 0.00 C ATOM 245 CD LYS A 17 -13.453 4.843 7.963 1.00 0.00 C ATOM 246 CE LYS A 17 -12.867 6.238 7.737 1.00 0.00 C ATOM 247 NZ LYS A 17 -13.075 6.956 9.025 1.00 0.00 N ATOM 0 H LYS A 17 -14.893 2.904 3.631 1.00 0.00 H new ATOM 0 HA LYS A 17 -16.579 4.626 5.459 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -14.139 3.215 5.734 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -13.609 4.841 5.348 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -15.292 5.653 7.164 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -15.409 3.975 7.656 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -13.639 4.683 9.025 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -12.740 4.082 7.646 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -11.809 6.185 7.481 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -13.369 6.749 6.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -12.698 7.922 8.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -14.092 6.997 9.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -12.580 6.451 9.788 1.00 0.00 H new ATOM 261 N GLU A 18 -14.899 6.719 4.463 1.00 0.00 N ATOM 262 CA GLU A 18 -14.695 7.940 3.632 1.00 0.00 C ATOM 263 C GLU A 18 -13.260 8.450 3.792 1.00 0.00 C ATOM 264 O GLU A 18 -12.980 9.292 4.622 1.00 0.00 O ATOM 265 CB GLU A 18 -15.693 8.962 4.174 1.00 0.00 C ATOM 266 CG GLU A 18 -16.277 9.771 3.014 1.00 0.00 C ATOM 267 CD GLU A 18 -17.803 9.790 3.121 1.00 0.00 C ATOM 268 OE1 GLU A 18 -18.300 10.292 4.115 1.00 0.00 O ATOM 269 OE2 GLU A 18 -18.448 9.303 2.207 1.00 0.00 O ATOM 0 H GLU A 18 -14.536 6.776 5.415 1.00 0.00 H new ATOM 0 HA GLU A 18 -14.849 7.749 2.570 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -16.491 8.454 4.715 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -15.200 9.627 4.883 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -15.888 10.789 3.035 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -15.974 9.333 2.063 1.00 0.00 H new ATOM 276 N HIS A 19 -12.351 7.946 3.004 1.00 0.00 N ATOM 277 CA HIS A 19 -10.934 8.401 3.110 1.00 0.00 C ATOM 278 C HIS A 19 -10.672 9.550 2.134 1.00 0.00 C ATOM 279 O HIS A 19 -9.593 9.680 1.590 1.00 0.00 O ATOM 280 CB HIS A 19 -10.099 7.177 2.734 1.00 0.00 C ATOM 281 CG HIS A 19 -10.029 7.061 1.236 1.00 0.00 C ATOM 282 ND1 HIS A 19 -8.825 7.060 0.550 1.00 0.00 N ATOM 283 CD2 HIS A 19 -11.006 6.945 0.278 1.00 0.00 C ATOM 284 CE1 HIS A 19 -9.105 6.946 -0.761 1.00 0.00 C ATOM 285 NE2 HIS A 19 -10.420 6.873 -0.982 1.00 0.00 N ATOM 0 H HIS A 19 -12.527 7.238 2.291 1.00 0.00 H new ATOM 0 HA HIS A 19 -10.692 8.771 4.106 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -9.096 7.266 3.150 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -10.542 6.276 3.159 1.00 0.00 H new ATOM 0 HD1 HIS A 19 -7.896 7.133 0.964 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -12.068 6.914 0.473 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -8.357 6.917 -1.540 1.00 0.00 H new ATOM 293 N ASP A 20 -11.649 10.385 1.908 1.00 0.00 N ATOM 294 CA ASP A 20 -11.453 11.524 0.966 1.00 0.00 C ATOM 295 C ASP A 20 -11.866 12.838 1.635 1.00 0.00 C ATOM 296 O ASP A 20 -12.820 13.477 1.234 1.00 0.00 O ATOM 297 CB ASP A 20 -12.366 11.217 -0.222 1.00 0.00 C ATOM 298 CG ASP A 20 -13.790 10.967 0.278 1.00 0.00 C ATOM 299 OD1 ASP A 20 -14.059 11.282 1.424 1.00 0.00 O ATOM 300 OD2 ASP A 20 -14.588 10.464 -0.497 1.00 0.00 O ATOM 0 H ASP A 20 -12.574 10.328 2.334 1.00 0.00 H new ATOM 0 HA ASP A 20 -10.412 11.635 0.662 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -12.357 12.050 -0.925 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -11.999 10.342 -0.759 1.00 0.00 H new ATOM 305 N ILE A 21 -11.157 13.246 2.652 1.00 0.00 N ATOM 306 CA ILE A 21 -11.511 14.518 3.344 1.00 0.00 C ATOM 307 C ILE A 21 -10.319 15.478 3.329 1.00 0.00 C ATOM 308 O ILE A 21 -9.542 15.532 4.261 1.00 0.00 O ATOM 309 CB ILE A 21 -11.851 14.110 4.776 1.00 0.00 C ATOM 310 CG1 ILE A 21 -12.677 12.822 4.758 1.00 0.00 C ATOM 311 CG2 ILE A 21 -12.659 15.222 5.446 1.00 0.00 C ATOM 312 CD1 ILE A 21 -13.188 12.522 6.167 1.00 0.00 C ATOM 0 H ILE A 21 -10.349 12.754 3.033 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.340 15.033 2.860 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.929 13.944 5.333 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -13.516 12.926 4.070 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -12.069 11.993 4.396 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -12.901 14.930 6.468 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -12.072 16.140 5.460 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -13.580 15.389 4.888 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.776 11.604 6.153 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -12.341 12.400 6.843 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -13.811 13.347 6.511 1.00 0.00 H new ATOM 324 N GLY A 22 -10.169 16.236 2.279 1.00 0.00 N ATOM 325 CA GLY A 22 -9.027 17.191 2.207 1.00 0.00 C ATOM 326 C GLY A 22 -8.365 17.095 0.831 1.00 0.00 C ATOM 327 O GLY A 22 -9.018 16.818 -0.155 1.00 0.00 O ATOM 0 H GLY A 22 -10.787 16.236 1.468 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -9.378 18.208 2.383 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -8.301 16.965 2.988 1.00 0.00 H new ATOM 331 N PRO A 23 -7.081 17.332 0.813 1.00 0.00 N ATOM 332 CA PRO A 23 -6.313 17.274 -0.456 1.00 0.00 C ATOM 333 C PRO A 23 -6.136 15.822 -0.908 1.00 0.00 C ATOM 334 O PRO A 23 -6.602 14.900 -0.269 1.00 0.00 O ATOM 335 CB PRO A 23 -4.970 17.897 -0.089 1.00 0.00 C ATOM 336 CG PRO A 23 -4.837 17.690 1.386 1.00 0.00 C ATOM 337 CD PRO A 23 -6.230 17.672 1.959 1.00 0.00 C ATOM 0 HA PRO A 23 -6.806 17.790 -1.280 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -4.153 17.420 -0.630 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -4.944 18.957 -0.343 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -4.321 16.754 1.598 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -4.246 18.488 1.835 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -6.324 16.936 2.758 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -6.500 18.639 2.383 1.00 0.00 H new ATOM 345 N ARG A 24 -5.463 15.612 -2.006 1.00 0.00 N ATOM 346 CA ARG A 24 -5.252 14.222 -2.500 1.00 0.00 C ATOM 347 C ARG A 24 -4.370 14.234 -3.750 1.00 0.00 C ATOM 348 O ARG A 24 -4.246 15.238 -4.423 1.00 0.00 O ATOM 349 CB ARG A 24 -6.653 13.704 -2.833 1.00 0.00 C ATOM 350 CG ARG A 24 -7.411 14.766 -3.632 1.00 0.00 C ATOM 351 CD ARG A 24 -8.479 14.092 -4.495 1.00 0.00 C ATOM 352 NE ARG A 24 -8.028 14.307 -5.897 1.00 0.00 N ATOM 353 CZ ARG A 24 -8.805 13.971 -6.892 1.00 0.00 C ATOM 354 NH1 ARG A 24 -8.797 12.747 -7.342 1.00 0.00 N ATOM 355 NH2 ARG A 24 -9.591 14.861 -7.434 1.00 0.00 N ATOM 0 H ARG A 24 -5.050 16.344 -2.583 1.00 0.00 H new ATOM 0 HA ARG A 24 -4.750 13.593 -1.765 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -6.584 12.781 -3.408 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -7.193 13.469 -1.916 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -7.875 15.483 -2.955 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.719 15.325 -4.262 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -8.561 13.030 -4.265 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -9.461 14.532 -4.324 1.00 0.00 H new ATOM 0 HE ARG A 24 -7.112 14.717 -6.081 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -8.184 12.051 -6.917 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -9.404 12.485 -8.119 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.598 15.818 -7.081 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.198 14.600 -8.211 1.00 0.00 H new ATOM 369 N GLU A 25 -3.755 13.127 -4.067 1.00 0.00 N ATOM 370 CA GLU A 25 -2.881 13.082 -5.275 1.00 0.00 C ATOM 371 C GLU A 25 -2.808 11.655 -5.827 1.00 0.00 C ATOM 372 O GLU A 25 -3.361 10.731 -5.263 1.00 0.00 O ATOM 373 CB GLU A 25 -1.506 13.536 -4.784 1.00 0.00 C ATOM 374 CG GLU A 25 -1.291 15.005 -5.154 1.00 0.00 C ATOM 375 CD GLU A 25 -1.208 15.142 -6.675 1.00 0.00 C ATOM 376 OE1 GLU A 25 -1.489 14.167 -7.353 1.00 0.00 O ATOM 377 OE2 GLU A 25 -0.865 16.218 -7.135 1.00 0.00 O ATOM 0 H GLU A 25 -3.819 12.254 -3.544 1.00 0.00 H new ATOM 0 HA GLU A 25 -3.258 13.713 -6.080 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -1.433 13.408 -3.704 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.726 12.919 -5.232 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.110 15.612 -4.768 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -0.375 15.376 -4.694 1.00 0.00 H new ATOM 384 N GLN A 26 -2.128 11.470 -6.925 1.00 0.00 N ATOM 385 CA GLN A 26 -2.017 10.105 -7.515 1.00 0.00 C ATOM 386 C GLN A 26 -0.563 9.814 -7.899 1.00 0.00 C ATOM 387 O GLN A 26 0.091 10.612 -8.541 1.00 0.00 O ATOM 388 CB GLN A 26 -2.906 10.136 -8.759 1.00 0.00 C ATOM 389 CG GLN A 26 -2.348 11.146 -9.764 1.00 0.00 C ATOM 390 CD GLN A 26 -3.489 11.999 -10.319 1.00 0.00 C ATOM 391 OE1 GLN A 26 -4.018 11.714 -11.374 1.00 0.00 O ATOM 392 NE2 GLN A 26 -3.894 13.042 -9.647 1.00 0.00 N ATOM 0 H GLN A 26 -1.644 12.205 -7.440 1.00 0.00 H new ATOM 0 HA GLN A 26 -2.324 9.326 -6.817 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -2.951 9.145 -9.211 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -3.925 10.407 -8.483 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -1.606 11.782 -9.282 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -1.842 10.625 -10.576 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -3.450 13.282 -8.761 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -4.655 13.617 -10.008 1.00 0.00 H new ATOM 401 N VAL A 27 -0.051 8.679 -7.509 1.00 0.00 N ATOM 402 CA VAL A 27 1.362 8.342 -7.851 1.00 0.00 C ATOM 403 C VAL A 27 1.471 6.880 -8.289 1.00 0.00 C ATOM 404 O VAL A 27 0.929 5.992 -7.662 1.00 0.00 O ATOM 405 CB VAL A 27 2.145 8.570 -6.557 1.00 0.00 C ATOM 406 CG1 VAL A 27 3.491 7.848 -6.641 1.00 0.00 C ATOM 407 CG2 VAL A 27 2.383 10.069 -6.363 1.00 0.00 C ATOM 0 H VAL A 27 -0.548 7.971 -6.969 1.00 0.00 H new ATOM 0 HA VAL A 27 1.741 8.948 -8.674 1.00 0.00 H new ATOM 0 HB VAL A 27 1.575 8.179 -5.714 1.00 0.00 H new ATOM 0 HG11 VAL A 27 4.049 8.010 -5.719 1.00 0.00 H new ATOM 0 HG12 VAL A 27 3.323 6.780 -6.780 1.00 0.00 H new ATOM 0 HG13 VAL A 27 4.061 8.238 -7.484 1.00 0.00 H new ATOM 0 HG21 VAL A 27 2.941 10.232 -5.441 1.00 0.00 H new ATOM 0 HG22 VAL A 27 2.953 10.459 -7.206 1.00 0.00 H new ATOM 0 HG23 VAL A 27 1.425 10.585 -6.303 1.00 0.00 H new ATOM 417 N ASN A 28 2.175 6.622 -9.358 1.00 0.00 N ATOM 418 CA ASN A 28 2.324 5.216 -9.830 1.00 0.00 C ATOM 419 C ASN A 28 3.426 4.513 -9.033 1.00 0.00 C ATOM 420 O ASN A 28 4.216 5.146 -8.360 1.00 0.00 O ATOM 421 CB ASN A 28 2.717 5.329 -11.304 1.00 0.00 C ATOM 422 CG ASN A 28 3.846 4.343 -11.609 1.00 0.00 C ATOM 423 OD1 ASN A 28 5.006 4.702 -11.580 1.00 0.00 O ATOM 424 ND2 ASN A 28 3.552 3.106 -11.903 1.00 0.00 N ATOM 0 H ASN A 28 2.653 7.323 -9.924 1.00 0.00 H new ATOM 0 HA ASN A 28 1.411 4.635 -9.698 1.00 0.00 H new ATOM 0 HB2 ASN A 28 1.856 5.119 -11.938 1.00 0.00 H new ATOM 0 HB3 ASN A 28 3.038 6.346 -11.529 1.00 0.00 H new ATOM 0 HD21 ASN A 28 4.297 2.440 -12.109 1.00 0.00 H new ATOM 0 HD22 ASN A 28 2.578 2.805 -11.927 1.00 0.00 H new ATOM 431 N PHE A 29 3.486 3.212 -9.100 1.00 0.00 N ATOM 432 CA PHE A 29 4.538 2.477 -8.340 1.00 0.00 C ATOM 433 C PHE A 29 5.239 1.464 -9.248 1.00 0.00 C ATOM 434 O PHE A 29 4.619 0.816 -10.069 1.00 0.00 O ATOM 435 CB PHE A 29 3.789 1.764 -7.215 1.00 0.00 C ATOM 436 CG PHE A 29 2.466 1.259 -7.735 1.00 0.00 C ATOM 437 CD1 PHE A 29 2.415 0.085 -8.496 1.00 0.00 C ATOM 438 CD2 PHE A 29 1.288 1.964 -7.456 1.00 0.00 C ATOM 439 CE1 PHE A 29 1.188 -0.384 -8.979 1.00 0.00 C ATOM 440 CE2 PHE A 29 0.060 1.494 -7.938 1.00 0.00 C ATOM 441 CZ PHE A 29 0.010 0.321 -8.700 1.00 0.00 C ATOM 0 H PHE A 29 2.854 2.626 -9.646 1.00 0.00 H new ATOM 0 HA PHE A 29 5.311 3.143 -7.956 1.00 0.00 H new ATOM 0 HB2 PHE A 29 4.384 0.933 -6.836 1.00 0.00 H new ATOM 0 HB3 PHE A 29 3.628 2.447 -6.381 1.00 0.00 H new ATOM 0 HD1 PHE A 29 3.323 -0.459 -8.710 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.327 2.870 -6.869 1.00 0.00 H new ATOM 0 HE1 PHE A 29 1.149 -1.289 -9.567 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -0.848 2.037 -7.722 1.00 0.00 H new ATOM 0 HZ PHE A 29 -0.937 -0.041 -9.073 1.00 0.00 H new ATOM 451 N GLN A 30 6.529 1.324 -9.108 1.00 0.00 N ATOM 452 CA GLN A 30 7.274 0.354 -9.962 1.00 0.00 C ATOM 453 C GLN A 30 7.536 -0.941 -9.190 1.00 0.00 C ATOM 454 O GLN A 30 8.274 -0.961 -8.225 1.00 0.00 O ATOM 455 CB GLN A 30 8.591 1.055 -10.299 1.00 0.00 C ATOM 456 CG GLN A 30 8.485 1.700 -11.683 1.00 0.00 C ATOM 457 CD GLN A 30 7.264 2.619 -11.724 1.00 0.00 C ATOM 458 OE1 GLN A 30 6.330 2.375 -12.462 1.00 0.00 O ATOM 459 NE2 GLN A 30 7.230 3.674 -10.957 1.00 0.00 N ATOM 0 H GLN A 30 7.100 1.840 -8.439 1.00 0.00 H new ATOM 0 HA GLN A 30 6.717 0.080 -10.858 1.00 0.00 H new ATOM 0 HB2 GLN A 30 8.814 1.813 -9.549 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.412 0.338 -10.282 1.00 0.00 H new ATOM 0 HG2 GLN A 30 9.389 2.268 -11.901 1.00 0.00 H new ATOM 0 HG3 GLN A 30 8.400 0.930 -12.450 1.00 0.00 H new ATOM 0 HE21 GLN A 30 8.014 3.879 -10.337 1.00 0.00 H new ATOM 0 HE22 GLN A 30 6.420 4.293 -10.977 1.00 0.00 H new ATOM 468 N LEU A 31 6.941 -2.022 -9.611 1.00 0.00 N ATOM 469 CA LEU A 31 7.161 -3.316 -8.905 1.00 0.00 C ATOM 470 C LEU A 31 8.507 -3.914 -9.318 1.00 0.00 C ATOM 471 O LEU A 31 8.730 -4.228 -10.471 1.00 0.00 O ATOM 472 CB LEU A 31 6.011 -4.218 -9.357 1.00 0.00 C ATOM 473 CG LEU A 31 4.676 -3.534 -9.058 1.00 0.00 C ATOM 474 CD1 LEU A 31 3.527 -4.490 -9.380 1.00 0.00 C ATOM 475 CD2 LEU A 31 4.620 -3.154 -7.577 1.00 0.00 C ATOM 0 H LEU A 31 6.312 -2.066 -10.413 1.00 0.00 H new ATOM 0 HA LEU A 31 7.181 -3.199 -7.821 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.095 -4.424 -10.424 1.00 0.00 H new ATOM 0 HB3 LEU A 31 6.063 -5.177 -8.842 1.00 0.00 H new ATOM 0 HG LEU A 31 4.584 -2.637 -9.670 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.576 -4.001 -9.166 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.566 -4.763 -10.434 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.619 -5.388 -8.769 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.669 -2.666 -7.362 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.713 -4.053 -6.967 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.438 -2.472 -7.345 1.00 0.00 H new ATOM 487 N LEU A 32 9.409 -4.072 -8.389 1.00 0.00 N ATOM 488 CA LEU A 32 10.740 -4.645 -8.733 1.00 0.00 C ATOM 489 C LEU A 32 11.137 -5.716 -7.714 1.00 0.00 C ATOM 490 O LEU A 32 11.396 -5.427 -6.563 1.00 0.00 O ATOM 491 CB LEU A 32 11.703 -3.460 -8.675 1.00 0.00 C ATOM 492 CG LEU A 32 11.382 -2.486 -9.811 1.00 0.00 C ATOM 493 CD1 LEU A 32 12.042 -1.135 -9.528 1.00 0.00 C ATOM 494 CD2 LEU A 32 11.919 -3.049 -11.129 1.00 0.00 C ATOM 0 H LEU A 32 9.282 -3.829 -7.407 1.00 0.00 H new ATOM 0 HA LEU A 32 10.744 -5.127 -9.711 1.00 0.00 H new ATOM 0 HB2 LEU A 32 11.617 -2.955 -7.713 1.00 0.00 H new ATOM 0 HB3 LEU A 32 12.732 -3.809 -8.761 1.00 0.00 H new ATOM 0 HG LEU A 32 10.302 -2.354 -9.883 1.00 0.00 H new ATOM 0 HD11 LEU A 32 11.813 -0.442 -10.337 1.00 0.00 H new ATOM 0 HD12 LEU A 32 11.662 -0.734 -8.588 1.00 0.00 H new ATOM 0 HD13 LEU A 32 13.122 -1.265 -9.456 1.00 0.00 H new ATOM 0 HD21 LEU A 32 11.692 -2.357 -11.940 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.999 -3.180 -11.056 1.00 0.00 H new ATOM 0 HD23 LEU A 32 11.450 -4.012 -11.331 1.00 0.00 H new ATOM 506 N ASP A 33 11.187 -6.953 -8.128 1.00 0.00 N ATOM 507 CA ASP A 33 11.567 -8.043 -7.185 1.00 0.00 C ATOM 508 C ASP A 33 13.045 -7.914 -6.797 1.00 0.00 C ATOM 509 O ASP A 33 13.580 -6.827 -6.719 1.00 0.00 O ATOM 510 CB ASP A 33 11.321 -9.336 -7.962 1.00 0.00 C ATOM 511 CG ASP A 33 9.890 -9.342 -8.506 1.00 0.00 C ATOM 512 OD1 ASP A 33 8.972 -9.360 -7.702 1.00 0.00 O ATOM 513 OD2 ASP A 33 9.737 -9.326 -9.716 1.00 0.00 O ATOM 0 H ASP A 33 10.981 -7.256 -9.080 1.00 0.00 H new ATOM 0 HA ASP A 33 10.995 -8.011 -6.258 1.00 0.00 H new ATOM 0 HB2 ASP A 33 12.033 -9.421 -8.783 1.00 0.00 H new ATOM 0 HB3 ASP A 33 11.478 -10.198 -7.313 1.00 0.00 H new ATOM 518 N LYS A 34 13.708 -9.013 -6.551 1.00 0.00 N ATOM 519 CA LYS A 34 15.148 -8.943 -6.168 1.00 0.00 C ATOM 520 C LYS A 34 16.037 -9.052 -7.410 1.00 0.00 C ATOM 521 O LYS A 34 17.102 -9.637 -7.372 1.00 0.00 O ATOM 522 CB LYS A 34 15.371 -10.139 -5.242 1.00 0.00 C ATOM 523 CG LYS A 34 16.769 -10.051 -4.624 1.00 0.00 C ATOM 524 CD LYS A 34 16.837 -10.944 -3.382 1.00 0.00 C ATOM 525 CE LYS A 34 18.245 -11.531 -3.254 1.00 0.00 C ATOM 526 NZ LYS A 34 18.121 -12.935 -3.737 1.00 0.00 N ATOM 0 H LYS A 34 13.316 -9.953 -6.599 1.00 0.00 H new ATOM 0 HA LYS A 34 15.398 -7.999 -5.684 1.00 0.00 H new ATOM 0 HB2 LYS A 34 14.615 -10.151 -4.457 1.00 0.00 H new ATOM 0 HB3 LYS A 34 15.266 -11.069 -5.800 1.00 0.00 H new ATOM 0 HG2 LYS A 34 17.519 -10.363 -5.350 1.00 0.00 H new ATOM 0 HG3 LYS A 34 16.995 -9.019 -4.355 1.00 0.00 H new ATOM 0 HD2 LYS A 34 16.590 -10.366 -2.491 1.00 0.00 H new ATOM 0 HD3 LYS A 34 16.102 -11.746 -3.456 1.00 0.00 H new ATOM 0 HE2 LYS A 34 18.963 -10.970 -3.852 1.00 0.00 H new ATOM 0 HE3 LYS A 34 18.595 -11.498 -2.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 19.047 -13.405 -3.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 17.436 -13.447 -3.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 17.793 -12.935 -4.724 1.00 0.00 H new ATOM 540 N ASN A 35 15.612 -8.491 -8.509 1.00 0.00 N ATOM 541 CA ASN A 35 16.439 -8.563 -9.749 1.00 0.00 C ATOM 542 C ASN A 35 16.204 -7.321 -10.616 1.00 0.00 C ATOM 543 O ASN A 35 16.496 -7.314 -11.796 1.00 0.00 O ATOM 544 CB ASN A 35 15.958 -9.820 -10.475 1.00 0.00 C ATOM 545 CG ASN A 35 17.166 -10.674 -10.867 1.00 0.00 C ATOM 546 OD1 ASN A 35 17.718 -10.513 -11.937 1.00 0.00 O ATOM 547 ND2 ASN A 35 17.604 -11.582 -10.037 1.00 0.00 N ATOM 0 H ASN A 35 14.730 -7.987 -8.603 1.00 0.00 H new ATOM 0 HA ASN A 35 17.506 -8.601 -9.530 1.00 0.00 H new ATOM 0 HB2 ASN A 35 15.288 -10.391 -9.832 1.00 0.00 H new ATOM 0 HB3 ASN A 35 15.389 -9.545 -11.363 1.00 0.00 H new ATOM 0 HD21 ASN A 35 18.409 -12.156 -10.287 1.00 0.00 H new ATOM 0 HD22 ASN A 35 17.141 -11.717 -9.138 1.00 0.00 H new ATOM 554 N ASN A 36 15.681 -6.270 -10.041 1.00 0.00 N ATOM 555 CA ASN A 36 15.429 -5.030 -10.834 1.00 0.00 C ATOM 556 C ASN A 36 14.699 -5.373 -12.135 1.00 0.00 C ATOM 557 O ASN A 36 14.810 -4.676 -13.123 1.00 0.00 O ATOM 558 CB ASN A 36 16.816 -4.460 -11.133 1.00 0.00 C ATOM 559 CG ASN A 36 17.119 -3.322 -10.158 1.00 0.00 C ATOM 560 OD1 ASN A 36 17.179 -2.172 -10.548 1.00 0.00 O ATOM 561 ND2 ASN A 36 17.314 -3.594 -8.897 1.00 0.00 N ATOM 0 H ASN A 36 15.417 -6.216 -9.057 1.00 0.00 H new ATOM 0 HA ASN A 36 14.803 -4.318 -10.296 1.00 0.00 H new ATOM 0 HB2 ASN A 36 17.570 -5.242 -11.042 1.00 0.00 H new ATOM 0 HB3 ASN A 36 16.858 -4.095 -12.159 1.00 0.00 H new ATOM 0 HD21 ASN A 36 17.517 -2.842 -8.238 1.00 0.00 H new ATOM 0 HD22 ASN A 36 17.264 -4.559 -8.570 1.00 0.00 H new ATOM 568 N GLU A 37 13.952 -6.442 -12.141 1.00 0.00 N ATOM 569 CA GLU A 37 13.215 -6.829 -13.377 1.00 0.00 C ATOM 570 C GLU A 37 11.705 -6.727 -13.146 1.00 0.00 C ATOM 571 O GLU A 37 11.110 -7.564 -12.496 1.00 0.00 O ATOM 572 CB GLU A 37 13.619 -8.279 -13.642 1.00 0.00 C ATOM 573 CG GLU A 37 13.964 -8.447 -15.123 1.00 0.00 C ATOM 574 CD GLU A 37 15.440 -8.114 -15.344 1.00 0.00 C ATOM 575 OE1 GLU A 37 15.833 -7.007 -15.013 1.00 0.00 O ATOM 576 OE2 GLU A 37 16.153 -8.970 -15.841 1.00 0.00 O ATOM 0 H GLU A 37 13.820 -7.064 -11.344 1.00 0.00 H new ATOM 0 HA GLU A 37 13.452 -6.179 -14.219 1.00 0.00 H new ATOM 0 HB2 GLU A 37 14.476 -8.548 -13.025 1.00 0.00 H new ATOM 0 HB3 GLU A 37 12.805 -8.951 -13.368 1.00 0.00 H new ATOM 0 HG2 GLU A 37 13.759 -9.469 -15.441 1.00 0.00 H new ATOM 0 HG3 GLU A 37 13.338 -7.793 -15.730 1.00 0.00 H new ATOM 713 N SER A 45 -4.017 -7.984 -7.402 1.00 0.00 N ATOM 714 CA SER A 45 -4.253 -7.317 -6.089 1.00 0.00 C ATOM 715 C SER A 45 -4.455 -5.813 -6.297 1.00 0.00 C ATOM 716 O SER A 45 -5.568 -5.330 -6.356 1.00 0.00 O ATOM 717 CB SER A 45 -2.987 -7.587 -5.275 1.00 0.00 C ATOM 718 OG SER A 45 -1.924 -7.919 -6.158 1.00 0.00 O ATOM 0 HA SER A 45 -5.144 -7.691 -5.584 1.00 0.00 H new ATOM 0 HB2 SER A 45 -2.725 -6.708 -4.686 1.00 0.00 H new ATOM 0 HB3 SER A 45 -3.159 -8.402 -4.572 1.00 0.00 H new ATOM 0 HG SER A 45 -2.292 -8.264 -6.998 1.00 0.00 H new ATOM 724 N ILE A 46 -3.388 -5.069 -6.417 1.00 0.00 N ATOM 725 CA ILE A 46 -3.526 -3.600 -6.630 1.00 0.00 C ATOM 726 C ILE A 46 -4.007 -3.328 -8.058 1.00 0.00 C ATOM 727 O ILE A 46 -3.975 -4.195 -8.907 1.00 0.00 O ATOM 728 CB ILE A 46 -2.123 -3.036 -6.416 1.00 0.00 C ATOM 729 CG1 ILE A 46 -1.671 -3.326 -4.983 1.00 0.00 C ATOM 730 CG2 ILE A 46 -2.138 -1.523 -6.646 1.00 0.00 C ATOM 731 CD1 ILE A 46 -0.704 -4.512 -4.983 1.00 0.00 C ATOM 0 H ILE A 46 -2.429 -5.414 -6.377 1.00 0.00 H new ATOM 0 HA ILE A 46 -4.250 -3.144 -5.955 1.00 0.00 H new ATOM 0 HB ILE A 46 -1.434 -3.504 -7.119 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -1.185 -2.447 -4.559 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.535 -3.547 -4.356 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.136 -1.122 -6.493 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.461 -1.313 -7.666 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -2.828 -1.055 -5.943 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -0.382 -4.719 -3.962 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.205 -5.390 -5.390 1.00 0.00 H new ATOM 0 HD13 ILE A 46 0.165 -4.273 -5.596 1.00 0.00 H new ATOM 743 N LYS A 47 -4.458 -2.134 -8.331 1.00 0.00 N ATOM 744 CA LYS A 47 -4.943 -1.825 -9.708 1.00 0.00 C ATOM 745 C LYS A 47 -4.734 -0.344 -10.035 1.00 0.00 C ATOM 746 O LYS A 47 -4.137 0.002 -11.034 1.00 0.00 O ATOM 747 CB LYS A 47 -6.434 -2.159 -9.681 1.00 0.00 C ATOM 748 CG LYS A 47 -6.959 -2.265 -11.114 1.00 0.00 C ATOM 749 CD LYS A 47 -8.076 -3.308 -11.174 1.00 0.00 C ATOM 750 CE LYS A 47 -8.952 -3.190 -9.924 1.00 0.00 C ATOM 751 NZ LYS A 47 -10.277 -3.733 -10.333 1.00 0.00 N ATOM 0 H LYS A 47 -4.512 -1.363 -7.665 1.00 0.00 H new ATOM 0 HA LYS A 47 -4.405 -2.392 -10.468 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -6.598 -3.098 -9.152 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.981 -1.388 -9.138 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -7.333 -1.297 -11.448 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -6.150 -2.544 -11.789 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -8.679 -3.159 -12.069 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -7.650 -4.309 -11.240 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -8.532 -3.756 -9.092 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -9.034 -2.154 -9.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -10.935 -3.686 -9.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -10.654 -3.170 -11.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -10.169 -4.722 -10.635 1.00 0.00 H new ATOM 765 N ASP A 48 -5.224 0.532 -9.203 1.00 0.00 N ATOM 766 CA ASP A 48 -5.057 1.988 -9.471 1.00 0.00 C ATOM 767 C ASP A 48 -3.709 2.469 -8.936 1.00 0.00 C ATOM 768 O ASP A 48 -3.063 1.782 -8.170 1.00 0.00 O ATOM 769 CB ASP A 48 -6.206 2.665 -8.721 1.00 0.00 C ATOM 770 CG ASP A 48 -7.455 2.672 -9.603 1.00 0.00 C ATOM 771 OD1 ASP A 48 -7.555 3.547 -10.446 1.00 0.00 O ATOM 772 OD2 ASP A 48 -8.292 1.803 -9.420 1.00 0.00 O ATOM 0 H ASP A 48 -5.733 0.303 -8.349 1.00 0.00 H new ATOM 0 HA ASP A 48 -5.077 2.218 -10.536 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -6.408 2.136 -7.790 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -5.930 3.685 -8.455 1.00 0.00 H new ATOM 777 N PRO A 49 -3.330 3.639 -9.364 1.00 0.00 N ATOM 778 CA PRO A 49 -2.043 4.225 -8.927 1.00 0.00 C ATOM 779 C PRO A 49 -2.140 4.697 -7.475 1.00 0.00 C ATOM 780 O PRO A 49 -3.156 5.205 -7.041 1.00 0.00 O ATOM 781 CB PRO A 49 -1.847 5.405 -9.874 1.00 0.00 C ATOM 782 CG PRO A 49 -3.225 5.775 -10.323 1.00 0.00 C ATOM 783 CD PRO A 49 -4.057 4.520 -10.285 1.00 0.00 C ATOM 0 HA PRO A 49 -1.214 3.518 -8.961 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -1.359 6.239 -9.369 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -1.216 5.131 -10.720 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -3.650 6.538 -9.671 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -3.203 6.192 -11.330 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.068 4.722 -9.930 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -4.150 4.073 -11.275 1.00 0.00 H new ATOM 791 N ALA A 50 -1.089 4.534 -6.719 1.00 0.00 N ATOM 792 CA ALA A 50 -1.119 4.971 -5.296 1.00 0.00 C ATOM 793 C ALA A 50 -1.631 6.409 -5.192 1.00 0.00 C ATOM 794 O ALA A 50 -1.546 7.179 -6.128 1.00 0.00 O ATOM 795 CB ALA A 50 0.332 4.882 -4.825 1.00 0.00 C ATOM 0 H ALA A 50 -0.210 4.117 -7.026 1.00 0.00 H new ATOM 0 HA ALA A 50 -1.784 4.356 -4.690 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.395 5.189 -3.781 1.00 0.00 H new ATOM 0 HB2 ALA A 50 0.684 3.855 -4.923 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.953 5.538 -5.434 1.00 0.00 H new ATOM 801 N ASP A 51 -2.163 6.774 -4.060 1.00 0.00 N ATOM 802 CA ASP A 51 -2.682 8.162 -3.890 1.00 0.00 C ATOM 803 C ASP A 51 -1.973 8.847 -2.718 1.00 0.00 C ATOM 804 O ASP A 51 -1.864 8.297 -1.640 1.00 0.00 O ATOM 805 CB ASP A 51 -4.173 7.997 -3.597 1.00 0.00 C ATOM 806 CG ASP A 51 -4.968 8.137 -4.896 1.00 0.00 C ATOM 807 OD1 ASP A 51 -4.520 7.609 -5.901 1.00 0.00 O ATOM 808 OD2 ASP A 51 -6.010 8.769 -4.864 1.00 0.00 O ATOM 0 H ASP A 51 -2.262 6.171 -3.243 1.00 0.00 H new ATOM 0 HA ASP A 51 -2.510 8.780 -4.771 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -4.360 7.022 -3.147 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -4.498 8.748 -2.877 1.00 0.00 H new ATOM 813 N VAL A 52 -1.487 10.041 -2.921 1.00 0.00 N ATOM 814 CA VAL A 52 -0.783 10.756 -1.819 1.00 0.00 C ATOM 815 C VAL A 52 -1.720 11.769 -1.156 1.00 0.00 C ATOM 816 O VAL A 52 -2.300 12.614 -1.810 1.00 0.00 O ATOM 817 CB VAL A 52 0.385 11.471 -2.497 1.00 0.00 C ATOM 818 CG1 VAL A 52 1.234 12.180 -1.441 1.00 0.00 C ATOM 819 CG2 VAL A 52 1.247 10.447 -3.242 1.00 0.00 C ATOM 0 H VAL A 52 -1.547 10.552 -3.802 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.448 10.077 -1.035 1.00 0.00 H new ATOM 0 HB VAL A 52 -0.001 12.205 -3.204 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.067 12.690 -1.926 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.621 12.909 -0.911 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.620 11.447 -0.732 1.00 0.00 H new ATOM 0 HG21 VAL A 52 2.080 10.956 -3.726 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.632 9.712 -2.535 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.643 9.943 -3.996 1.00 0.00 H new ATOM 829 N TYR A 53 -1.871 11.694 0.138 1.00 0.00 N ATOM 830 CA TYR A 53 -2.767 12.654 0.843 1.00 0.00 C ATOM 831 C TYR A 53 -1.943 13.578 1.745 1.00 0.00 C ATOM 832 O TYR A 53 -1.576 13.220 2.846 1.00 0.00 O ATOM 833 CB TYR A 53 -3.703 11.782 1.681 1.00 0.00 C ATOM 834 CG TYR A 53 -4.904 11.391 0.854 1.00 0.00 C ATOM 835 CD1 TYR A 53 -4.806 10.341 -0.069 1.00 0.00 C ATOM 836 CD2 TYR A 53 -6.114 12.077 1.008 1.00 0.00 C ATOM 837 CE1 TYR A 53 -5.919 9.979 -0.837 1.00 0.00 C ATOM 838 CE2 TYR A 53 -7.227 11.714 0.240 1.00 0.00 C ATOM 839 CZ TYR A 53 -7.130 10.665 -0.683 1.00 0.00 C ATOM 840 OH TYR A 53 -8.226 10.309 -1.441 1.00 0.00 O ATOM 0 H TYR A 53 -1.412 11.009 0.738 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.317 13.291 0.151 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.178 10.890 2.022 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -4.022 12.324 2.571 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -3.872 9.811 -0.188 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -6.189 12.886 1.719 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -5.844 9.170 -1.549 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -8.161 12.243 0.359 1.00 0.00 H new ATOM 0 HH TYR A 53 -8.985 10.884 -1.209 1.00 0.00 H new ATOM 850 N TYR A 54 -1.648 14.763 1.284 1.00 0.00 N ATOM 851 CA TYR A 54 -0.845 15.708 2.115 1.00 0.00 C ATOM 852 C TYR A 54 -1.714 16.320 3.216 1.00 0.00 C ATOM 853 O TYR A 54 -2.660 17.034 2.951 1.00 0.00 O ATOM 854 CB TYR A 54 -0.372 16.786 1.138 1.00 0.00 C ATOM 855 CG TYR A 54 0.587 16.174 0.145 1.00 0.00 C ATOM 856 CD1 TYR A 54 1.684 15.430 0.597 1.00 0.00 C ATOM 857 CD2 TYR A 54 0.379 16.350 -1.228 1.00 0.00 C ATOM 858 CE1 TYR A 54 2.572 14.862 -0.324 1.00 0.00 C ATOM 859 CE2 TYR A 54 1.268 15.782 -2.149 1.00 0.00 C ATOM 860 CZ TYR A 54 2.364 15.038 -1.697 1.00 0.00 C ATOM 861 OH TYR A 54 3.240 14.477 -2.604 1.00 0.00 O ATOM 0 H TYR A 54 -1.927 15.118 0.370 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.011 15.214 2.613 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.225 17.220 0.617 1.00 0.00 H new ATOM 0 HB3 TYR A 54 0.116 17.596 1.680 1.00 0.00 H new ATOM 0 HD1 TYR A 54 1.845 15.294 1.656 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -0.467 16.924 -1.577 1.00 0.00 H new ATOM 0 HE1 TYR A 54 3.418 14.288 0.025 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.108 15.918 -3.208 1.00 0.00 H new ATOM 0 HH TYR A 54 2.951 14.694 -3.515 1.00 0.00 H new ATOM 871 N THR A 55 -1.398 16.046 4.453 1.00 0.00 N ATOM 872 CA THR A 55 -2.204 16.611 5.574 1.00 0.00 C ATOM 873 C THR A 55 -1.389 17.659 6.336 1.00 0.00 C ATOM 874 O THR A 55 -0.316 18.049 5.921 1.00 0.00 O ATOM 875 CB THR A 55 -2.518 15.417 6.477 1.00 0.00 C ATOM 876 OG1 THR A 55 -1.326 14.680 6.714 1.00 0.00 O ATOM 877 CG2 THR A 55 -3.550 14.516 5.796 1.00 0.00 C ATOM 0 H THR A 55 -0.616 15.455 4.736 1.00 0.00 H new ATOM 0 HA THR A 55 -3.109 17.106 5.223 1.00 0.00 H new ATOM 0 HB THR A 55 -2.921 15.774 7.425 1.00 0.00 H new ATOM 0 HG1 THR A 55 -1.524 13.915 7.293 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.773 13.666 6.441 1.00 0.00 H new ATOM 0 HG22 THR A 55 -4.463 15.082 5.614 1.00 0.00 H new ATOM 0 HG23 THR A 55 -3.150 14.157 4.848 1.00 0.00 H new ATOM 885 N LYS A 56 -1.889 18.117 7.452 1.00 0.00 N ATOM 886 CA LYS A 56 -1.142 19.138 8.242 1.00 0.00 C ATOM 887 C LYS A 56 0.109 18.510 8.865 1.00 0.00 C ATOM 888 O LYS A 56 1.047 19.195 9.221 1.00 0.00 O ATOM 889 CB LYS A 56 -2.117 19.587 9.331 1.00 0.00 C ATOM 890 CG LYS A 56 -1.359 19.791 10.645 1.00 0.00 C ATOM 891 CD LYS A 56 -2.293 20.419 11.681 1.00 0.00 C ATOM 892 CE LYS A 56 -2.040 19.783 13.049 1.00 0.00 C ATOM 893 NZ LYS A 56 -3.307 19.982 13.806 1.00 0.00 N ATOM 0 H LYS A 56 -2.782 17.828 7.851 1.00 0.00 H new ATOM 0 HA LYS A 56 -0.806 19.973 7.627 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.608 20.514 9.035 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -2.900 18.840 9.463 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.982 18.836 11.011 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.494 20.434 10.482 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -2.126 21.495 11.732 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -3.332 20.271 11.386 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -1.799 18.724 12.954 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -1.199 20.257 13.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.211 19.571 14.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -3.507 20.999 13.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -4.089 19.514 13.304 1.00 0.00 H new ATOM 907 N LYS A 57 0.128 17.211 9.002 1.00 0.00 N ATOM 908 CA LYS A 57 1.318 16.543 9.603 1.00 0.00 C ATOM 909 C LYS A 57 2.295 16.110 8.506 1.00 0.00 C ATOM 910 O LYS A 57 3.273 16.778 8.235 1.00 0.00 O ATOM 911 CB LYS A 57 0.756 15.323 10.336 1.00 0.00 C ATOM 912 CG LYS A 57 0.203 15.754 11.696 1.00 0.00 C ATOM 913 CD LYS A 57 -1.302 15.487 11.747 1.00 0.00 C ATOM 914 CE LYS A 57 -1.736 15.285 13.201 1.00 0.00 C ATOM 915 NZ LYS A 57 -3.209 15.076 13.138 1.00 0.00 N ATOM 0 H LYS A 57 -0.628 16.585 8.724 1.00 0.00 H new ATOM 0 HA LYS A 57 1.869 17.204 10.272 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -0.031 14.859 9.742 1.00 0.00 H new ATOM 0 HB3 LYS A 57 1.537 14.574 10.470 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.706 15.208 12.494 1.00 0.00 H new ATOM 0 HG3 LYS A 57 0.400 16.813 11.861 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -1.845 16.323 11.307 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -1.545 14.603 11.158 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -1.234 14.426 13.647 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -1.486 16.153 13.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -3.580 14.930 14.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -3.661 15.912 12.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -3.416 14.239 12.556 1.00 0.00 H new ATOM 929 N LYS A 58 2.038 14.999 7.873 1.00 0.00 N ATOM 930 CA LYS A 58 2.952 14.524 6.795 1.00 0.00 C ATOM 931 C LYS A 58 2.144 13.928 5.641 1.00 0.00 C ATOM 932 O LYS A 58 0.967 13.654 5.770 1.00 0.00 O ATOM 933 CB LYS A 58 3.815 13.449 7.456 1.00 0.00 C ATOM 934 CG LYS A 58 5.280 13.887 7.430 1.00 0.00 C ATOM 935 CD LYS A 58 5.736 14.058 5.980 1.00 0.00 C ATOM 936 CE LYS A 58 7.259 14.174 5.937 1.00 0.00 C ATOM 937 NZ LYS A 58 7.573 15.418 6.693 1.00 0.00 N ATOM 0 H LYS A 58 1.234 14.399 8.055 1.00 0.00 H new ATOM 0 HA LYS A 58 3.553 15.331 6.377 1.00 0.00 H new ATOM 0 HB2 LYS A 58 3.490 13.288 8.484 1.00 0.00 H new ATOM 0 HB3 LYS A 58 3.698 12.500 6.932 1.00 0.00 H new ATOM 0 HG2 LYS A 58 5.400 14.824 7.973 1.00 0.00 H new ATOM 0 HG3 LYS A 58 5.901 13.146 7.933 1.00 0.00 H new ATOM 0 HD2 LYS A 58 5.408 13.208 5.381 1.00 0.00 H new ATOM 0 HD3 LYS A 58 5.280 14.948 5.546 1.00 0.00 H new ATOM 0 HE2 LYS A 58 7.734 13.305 6.392 1.00 0.00 H new ATOM 0 HE3 LYS A 58 7.621 14.234 4.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 8.315 15.950 6.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 6.717 16.004 6.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 7.907 15.170 7.646 1.00 0.00 H new ATOM 951 N ALA A 59 2.767 13.722 4.512 1.00 0.00 N ATOM 952 CA ALA A 59 2.032 13.143 3.352 1.00 0.00 C ATOM 953 C ALA A 59 1.525 11.742 3.701 1.00 0.00 C ATOM 954 O ALA A 59 1.989 11.119 4.635 1.00 0.00 O ATOM 955 CB ALA A 59 3.061 13.077 2.225 1.00 0.00 C ATOM 0 H ALA A 59 3.751 13.929 4.343 1.00 0.00 H new ATOM 0 HA ALA A 59 1.162 13.737 3.072 1.00 0.00 H new ATOM 0 HB1 ALA A 59 2.596 12.660 1.332 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.428 14.080 2.008 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.894 12.444 2.530 1.00 0.00 H new ATOM 961 N GLU A 60 0.574 11.241 2.961 1.00 0.00 N ATOM 962 CA GLU A 60 0.041 9.881 3.259 1.00 0.00 C ATOM 963 C GLU A 60 -0.269 9.131 1.960 1.00 0.00 C ATOM 964 O GLU A 60 -1.314 9.305 1.367 1.00 0.00 O ATOM 965 CB GLU A 60 -1.240 10.126 4.055 1.00 0.00 C ATOM 966 CG GLU A 60 -0.882 10.613 5.461 1.00 0.00 C ATOM 967 CD GLU A 60 -2.163 10.827 6.270 1.00 0.00 C ATOM 968 OE1 GLU A 60 -3.229 10.574 5.732 1.00 0.00 O ATOM 969 OE2 GLU A 60 -2.056 11.239 7.412 1.00 0.00 O ATOM 0 H GLU A 60 0.144 11.713 2.165 1.00 0.00 H new ATOM 0 HA GLU A 60 0.756 9.271 3.811 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -1.859 10.867 3.549 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -1.825 9.208 4.114 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.243 9.883 5.958 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -0.317 11.543 5.402 1.00 0.00 H new ATOM 976 N VAL A 61 0.629 8.294 1.517 1.00 0.00 N ATOM 977 CA VAL A 61 0.382 7.530 0.261 1.00 0.00 C ATOM 978 C VAL A 61 -0.618 6.400 0.523 1.00 0.00 C ATOM 979 O VAL A 61 -0.615 5.791 1.573 1.00 0.00 O ATOM 980 CB VAL A 61 1.743 6.959 -0.133 1.00 0.00 C ATOM 981 CG1 VAL A 61 1.574 5.996 -1.308 1.00 0.00 C ATOM 982 CG2 VAL A 61 2.675 8.103 -0.539 1.00 0.00 C ATOM 0 H VAL A 61 1.523 8.106 1.970 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.039 8.155 -0.527 1.00 0.00 H new ATOM 0 HB VAL A 61 2.171 6.423 0.714 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.546 5.589 -1.588 1.00 0.00 H new ATOM 0 HG12 VAL A 61 0.910 5.182 -1.018 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.146 6.529 -2.157 1.00 0.00 H new ATOM 0 HG21 VAL A 61 3.647 7.698 -0.821 1.00 0.00 H new ATOM 0 HG22 VAL A 61 2.246 8.639 -1.386 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.797 8.788 0.300 1.00 0.00 H new ATOM 992 N GLU A 62 -1.472 6.117 -0.422 1.00 0.00 N ATOM 993 CA GLU A 62 -2.470 5.028 -0.220 1.00 0.00 C ATOM 994 C GLU A 62 -2.440 4.053 -1.401 1.00 0.00 C ATOM 995 O GLU A 62 -1.835 4.319 -2.421 1.00 0.00 O ATOM 996 CB GLU A 62 -3.821 5.741 -0.145 1.00 0.00 C ATOM 997 CG GLU A 62 -3.678 7.018 0.685 1.00 0.00 C ATOM 998 CD GLU A 62 -5.053 7.450 1.200 1.00 0.00 C ATOM 999 OE1 GLU A 62 -6.030 6.840 0.801 1.00 0.00 O ATOM 1000 OE2 GLU A 62 -5.103 8.382 1.986 1.00 0.00 O ATOM 0 H GLU A 62 -1.522 6.591 -1.324 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.267 4.442 0.677 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.172 5.984 -1.148 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.566 5.084 0.304 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.002 6.846 1.523 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.239 7.811 0.079 1.00 0.00 H new ATOM 1007 N LEU A 63 -3.086 2.927 -1.269 1.00 0.00 N ATOM 1008 CA LEU A 63 -3.093 1.935 -2.383 1.00 0.00 C ATOM 1009 C LEU A 63 -4.378 1.103 -2.344 1.00 0.00 C ATOM 1010 O LEU A 63 -4.942 0.863 -1.295 1.00 0.00 O ATOM 1011 CB LEU A 63 -1.873 1.049 -2.128 1.00 0.00 C ATOM 1012 CG LEU A 63 -0.647 1.659 -2.807 1.00 0.00 C ATOM 1013 CD1 LEU A 63 0.393 2.030 -1.747 1.00 0.00 C ATOM 1014 CD2 LEU A 63 -0.044 0.641 -3.777 1.00 0.00 C ATOM 0 H LEU A 63 -3.609 2.650 -0.438 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.055 2.412 -3.362 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.698 0.953 -1.056 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.053 0.045 -2.513 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.943 2.554 -3.354 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.267 2.465 -2.232 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.036 2.754 -1.054 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.689 1.135 -1.199 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.831 1.074 -4.262 1.00 0.00 H new ATOM 0 HD22 LEU A 63 0.251 -0.253 -3.229 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.784 0.376 -4.532 1.00 0.00 H new ATOM 1026 N ASP A 64 -4.846 0.659 -3.480 1.00 0.00 N ATOM 1027 CA ASP A 64 -6.094 -0.157 -3.503 1.00 0.00 C ATOM 1028 C ASP A 64 -5.749 -1.646 -3.587 1.00 0.00 C ATOM 1029 O ASP A 64 -4.727 -2.028 -4.121 1.00 0.00 O ATOM 1030 CB ASP A 64 -6.838 0.291 -4.761 1.00 0.00 C ATOM 1031 CG ASP A 64 -8.144 -0.496 -4.889 1.00 0.00 C ATOM 1032 OD1 ASP A 64 -9.062 -0.209 -4.139 1.00 0.00 O ATOM 1033 OD2 ASP A 64 -8.203 -1.373 -5.736 1.00 0.00 O ATOM 0 H ASP A 64 -4.419 0.826 -4.391 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.694 -0.019 -2.604 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -7.048 1.359 -4.711 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -6.216 0.129 -5.641 1.00 0.00 H new ATOM 1038 N ILE A 65 -6.594 -2.490 -3.063 1.00 0.00 N ATOM 1039 CA ILE A 65 -6.315 -3.955 -3.113 1.00 0.00 C ATOM 1040 C ILE A 65 -7.588 -4.718 -3.489 1.00 0.00 C ATOM 1041 O ILE A 65 -8.535 -4.777 -2.731 1.00 0.00 O ATOM 1042 CB ILE A 65 -5.863 -4.320 -1.699 1.00 0.00 C ATOM 1043 CG1 ILE A 65 -4.391 -3.936 -1.521 1.00 0.00 C ATOM 1044 CG2 ILE A 65 -6.025 -5.826 -1.481 1.00 0.00 C ATOM 1045 CD1 ILE A 65 -4.294 -2.472 -1.092 1.00 0.00 C ATOM 0 H ILE A 65 -7.466 -2.230 -2.602 1.00 0.00 H new ATOM 0 HA ILE A 65 -5.561 -4.210 -3.857 1.00 0.00 H new ATOM 0 HB ILE A 65 -6.472 -3.781 -0.973 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -3.925 -4.577 -0.773 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.849 -4.089 -2.454 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -5.702 -6.084 -0.472 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -7.072 -6.102 -1.609 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.416 -6.366 -2.206 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.246 -2.199 -0.965 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -4.745 -1.838 -1.856 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -4.822 -2.334 -0.148 1.00 0.00 H new ATOM 1057 N ASN A 66 -7.619 -5.298 -4.657 1.00 0.00 N ATOM 1058 CA ASN A 66 -8.832 -6.050 -5.087 1.00 0.00 C ATOM 1059 C ASN A 66 -8.851 -7.448 -4.459 1.00 0.00 C ATOM 1060 O ASN A 66 -9.878 -8.094 -4.398 1.00 0.00 O ATOM 1061 CB ASN A 66 -8.718 -6.146 -6.608 1.00 0.00 C ATOM 1062 CG ASN A 66 -9.551 -7.327 -7.110 1.00 0.00 C ATOM 1063 OD1 ASN A 66 -9.012 -8.346 -7.494 1.00 0.00 O ATOM 1064 ND2 ASN A 66 -10.852 -7.232 -7.123 1.00 0.00 N ATOM 0 H ASN A 66 -6.856 -5.284 -5.333 1.00 0.00 H new ATOM 0 HA ASN A 66 -9.752 -5.556 -4.775 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -9.065 -5.221 -7.068 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -7.675 -6.274 -6.898 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -11.417 -8.013 -7.456 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -11.304 -6.376 -6.801 1.00 0.00 H new ATOM 1071 N THR A 67 -7.727 -7.921 -3.996 1.00 0.00 N ATOM 1072 CA THR A 67 -7.693 -9.278 -3.378 1.00 0.00 C ATOM 1073 C THR A 67 -7.314 -9.177 -1.897 1.00 0.00 C ATOM 1074 O THR A 67 -6.295 -9.685 -1.471 1.00 0.00 O ATOM 1075 CB THR A 67 -6.620 -10.041 -4.158 1.00 0.00 C ATOM 1076 OG1 THR A 67 -5.369 -9.387 -4.001 1.00 0.00 O ATOM 1077 CG2 THR A 67 -6.996 -10.082 -5.639 1.00 0.00 C ATOM 0 H THR A 67 -6.833 -7.430 -4.018 1.00 0.00 H new ATOM 0 HA THR A 67 -8.661 -9.777 -3.423 1.00 0.00 H new ATOM 0 HB THR A 67 -6.547 -11.060 -3.777 1.00 0.00 H new ATOM 0 HG1 THR A 67 -5.154 -9.316 -3.047 1.00 0.00 H new ATOM 0 HG21 THR A 67 -6.231 -10.626 -6.194 1.00 0.00 H new ATOM 0 HG22 THR A 67 -7.956 -10.585 -5.757 1.00 0.00 H new ATOM 0 HG23 THR A 67 -7.069 -9.065 -6.024 1.00 0.00 H new ATOM 1085 N ALA A 68 -8.127 -8.526 -1.111 1.00 0.00 N ATOM 1086 CA ALA A 68 -7.815 -8.393 0.340 1.00 0.00 C ATOM 1087 C ALA A 68 -7.900 -9.758 1.028 1.00 0.00 C ATOM 1088 O ALA A 68 -7.271 -9.994 2.041 1.00 0.00 O ATOM 1089 CB ALA A 68 -8.887 -7.451 0.888 1.00 0.00 C ATOM 0 H ALA A 68 -8.994 -8.080 -1.411 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.808 -8.013 0.513 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -8.728 -7.300 1.956 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.826 -6.492 0.373 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -9.872 -7.888 0.726 1.00 0.00 H new ATOM 1095 N SER A 69 -8.672 -10.659 0.485 1.00 0.00 N ATOM 1096 CA SER A 69 -8.799 -12.007 1.107 1.00 0.00 C ATOM 1097 C SER A 69 -7.483 -12.784 0.976 1.00 0.00 C ATOM 1098 O SER A 69 -7.266 -13.769 1.655 1.00 0.00 O ATOM 1099 CB SER A 69 -9.910 -12.702 0.321 1.00 0.00 C ATOM 1100 OG SER A 69 -10.670 -13.517 1.203 1.00 0.00 O ATOM 0 H SER A 69 -9.221 -10.520 -0.363 1.00 0.00 H new ATOM 0 HA SER A 69 -9.025 -11.948 2.172 1.00 0.00 H new ATOM 0 HB2 SER A 69 -10.554 -11.961 -0.154 1.00 0.00 H new ATOM 0 HB3 SER A 69 -9.482 -13.310 -0.476 1.00 0.00 H new ATOM 0 HG SER A 69 -11.385 -13.963 0.702 1.00 0.00 H new ATOM 1106 N THR A 70 -6.606 -12.355 0.109 1.00 0.00 N ATOM 1107 CA THR A 70 -5.312 -13.078 -0.060 1.00 0.00 C ATOM 1108 C THR A 70 -4.228 -12.449 0.822 1.00 0.00 C ATOM 1109 O THR A 70 -3.404 -13.135 1.393 1.00 0.00 O ATOM 1110 CB THR A 70 -4.960 -12.914 -1.539 1.00 0.00 C ATOM 1111 OG1 THR A 70 -4.749 -11.538 -1.824 1.00 0.00 O ATOM 1112 CG2 THR A 70 -6.105 -13.447 -2.402 1.00 0.00 C ATOM 0 H THR A 70 -6.729 -11.537 -0.488 1.00 0.00 H new ATOM 0 HA THR A 70 -5.385 -14.126 0.231 1.00 0.00 H new ATOM 0 HB THR A 70 -4.052 -13.475 -1.760 1.00 0.00 H new ATOM 0 HG1 THR A 70 -5.609 -11.068 -1.824 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.852 -13.329 -3.456 1.00 0.00 H new ATOM 0 HG22 THR A 70 -6.265 -14.503 -2.183 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.016 -12.889 -2.183 1.00 0.00 H new ATOM 1120 N TRP A 71 -4.220 -11.148 0.934 1.00 0.00 N ATOM 1121 CA TRP A 71 -3.184 -10.479 1.773 1.00 0.00 C ATOM 1122 C TRP A 71 -3.364 -10.848 3.250 1.00 0.00 C ATOM 1123 O TRP A 71 -4.457 -10.813 3.781 1.00 0.00 O ATOM 1124 CB TRP A 71 -3.413 -8.981 1.571 1.00 0.00 C ATOM 1125 CG TRP A 71 -3.077 -8.608 0.163 1.00 0.00 C ATOM 1126 CD1 TRP A 71 -3.974 -8.210 -0.768 1.00 0.00 C ATOM 1127 CD2 TRP A 71 -1.773 -8.588 -0.488 1.00 0.00 C ATOM 1128 NE1 TRP A 71 -3.304 -7.948 -1.950 1.00 0.00 N ATOM 1129 CE2 TRP A 71 -1.947 -8.166 -1.828 1.00 0.00 C ATOM 1130 CE3 TRP A 71 -0.471 -8.892 -0.052 1.00 0.00 C ATOM 1131 CZ2 TRP A 71 -0.866 -8.050 -2.704 1.00 0.00 C ATOM 1132 CZ3 TRP A 71 0.618 -8.776 -0.931 1.00 0.00 C ATOM 1133 CH2 TRP A 71 0.421 -8.356 -2.254 1.00 0.00 C ATOM 0 H TRP A 71 -4.885 -10.520 0.482 1.00 0.00 H new ATOM 0 HA TRP A 71 -2.176 -10.784 1.491 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -4.451 -8.729 1.787 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -2.796 -8.411 2.266 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -5.039 -8.113 -0.614 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -3.758 -7.632 -2.807 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -0.308 -9.217 0.965 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -1.023 -7.726 -3.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 1.614 -9.012 -0.586 1.00 0.00 H new ATOM 0 HH2 TRP A 71 1.263 -8.269 -2.925 1.00 0.00 H new ATOM 1144 N LYS A 72 -2.297 -11.192 3.917 1.00 0.00 N ATOM 1145 CA LYS A 72 -2.397 -11.553 5.360 1.00 0.00 C ATOM 1146 C LYS A 72 -1.505 -10.623 6.187 1.00 0.00 C ATOM 1147 O LYS A 72 -1.860 -10.200 7.268 1.00 0.00 O ATOM 1148 CB LYS A 72 -1.900 -12.997 5.445 1.00 0.00 C ATOM 1149 CG LYS A 72 -2.696 -13.750 6.513 1.00 0.00 C ATOM 1150 CD LYS A 72 -1.732 -14.477 7.453 1.00 0.00 C ATOM 1151 CE LYS A 72 -1.774 -13.822 8.834 1.00 0.00 C ATOM 1152 NZ LYS A 72 -1.241 -14.855 9.766 1.00 0.00 N ATOM 0 H LYS A 72 -1.357 -11.239 3.524 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.411 -11.455 5.747 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.012 -13.489 4.479 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.838 -13.013 5.689 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -3.315 -13.053 7.078 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.370 -14.466 6.042 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.006 -15.529 7.529 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.719 -14.440 7.052 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.168 -12.916 8.860 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -2.790 -13.534 9.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -1.238 -14.479 10.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.842 -15.703 9.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.270 -15.105 9.489 1.00 0.00 H new ATOM 1166 N LYS A 73 -0.349 -10.297 5.675 1.00 0.00 N ATOM 1167 CA LYS A 73 0.572 -9.387 6.415 1.00 0.00 C ATOM 1168 C LYS A 73 1.051 -8.272 5.482 1.00 0.00 C ATOM 1169 O LYS A 73 0.929 -8.370 4.278 1.00 0.00 O ATOM 1170 CB LYS A 73 1.744 -10.271 6.845 1.00 0.00 C ATOM 1171 CG LYS A 73 1.316 -11.159 8.015 1.00 0.00 C ATOM 1172 CD LYS A 73 1.366 -10.353 9.316 1.00 0.00 C ATOM 1173 CE LYS A 73 1.923 -11.231 10.440 1.00 0.00 C ATOM 1174 NZ LYS A 73 0.818 -12.171 10.775 1.00 0.00 N ATOM 0 H LYS A 73 -0.002 -10.623 4.773 1.00 0.00 H new ATOM 0 HA LYS A 73 0.093 -8.910 7.270 1.00 0.00 H new ATOM 0 HB2 LYS A 73 2.073 -10.888 6.009 1.00 0.00 H new ATOM 0 HB3 LYS A 73 2.592 -9.651 7.137 1.00 0.00 H new ATOM 0 HG2 LYS A 73 0.307 -11.537 7.848 1.00 0.00 H new ATOM 0 HG3 LYS A 73 1.973 -12.026 8.087 1.00 0.00 H new ATOM 0 HD2 LYS A 73 1.992 -9.470 9.186 1.00 0.00 H new ATOM 0 HD3 LYS A 73 0.368 -10.000 9.576 1.00 0.00 H new ATOM 0 HE2 LYS A 73 2.814 -11.768 10.117 1.00 0.00 H new ATOM 0 HE3 LYS A 73 2.208 -10.632 11.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 1.056 -12.690 11.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -0.061 -11.635 10.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 0.687 -12.845 9.994 1.00 0.00 H new ATOM 1188 N PHE A 74 1.595 -7.215 6.022 1.00 0.00 N ATOM 1189 CA PHE A 74 2.079 -6.101 5.153 1.00 0.00 C ATOM 1190 C PHE A 74 2.740 -5.012 6.002 1.00 0.00 C ATOM 1191 O PHE A 74 2.163 -4.512 6.947 1.00 0.00 O ATOM 1192 CB PHE A 74 0.828 -5.550 4.467 1.00 0.00 C ATOM 1193 CG PHE A 74 1.204 -4.369 3.602 1.00 0.00 C ATOM 1194 CD1 PHE A 74 2.438 -4.348 2.938 1.00 0.00 C ATOM 1195 CD2 PHE A 74 0.316 -3.297 3.462 1.00 0.00 C ATOM 1196 CE1 PHE A 74 2.781 -3.252 2.136 1.00 0.00 C ATOM 1197 CE2 PHE A 74 0.659 -2.203 2.659 1.00 0.00 C ATOM 1198 CZ PHE A 74 1.892 -2.180 1.997 1.00 0.00 C ATOM 0 H PHE A 74 1.725 -7.074 7.024 1.00 0.00 H new ATOM 0 HA PHE A 74 2.823 -6.442 4.433 1.00 0.00 H new ATOM 0 HB2 PHE A 74 0.363 -6.326 3.859 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.094 -5.248 5.214 1.00 0.00 H new ATOM 0 HD1 PHE A 74 3.124 -5.176 3.045 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -0.635 -3.314 3.974 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.732 -3.234 1.625 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -0.028 -1.377 2.550 1.00 0.00 H new ATOM 0 HZ PHE A 74 2.157 -1.335 1.379 1.00 0.00 H new ATOM 1208 N GLU A 75 3.944 -4.638 5.669 1.00 0.00 N ATOM 1209 CA GLU A 75 4.638 -3.579 6.456 1.00 0.00 C ATOM 1210 C GLU A 75 5.881 -3.089 5.707 1.00 0.00 C ATOM 1211 O GLU A 75 6.959 -3.626 5.859 1.00 0.00 O ATOM 1212 CB GLU A 75 5.035 -4.255 7.768 1.00 0.00 C ATOM 1213 CG GLU A 75 4.034 -3.877 8.862 1.00 0.00 C ATOM 1214 CD GLU A 75 4.760 -3.131 9.983 1.00 0.00 C ATOM 1215 OE1 GLU A 75 5.215 -2.026 9.735 1.00 0.00 O ATOM 1216 OE2 GLU A 75 4.847 -3.677 11.071 1.00 0.00 O ATOM 0 H GLU A 75 4.477 -5.019 4.887 1.00 0.00 H new ATOM 0 HA GLU A 75 4.004 -2.708 6.622 1.00 0.00 H new ATOM 0 HB2 GLU A 75 5.057 -5.337 7.639 1.00 0.00 H new ATOM 0 HB3 GLU A 75 6.040 -3.948 8.058 1.00 0.00 H new ATOM 0 HG2 GLU A 75 3.244 -3.251 8.446 1.00 0.00 H new ATOM 0 HG3 GLU A 75 3.556 -4.773 9.257 1.00 0.00 H new ATOM 1223 N VAL A 76 5.738 -2.074 4.900 1.00 0.00 N ATOM 1224 CA VAL A 76 6.913 -1.553 4.144 1.00 0.00 C ATOM 1225 C VAL A 76 8.038 -1.174 5.111 1.00 0.00 C ATOM 1226 O VAL A 76 7.801 -0.852 6.259 1.00 0.00 O ATOM 1227 CB VAL A 76 6.392 -0.314 3.416 1.00 0.00 C ATOM 1228 CG1 VAL A 76 5.211 -0.702 2.525 1.00 0.00 C ATOM 1229 CG2 VAL A 76 5.934 0.724 4.442 1.00 0.00 C ATOM 0 H VAL A 76 4.860 -1.583 4.731 1.00 0.00 H new ATOM 0 HA VAL A 76 7.323 -2.291 3.454 1.00 0.00 H new ATOM 0 HB VAL A 76 7.188 0.106 2.801 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.840 0.182 2.007 1.00 0.00 H new ATOM 0 HG12 VAL A 76 5.535 -1.442 1.794 1.00 0.00 H new ATOM 0 HG13 VAL A 76 4.415 -1.123 3.139 1.00 0.00 H new ATOM 0 HG21 VAL A 76 5.562 1.608 3.924 1.00 0.00 H new ATOM 0 HG22 VAL A 76 5.139 0.302 5.056 1.00 0.00 H new ATOM 0 HG23 VAL A 76 6.774 1.003 5.078 1.00 0.00 H new ATOM 1239 N TYR A 77 9.261 -1.211 4.657 1.00 0.00 N ATOM 1240 CA TYR A 77 10.399 -0.853 5.552 1.00 0.00 C ATOM 1241 C TYR A 77 11.488 -0.126 4.757 1.00 0.00 C ATOM 1242 O TYR A 77 12.049 -0.662 3.822 1.00 0.00 O ATOM 1243 CB TYR A 77 10.919 -2.190 6.084 1.00 0.00 C ATOM 1244 CG TYR A 77 12.422 -2.238 5.947 1.00 0.00 C ATOM 1245 CD1 TYR A 77 13.229 -1.523 6.839 1.00 0.00 C ATOM 1246 CD2 TYR A 77 13.009 -2.997 4.928 1.00 0.00 C ATOM 1247 CE1 TYR A 77 14.622 -1.566 6.712 1.00 0.00 C ATOM 1248 CE2 TYR A 77 14.403 -3.042 4.801 1.00 0.00 C ATOM 1249 CZ TYR A 77 15.209 -2.325 5.693 1.00 0.00 C ATOM 1250 OH TYR A 77 16.583 -2.368 5.568 1.00 0.00 O ATOM 0 H TYR A 77 9.522 -1.473 3.706 1.00 0.00 H new ATOM 0 HA TYR A 77 10.098 -0.185 6.359 1.00 0.00 H new ATOM 0 HB2 TYR A 77 10.635 -2.313 7.129 1.00 0.00 H new ATOM 0 HB3 TYR A 77 10.467 -3.014 5.532 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.777 -0.938 7.626 1.00 0.00 H new ATOM 0 HD2 TYR A 77 12.386 -3.548 4.239 1.00 0.00 H new ATOM 0 HE1 TYR A 77 15.244 -1.013 7.400 1.00 0.00 H new ATOM 0 HE2 TYR A 77 14.856 -3.629 4.016 1.00 0.00 H new ATOM 0 HH TYR A 77 16.825 -2.941 4.811 1.00 0.00 H new ATOM 1260 N GLU A 78 11.790 1.090 5.121 1.00 0.00 N ATOM 1261 CA GLU A 78 12.841 1.849 4.385 1.00 0.00 C ATOM 1262 C GLU A 78 13.672 2.689 5.360 1.00 0.00 C ATOM 1263 O GLU A 78 13.156 3.260 6.300 1.00 0.00 O ATOM 1264 CB GLU A 78 12.074 2.753 3.420 1.00 0.00 C ATOM 1265 CG GLU A 78 13.046 3.724 2.747 1.00 0.00 C ATOM 1266 CD GLU A 78 12.663 5.161 3.106 1.00 0.00 C ATOM 1267 OE1 GLU A 78 11.482 5.411 3.283 1.00 0.00 O ATOM 1268 OE2 GLU A 78 13.557 5.986 3.198 1.00 0.00 O ATOM 0 H GLU A 78 11.355 1.591 5.896 1.00 0.00 H new ATOM 0 HA GLU A 78 13.535 1.190 3.864 1.00 0.00 H new ATOM 0 HB2 GLU A 78 11.566 2.151 2.667 1.00 0.00 H new ATOM 0 HB3 GLU A 78 11.304 3.307 3.958 1.00 0.00 H new ATOM 0 HG2 GLU A 78 14.066 3.517 3.071 1.00 0.00 H new ATOM 0 HG3 GLU A 78 13.021 3.589 1.666 1.00 0.00 H new ATOM 1275 N ASN A 79 14.957 2.771 5.140 1.00 0.00 N ATOM 1276 CA ASN A 79 15.822 3.578 6.049 1.00 0.00 C ATOM 1277 C ASN A 79 15.749 3.037 7.480 1.00 0.00 C ATOM 1278 O ASN A 79 15.724 3.787 8.435 1.00 0.00 O ATOM 1279 CB ASN A 79 15.252 4.995 5.981 1.00 0.00 C ATOM 1280 CG ASN A 79 16.391 5.994 5.771 1.00 0.00 C ATOM 1281 OD1 ASN A 79 16.304 6.864 4.927 1.00 0.00 O ATOM 1282 ND2 ASN A 79 17.465 5.904 6.507 1.00 0.00 N ATOM 0 H ASN A 79 15.445 2.314 4.370 1.00 0.00 H new ATOM 0 HA ASN A 79 16.871 3.544 5.755 1.00 0.00 H new ATOM 0 HB2 ASN A 79 14.533 5.070 5.165 1.00 0.00 H new ATOM 0 HB3 ASN A 79 14.716 5.227 6.901 1.00 0.00 H new ATOM 0 HD21 ASN A 79 18.231 6.564 6.374 1.00 0.00 H new ATOM 0 HD22 ASN A 79 17.538 5.174 7.215 1.00 0.00 H new ATOM 1289 N ASN A 80 15.717 1.742 7.637 1.00 0.00 N ATOM 1290 CA ASN A 80 15.648 1.159 9.009 1.00 0.00 C ATOM 1291 C ASN A 80 14.418 1.689 9.749 1.00 0.00 C ATOM 1292 O ASN A 80 14.530 2.418 10.713 1.00 0.00 O ATOM 1293 CB ASN A 80 16.930 1.625 9.700 1.00 0.00 C ATOM 1294 CG ASN A 80 17.324 0.620 10.785 1.00 0.00 C ATOM 1295 OD1 ASN A 80 17.704 -0.495 10.488 1.00 0.00 O ATOM 1296 ND2 ASN A 80 17.249 0.971 12.040 1.00 0.00 N ATOM 0 H ASN A 80 15.736 1.062 6.877 1.00 0.00 H new ATOM 0 HA ASN A 80 15.564 0.072 8.992 1.00 0.00 H new ATOM 0 HB2 ASN A 80 17.734 1.721 8.970 1.00 0.00 H new ATOM 0 HB3 ASN A 80 16.780 2.611 10.141 1.00 0.00 H new ATOM 0 HD21 ASN A 80 17.509 0.309 12.771 1.00 0.00 H new ATOM 0 HD22 ASN A 80 16.930 1.907 12.290 1.00 0.00 H new ATOM 1303 N GLN A 81 13.244 1.328 9.307 1.00 0.00 N ATOM 1304 CA GLN A 81 12.010 1.815 9.990 1.00 0.00 C ATOM 1305 C GLN A 81 10.765 1.203 9.343 1.00 0.00 C ATOM 1306 O GLN A 81 10.146 1.797 8.482 1.00 0.00 O ATOM 1307 CB GLN A 81 12.023 3.332 9.797 1.00 0.00 C ATOM 1308 CG GLN A 81 12.102 4.019 11.162 1.00 0.00 C ATOM 1309 CD GLN A 81 12.672 5.427 10.992 1.00 0.00 C ATOM 1310 OE1 GLN A 81 11.933 6.388 10.897 1.00 0.00 O ATOM 1311 NE2 GLN A 81 13.966 5.593 10.952 1.00 0.00 N ATOM 0 H GLN A 81 13.085 0.719 8.505 1.00 0.00 H new ATOM 0 HA GLN A 81 11.987 1.537 11.044 1.00 0.00 H new ATOM 0 HB2 GLN A 81 12.874 3.624 9.181 1.00 0.00 H new ATOM 0 HB3 GLN A 81 11.124 3.650 9.269 1.00 0.00 H new ATOM 0 HG2 GLN A 81 11.111 4.068 11.614 1.00 0.00 H new ATOM 0 HG3 GLN A 81 12.732 3.439 11.837 1.00 0.00 H new ATOM 0 HE21 GLN A 81 14.586 4.787 11.032 1.00 0.00 H new ATOM 0 HE22 GLN A 81 14.357 6.529 10.841 1.00 0.00 H new ATOM 1320 N LYS A 82 10.389 0.022 9.752 1.00 0.00 N ATOM 1321 CA LYS A 82 9.179 -0.621 9.163 1.00 0.00 C ATOM 1322 C LYS A 82 7.934 0.201 9.506 1.00 0.00 C ATOM 1323 O LYS A 82 7.533 0.290 10.650 1.00 0.00 O ATOM 1324 CB LYS A 82 9.108 -2.004 9.811 1.00 0.00 C ATOM 1325 CG LYS A 82 8.352 -2.963 8.888 1.00 0.00 C ATOM 1326 CD LYS A 82 9.211 -4.200 8.621 1.00 0.00 C ATOM 1327 CE LYS A 82 8.346 -5.302 8.005 1.00 0.00 C ATOM 1328 NZ LYS A 82 9.050 -6.573 8.334 1.00 0.00 N ATOM 0 H LYS A 82 10.867 -0.525 10.468 1.00 0.00 H new ATOM 0 HA LYS A 82 9.229 -0.687 8.076 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.113 -2.381 10.000 1.00 0.00 H new ATOM 0 HB3 LYS A 82 8.605 -1.940 10.776 1.00 0.00 H new ATOM 0 HG2 LYS A 82 7.407 -3.256 9.346 1.00 0.00 H new ATOM 0 HG3 LYS A 82 8.111 -2.466 7.949 1.00 0.00 H new ATOM 0 HD2 LYS A 82 10.030 -3.948 7.948 1.00 0.00 H new ATOM 0 HD3 LYS A 82 9.659 -4.552 9.550 1.00 0.00 H new ATOM 0 HE2 LYS A 82 7.338 -5.290 8.419 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.249 -5.172 6.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 8.517 -7.376 7.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.004 -6.558 7.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.121 -6.673 9.367 1.00 0.00 H new ATOM 1342 N LEU A 83 7.321 0.807 8.526 1.00 0.00 N ATOM 1343 CA LEU A 83 6.109 1.628 8.799 1.00 0.00 C ATOM 1344 C LEU A 83 4.880 0.726 8.978 1.00 0.00 C ATOM 1345 O LEU A 83 4.645 -0.157 8.177 1.00 0.00 O ATOM 1346 CB LEU A 83 5.944 2.511 7.562 1.00 0.00 C ATOM 1347 CG LEU A 83 7.233 3.298 7.322 1.00 0.00 C ATOM 1348 CD1 LEU A 83 7.174 3.968 5.949 1.00 0.00 C ATOM 1349 CD2 LEU A 83 7.384 4.369 8.405 1.00 0.00 C ATOM 0 H LEU A 83 7.608 0.769 7.548 1.00 0.00 H new ATOM 0 HA LEU A 83 6.208 2.214 9.713 1.00 0.00 H new ATOM 0 HB2 LEU A 83 5.713 1.897 6.692 1.00 0.00 H new ATOM 0 HB3 LEU A 83 5.107 3.196 7.700 1.00 0.00 H new ATOM 0 HG LEU A 83 8.085 2.619 7.358 1.00 0.00 H new ATOM 0 HD11 LEU A 83 8.093 4.529 5.778 1.00 0.00 H new ATOM 0 HD12 LEU A 83 7.065 3.206 5.177 1.00 0.00 H new ATOM 0 HD13 LEU A 83 6.322 4.647 5.912 1.00 0.00 H new ATOM 0 HD21 LEU A 83 8.302 4.931 8.235 1.00 0.00 H new ATOM 0 HD22 LEU A 83 6.531 5.047 8.367 1.00 0.00 H new ATOM 0 HD23 LEU A 83 7.426 3.893 9.384 1.00 0.00 H new ATOM 1361 N PRO A 84 4.130 0.977 10.022 1.00 0.00 N ATOM 1362 CA PRO A 84 2.915 0.173 10.290 1.00 0.00 C ATOM 1363 C PRO A 84 1.791 0.584 9.335 1.00 0.00 C ATOM 1364 O PRO A 84 0.986 1.441 9.642 1.00 0.00 O ATOM 1365 CB PRO A 84 2.559 0.527 11.730 1.00 0.00 C ATOM 1366 CG PRO A 84 3.152 1.882 11.959 1.00 0.00 C ATOM 1367 CD PRO A 84 4.338 2.017 11.039 1.00 0.00 C ATOM 0 HA PRO A 84 3.066 -0.897 10.147 1.00 0.00 H new ATOM 0 HB2 PRO A 84 1.479 0.540 11.877 1.00 0.00 H new ATOM 0 HB3 PRO A 84 2.967 -0.204 12.428 1.00 0.00 H new ATOM 0 HG2 PRO A 84 2.418 2.662 11.755 1.00 0.00 H new ATOM 0 HG3 PRO A 84 3.458 1.996 12.999 1.00 0.00 H new ATOM 0 HD2 PRO A 84 4.382 3.009 10.590 1.00 0.00 H new ATOM 0 HD3 PRO A 84 5.276 1.868 11.574 1.00 0.00 H new ATOM 1375 N VAL A 85 1.729 -0.019 8.180 1.00 0.00 N ATOM 1376 CA VAL A 85 0.658 0.342 7.209 1.00 0.00 C ATOM 1377 C VAL A 85 -0.712 0.210 7.875 1.00 0.00 C ATOM 1378 O VAL A 85 -1.043 -0.816 8.436 1.00 0.00 O ATOM 1379 CB VAL A 85 0.799 -0.661 6.066 1.00 0.00 C ATOM 1380 CG1 VAL A 85 0.431 -2.059 6.564 1.00 0.00 C ATOM 1381 CG2 VAL A 85 -0.140 -0.264 4.925 1.00 0.00 C ATOM 0 H VAL A 85 2.373 -0.745 7.867 1.00 0.00 H new ATOM 0 HA VAL A 85 0.747 1.369 6.856 1.00 0.00 H new ATOM 0 HB VAL A 85 1.829 -0.663 5.709 1.00 0.00 H new ATOM 0 HG11 VAL A 85 0.532 -2.774 5.748 1.00 0.00 H new ATOM 0 HG12 VAL A 85 1.097 -2.342 7.379 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.599 -2.059 6.921 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -0.042 -0.978 4.108 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.169 -0.263 5.284 1.00 0.00 H new ATOM 0 HG23 VAL A 85 0.121 0.733 4.569 1.00 0.00 H new ATOM 1391 N ARG A 86 -1.510 1.238 7.821 1.00 0.00 N ATOM 1392 CA ARG A 86 -2.854 1.161 8.458 1.00 0.00 C ATOM 1393 C ARG A 86 -3.945 1.078 7.388 1.00 0.00 C ATOM 1394 O ARG A 86 -3.685 1.220 6.210 1.00 0.00 O ATOM 1395 CB ARG A 86 -2.988 2.451 9.271 1.00 0.00 C ATOM 1396 CG ARG A 86 -2.751 3.660 8.363 1.00 0.00 C ATOM 1397 CD ARG A 86 -1.373 4.258 8.661 1.00 0.00 C ATOM 1398 NE ARG A 86 -1.531 4.954 9.968 1.00 0.00 N ATOM 1399 CZ ARG A 86 -0.692 4.716 10.940 1.00 0.00 C ATOM 1400 NH1 ARG A 86 0.569 4.505 10.676 1.00 0.00 N ATOM 1401 NH2 ARG A 86 -1.114 4.688 12.174 1.00 0.00 N ATOM 0 H ARG A 86 -1.292 2.124 7.366 1.00 0.00 H new ATOM 0 HA ARG A 86 -2.961 0.276 9.085 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.980 2.509 9.718 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.269 2.453 10.090 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -2.811 3.360 7.317 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -3.527 4.408 8.525 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -0.609 3.482 8.716 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -1.066 4.952 7.879 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.294 5.617 10.104 1.00 0.00 H new ATOM 0 HH11 ARG A 86 0.898 4.526 9.711 1.00 0.00 H new ATOM 0 HH12 ARG A 86 1.225 4.319 11.435 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.099 4.852 12.380 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.459 4.502 12.933 1.00 0.00 H new ATOM 1415 N LEU A 87 -5.166 0.847 7.788 1.00 0.00 N ATOM 1416 CA LEU A 87 -6.272 0.752 6.793 1.00 0.00 C ATOM 1417 C LEU A 87 -7.218 1.950 6.932 1.00 0.00 C ATOM 1418 O LEU A 87 -7.413 2.478 8.009 1.00 0.00 O ATOM 1419 CB LEU A 87 -7.003 -0.547 7.134 1.00 0.00 C ATOM 1420 CG LEU A 87 -6.821 -1.555 5.996 1.00 0.00 C ATOM 1421 CD1 LEU A 87 -6.048 -2.772 6.508 1.00 0.00 C ATOM 1422 CD2 LEU A 87 -8.194 -2.005 5.488 1.00 0.00 C ATOM 0 H LEU A 87 -5.445 0.720 8.761 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.903 0.756 5.767 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.615 -0.961 8.065 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.063 -0.349 7.291 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.266 -1.086 5.184 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.919 -3.489 5.697 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.070 -2.456 6.871 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.603 -3.240 7.321 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.065 -2.723 4.678 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.748 -2.473 6.302 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.748 -1.140 5.122 1.00 0.00 H new ATOM 1434 N VAL A 88 -7.806 2.380 5.849 1.00 0.00 N ATOM 1435 CA VAL A 88 -8.740 3.540 5.918 1.00 0.00 C ATOM 1436 C VAL A 88 -10.153 3.105 5.516 1.00 0.00 C ATOM 1437 O VAL A 88 -11.135 3.601 6.032 1.00 0.00 O ATOM 1438 CB VAL A 88 -8.187 4.555 4.918 1.00 0.00 C ATOM 1439 CG1 VAL A 88 -6.694 4.768 5.178 1.00 0.00 C ATOM 1440 CG2 VAL A 88 -8.386 4.030 3.494 1.00 0.00 C ATOM 0 H VAL A 88 -7.680 1.979 4.920 1.00 0.00 H new ATOM 0 HA VAL A 88 -8.809 3.955 6.923 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.715 5.502 5.034 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -6.300 5.492 4.465 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.551 5.143 6.192 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.166 3.821 5.063 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -7.992 4.754 2.781 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -7.859 3.083 3.378 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.449 3.879 3.307 1.00 0.00 H new ATOM 1450 N SER A 89 -10.262 2.183 4.598 1.00 0.00 N ATOM 1451 CA SER A 89 -11.611 1.718 4.164 1.00 0.00 C ATOM 1452 C SER A 89 -11.513 0.323 3.541 1.00 0.00 C ATOM 1453 O SER A 89 -10.490 -0.055 3.005 1.00 0.00 O ATOM 1454 CB SER A 89 -12.064 2.740 3.123 1.00 0.00 C ATOM 1455 OG SER A 89 -11.364 2.514 1.907 1.00 0.00 O ATOM 0 H SER A 89 -9.476 1.732 4.130 1.00 0.00 H new ATOM 0 HA SER A 89 -12.312 1.645 4.996 1.00 0.00 H new ATOM 0 HB2 SER A 89 -13.138 2.657 2.958 1.00 0.00 H new ATOM 0 HB3 SER A 89 -11.874 3.751 3.483 1.00 0.00 H new ATOM 0 HG SER A 89 -11.864 1.876 1.356 1.00 0.00 H new ATOM 1461 N TYR A 90 -12.564 -0.448 3.607 1.00 0.00 N ATOM 1462 CA TYR A 90 -12.517 -1.817 3.015 1.00 0.00 C ATOM 1463 C TYR A 90 -13.902 -2.247 2.530 1.00 0.00 C ATOM 1464 O TYR A 90 -14.868 -2.207 3.265 1.00 0.00 O ATOM 1465 CB TYR A 90 -12.056 -2.729 4.151 1.00 0.00 C ATOM 1466 CG TYR A 90 -12.557 -4.132 3.898 1.00 0.00 C ATOM 1467 CD1 TYR A 90 -11.784 -5.026 3.150 1.00 0.00 C ATOM 1468 CD2 TYR A 90 -13.799 -4.537 4.407 1.00 0.00 C ATOM 1469 CE1 TYR A 90 -12.247 -6.326 2.911 1.00 0.00 C ATOM 1470 CE2 TYR A 90 -14.263 -5.839 4.168 1.00 0.00 C ATOM 1471 CZ TYR A 90 -13.486 -6.733 3.420 1.00 0.00 C ATOM 1472 OH TYR A 90 -13.943 -8.013 3.187 1.00 0.00 O ATOM 0 H TYR A 90 -13.450 -0.192 4.043 1.00 0.00 H new ATOM 0 HA TYR A 90 -11.851 -1.858 2.153 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -10.968 -2.725 4.217 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -12.435 -2.361 5.105 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -10.828 -4.713 2.756 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -14.398 -3.847 4.983 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -11.648 -7.015 2.334 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -15.219 -6.152 4.561 1.00 0.00 H new ATOM 0 HH TYR A 90 -14.819 -8.130 3.611 1.00 0.00 H new ATOM 1482 N SER A 91 -14.003 -2.676 1.303 1.00 0.00 N ATOM 1483 CA SER A 91 -15.321 -3.128 0.780 1.00 0.00 C ATOM 1484 C SER A 91 -15.599 -4.550 1.272 1.00 0.00 C ATOM 1485 O SER A 91 -14.686 -5.285 1.577 1.00 0.00 O ATOM 1486 CB SER A 91 -15.178 -3.087 -0.737 1.00 0.00 C ATOM 1487 OG SER A 91 -16.362 -2.540 -1.303 1.00 0.00 O ATOM 0 H SER A 91 -13.230 -2.733 0.640 1.00 0.00 H new ATOM 0 HA SER A 91 -16.151 -2.505 1.115 1.00 0.00 H new ATOM 0 HB2 SER A 91 -14.314 -2.484 -1.017 1.00 0.00 H new ATOM 0 HB3 SER A 91 -15.005 -4.091 -1.125 1.00 0.00 H new ATOM 0 HG SER A 91 -16.141 -2.073 -2.136 1.00 0.00 H new ATOM 1493 N PRO A 92 -16.856 -4.879 1.358 1.00 0.00 N ATOM 1494 CA PRO A 92 -17.269 -6.217 1.855 1.00 0.00 C ATOM 1495 C PRO A 92 -16.901 -7.347 0.880 1.00 0.00 C ATOM 1496 O PRO A 92 -16.568 -7.121 -0.267 1.00 0.00 O ATOM 1497 CB PRO A 92 -18.779 -6.088 2.014 1.00 0.00 C ATOM 1498 CG PRO A 92 -19.174 -4.996 1.073 1.00 0.00 C ATOM 1499 CD PRO A 92 -18.009 -4.046 0.999 1.00 0.00 C ATOM 0 HA PRO A 92 -16.761 -6.485 2.782 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -19.283 -7.023 1.768 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -19.048 -5.841 3.041 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -19.407 -5.400 0.088 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -20.069 -4.484 1.428 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -17.901 -3.622 0.001 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -18.129 -3.211 1.689 1.00 0.00 H new ATOM 1507 N VAL A 93 -16.953 -8.565 1.371 1.00 0.00 N ATOM 1508 CA VAL A 93 -16.610 -9.781 0.558 1.00 0.00 C ATOM 1509 C VAL A 93 -16.949 -9.644 -0.936 1.00 0.00 C ATOM 1510 O VAL A 93 -16.090 -9.855 -1.768 1.00 0.00 O ATOM 1511 CB VAL A 93 -17.437 -10.905 1.179 1.00 0.00 C ATOM 1512 CG1 VAL A 93 -17.410 -12.126 0.258 1.00 0.00 C ATOM 1513 CG2 VAL A 93 -16.843 -11.280 2.539 1.00 0.00 C ATOM 0 H VAL A 93 -17.227 -8.773 2.331 1.00 0.00 H new ATOM 0 HA VAL A 93 -15.535 -9.958 0.584 1.00 0.00 H new ATOM 0 HB VAL A 93 -18.466 -10.571 1.310 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -18.000 -12.929 0.700 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -17.830 -11.859 -0.712 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -16.381 -12.461 0.128 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -17.432 -12.082 2.984 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -15.814 -11.615 2.407 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -16.860 -10.410 3.196 1.00 0.00 H new ATOM 1523 N PRO A 94 -18.181 -9.318 -1.250 1.00 0.00 N ATOM 1524 CA PRO A 94 -18.574 -9.193 -2.679 1.00 0.00 C ATOM 1525 C PRO A 94 -17.697 -8.163 -3.392 1.00 0.00 C ATOM 1526 O PRO A 94 -17.325 -8.343 -4.534 1.00 0.00 O ATOM 1527 CB PRO A 94 -20.047 -8.779 -2.611 1.00 0.00 C ATOM 1528 CG PRO A 94 -20.198 -8.187 -1.251 1.00 0.00 C ATOM 1529 CD PRO A 94 -19.308 -9.015 -0.361 1.00 0.00 C ATOM 0 HA PRO A 94 -18.442 -10.110 -3.254 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -20.294 -8.057 -3.389 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -20.708 -9.635 -2.749 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -19.899 -7.139 -1.242 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -21.235 -8.226 -0.917 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -18.992 -8.464 0.525 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -19.807 -9.919 -0.013 1.00 0.00 H new ATOM 1537 N GLU A 95 -17.332 -7.106 -2.726 1.00 0.00 N ATOM 1538 CA GLU A 95 -16.445 -6.105 -3.376 1.00 0.00 C ATOM 1539 C GLU A 95 -14.986 -6.516 -3.153 1.00 0.00 C ATOM 1540 O GLU A 95 -14.133 -6.311 -3.993 1.00 0.00 O ATOM 1541 CB GLU A 95 -16.755 -4.778 -2.687 1.00 0.00 C ATOM 1542 CG GLU A 95 -18.014 -4.167 -3.305 1.00 0.00 C ATOM 1543 CD GLU A 95 -17.674 -3.580 -4.676 1.00 0.00 C ATOM 1544 OE1 GLU A 95 -16.592 -3.033 -4.813 1.00 0.00 O ATOM 1545 OE2 GLU A 95 -18.501 -3.688 -5.567 1.00 0.00 O ATOM 0 H GLU A 95 -17.607 -6.892 -1.767 1.00 0.00 H new ATOM 0 HA GLU A 95 -16.604 -6.030 -4.452 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -16.901 -4.936 -1.618 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -15.914 -4.094 -2.796 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -18.789 -4.927 -3.405 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -18.412 -3.390 -2.653 1.00 0.00 H new ATOM 1552 N ASP A 96 -14.707 -7.112 -2.021 1.00 0.00 N ATOM 1553 CA ASP A 96 -13.317 -7.568 -1.717 1.00 0.00 C ATOM 1554 C ASP A 96 -12.293 -6.491 -2.078 1.00 0.00 C ATOM 1555 O ASP A 96 -11.320 -6.749 -2.758 1.00 0.00 O ATOM 1556 CB ASP A 96 -13.114 -8.813 -2.580 1.00 0.00 C ATOM 1557 CG ASP A 96 -12.457 -9.912 -1.744 1.00 0.00 C ATOM 1558 OD1 ASP A 96 -11.410 -9.653 -1.176 1.00 0.00 O ATOM 1559 OD2 ASP A 96 -13.014 -10.997 -1.685 1.00 0.00 O ATOM 0 H ASP A 96 -15.390 -7.304 -1.288 1.00 0.00 H new ATOM 0 HA ASP A 96 -13.182 -7.774 -0.655 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -14.072 -9.160 -2.968 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -12.490 -8.574 -3.441 1.00 0.00 H new ATOM 1564 N HIS A 97 -12.497 -5.289 -1.619 1.00 0.00 N ATOM 1565 CA HIS A 97 -11.527 -4.202 -1.925 1.00 0.00 C ATOM 1566 C HIS A 97 -11.025 -3.580 -0.619 1.00 0.00 C ATOM 1567 O HIS A 97 -11.785 -3.018 0.142 1.00 0.00 O ATOM 1568 CB HIS A 97 -12.316 -3.181 -2.748 1.00 0.00 C ATOM 1569 CG HIS A 97 -12.195 -3.511 -4.210 1.00 0.00 C ATOM 1570 ND1 HIS A 97 -11.010 -3.347 -4.911 1.00 0.00 N ATOM 1571 CD2 HIS A 97 -13.104 -3.993 -5.119 1.00 0.00 C ATOM 1572 CE1 HIS A 97 -11.236 -3.723 -6.183 1.00 0.00 C ATOM 1573 NE2 HIS A 97 -12.497 -4.126 -6.364 1.00 0.00 N ATOM 0 H HIS A 97 -13.293 -5.012 -1.045 1.00 0.00 H new ATOM 0 HA HIS A 97 -10.652 -4.560 -2.468 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -13.364 -3.189 -2.448 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -11.938 -2.176 -2.559 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -14.134 -4.233 -4.901 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -10.489 -3.702 -6.963 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -12.923 -4.459 -7.229 1.00 0.00 H new ATOM 1581 N ALA A 98 -9.753 -3.683 -0.353 1.00 0.00 N ATOM 1582 CA ALA A 98 -9.210 -3.103 0.909 1.00 0.00 C ATOM 1583 C ALA A 98 -8.320 -1.899 0.595 1.00 0.00 C ATOM 1584 O ALA A 98 -7.658 -1.855 -0.424 1.00 0.00 O ATOM 1585 CB ALA A 98 -8.384 -4.226 1.539 1.00 0.00 C ATOM 0 H ALA A 98 -9.067 -4.142 -0.952 1.00 0.00 H new ATOM 0 HA ALA A 98 -9.999 -2.753 1.575 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -7.949 -3.877 2.475 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -9.027 -5.084 1.735 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -7.587 -4.519 0.856 1.00 0.00 H new ATOM 1591 N TYR A 99 -8.298 -0.922 1.458 1.00 0.00 N ATOM 1592 CA TYR A 99 -7.450 0.278 1.201 1.00 0.00 C ATOM 1593 C TYR A 99 -6.406 0.438 2.308 1.00 0.00 C ATOM 1594 O TYR A 99 -6.676 0.213 3.471 1.00 0.00 O ATOM 1595 CB TYR A 99 -8.418 1.460 1.204 1.00 0.00 C ATOM 1596 CG TYR A 99 -9.147 1.518 -0.117 1.00 0.00 C ATOM 1597 CD1 TYR A 99 -8.509 2.044 -1.247 1.00 0.00 C ATOM 1598 CD2 TYR A 99 -10.462 1.047 -0.211 1.00 0.00 C ATOM 1599 CE1 TYR A 99 -9.187 2.098 -2.471 1.00 0.00 C ATOM 1600 CE2 TYR A 99 -11.140 1.102 -1.435 1.00 0.00 C ATOM 1601 CZ TYR A 99 -10.501 1.627 -2.566 1.00 0.00 C ATOM 1602 OH TYR A 99 -11.169 1.682 -3.772 1.00 0.00 O ATOM 0 H TYR A 99 -8.829 -0.901 2.329 1.00 0.00 H new ATOM 0 HA TYR A 99 -6.905 0.201 0.260 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -9.132 1.357 2.021 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -7.873 2.389 1.372 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -7.495 2.408 -1.175 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -10.954 0.641 0.661 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -8.695 2.504 -3.343 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -12.155 0.740 -1.507 1.00 0.00 H new ATOM 0 HH TYR A 99 -10.754 1.059 -4.404 1.00 0.00 H new ATOM 1612 N ILE A 100 -5.213 0.827 1.952 1.00 0.00 N ATOM 1613 CA ILE A 100 -4.145 1.006 2.978 1.00 0.00 C ATOM 1614 C ILE A 100 -3.297 2.234 2.643 1.00 0.00 C ATOM 1615 O ILE A 100 -3.355 2.761 1.550 1.00 0.00 O ATOM 1616 CB ILE A 100 -3.303 -0.267 2.897 1.00 0.00 C ATOM 1617 CG1 ILE A 100 -2.661 -0.365 1.512 1.00 0.00 C ATOM 1618 CG2 ILE A 100 -4.196 -1.486 3.131 1.00 0.00 C ATOM 1619 CD1 ILE A 100 -1.332 0.392 1.508 1.00 0.00 C ATOM 0 H ILE A 100 -4.930 1.029 0.993 1.00 0.00 H new ATOM 0 HA ILE A 100 -4.551 1.162 3.978 1.00 0.00 H new ATOM 0 HB ILE A 100 -2.524 -0.236 3.659 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -2.497 -1.410 1.249 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -3.331 0.051 0.759 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.595 -2.394 3.073 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -4.655 -1.417 4.117 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.975 -1.518 2.370 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -0.876 0.321 0.521 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -1.509 1.440 1.752 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -0.662 -0.045 2.249 1.00 0.00 H new ATOM 1631 N ARG A 101 -2.507 2.697 3.573 1.00 0.00 N ATOM 1632 CA ARG A 101 -1.658 3.893 3.299 1.00 0.00 C ATOM 1633 C ARG A 101 -0.556 4.023 4.355 1.00 0.00 C ATOM 1634 O ARG A 101 -0.650 3.477 5.437 1.00 0.00 O ATOM 1635 CB ARG A 101 -2.616 5.081 3.374 1.00 0.00 C ATOM 1636 CG ARG A 101 -3.245 5.145 4.768 1.00 0.00 C ATOM 1637 CD ARG A 101 -3.110 6.564 5.324 1.00 0.00 C ATOM 1638 NE ARG A 101 -3.753 6.515 6.666 1.00 0.00 N ATOM 1639 CZ ARG A 101 -3.466 7.420 7.561 1.00 0.00 C ATOM 1640 NH1 ARG A 101 -2.222 7.747 7.783 1.00 0.00 N ATOM 1641 NH2 ARG A 101 -4.423 8.000 8.232 1.00 0.00 N ATOM 0 H ARG A 101 -2.412 2.301 4.508 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.158 3.829 2.332 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -2.081 6.007 3.162 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -3.394 4.982 2.617 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -4.296 4.861 4.718 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -2.754 4.434 5.433 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -2.064 6.861 5.398 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -3.602 7.290 4.677 1.00 0.00 H new ATOM 0 HE ARG A 101 -4.418 5.774 6.886 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -1.474 7.295 7.257 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -1.998 8.455 8.483 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -5.395 7.746 8.057 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -4.199 8.707 8.932 1.00 0.00 H new ATOM 1655 N PHE A 102 0.486 4.747 4.049 1.00 0.00 N ATOM 1656 CA PHE A 102 1.595 4.920 5.031 1.00 0.00 C ATOM 1657 C PHE A 102 2.248 6.295 4.853 1.00 0.00 C ATOM 1658 O PHE A 102 2.101 6.924 3.824 1.00 0.00 O ATOM 1659 CB PHE A 102 2.592 3.807 4.710 1.00 0.00 C ATOM 1660 CG PHE A 102 2.604 3.552 3.222 1.00 0.00 C ATOM 1661 CD1 PHE A 102 1.691 2.654 2.658 1.00 0.00 C ATOM 1662 CD2 PHE A 102 3.528 4.216 2.406 1.00 0.00 C ATOM 1663 CE1 PHE A 102 1.703 2.418 1.277 1.00 0.00 C ATOM 1664 CE2 PHE A 102 3.540 3.981 1.027 1.00 0.00 C ATOM 1665 CZ PHE A 102 2.627 3.083 0.462 1.00 0.00 C ATOM 0 H PHE A 102 0.618 5.228 3.159 1.00 0.00 H new ATOM 0 HA PHE A 102 1.245 4.865 6.062 1.00 0.00 H new ATOM 0 HB2 PHE A 102 3.589 4.089 5.049 1.00 0.00 H new ATOM 0 HB3 PHE A 102 2.320 2.896 5.243 1.00 0.00 H new ATOM 0 HD1 PHE A 102 0.977 2.143 3.287 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.232 4.910 2.841 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.000 1.724 0.841 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.254 4.493 0.398 1.00 0.00 H new ATOM 0 HZ PHE A 102 2.635 2.903 -0.603 1.00 0.00 H new ATOM 1675 N PRO A 103 2.945 6.716 5.871 1.00 0.00 N ATOM 1676 CA PRO A 103 3.627 8.033 5.839 1.00 0.00 C ATOM 1677 C PRO A 103 4.880 7.975 4.958 1.00 0.00 C ATOM 1678 O PRO A 103 5.441 6.924 4.723 1.00 0.00 O ATOM 1679 CB PRO A 103 4.005 8.276 7.297 1.00 0.00 C ATOM 1680 CG PRO A 103 4.092 6.914 7.911 1.00 0.00 C ATOM 1681 CD PRO A 103 3.161 6.012 7.139 1.00 0.00 C ATOM 0 HA PRO A 103 3.002 8.824 5.424 1.00 0.00 H new ATOM 0 HB2 PRO A 103 4.955 8.805 7.375 1.00 0.00 H new ATOM 0 HB3 PRO A 103 3.257 8.888 7.801 1.00 0.00 H new ATOM 0 HG2 PRO A 103 5.114 6.538 7.868 1.00 0.00 H new ATOM 0 HG3 PRO A 103 3.809 6.948 8.963 1.00 0.00 H new ATOM 0 HD2 PRO A 103 3.602 5.028 6.978 1.00 0.00 H new ATOM 0 HD3 PRO A 103 2.223 5.857 7.673 1.00 0.00 H new ATOM 1689 N VAL A 104 5.324 9.105 4.477 1.00 0.00 N ATOM 1690 CA VAL A 104 6.543 9.130 3.617 1.00 0.00 C ATOM 1691 C VAL A 104 7.395 10.353 3.964 1.00 0.00 C ATOM 1692 O VAL A 104 7.129 11.454 3.525 1.00 0.00 O ATOM 1693 CB VAL A 104 6.021 9.234 2.188 1.00 0.00 C ATOM 1694 CG1 VAL A 104 5.276 7.949 1.820 1.00 0.00 C ATOM 1695 CG2 VAL A 104 5.067 10.425 2.085 1.00 0.00 C ATOM 0 H VAL A 104 4.894 10.015 4.643 1.00 0.00 H new ATOM 0 HA VAL A 104 7.168 8.248 3.756 1.00 0.00 H new ATOM 0 HB VAL A 104 6.857 9.375 1.503 1.00 0.00 H new ATOM 0 HG11 VAL A 104 4.903 8.024 0.798 1.00 0.00 H new ATOM 0 HG12 VAL A 104 5.955 7.100 1.897 1.00 0.00 H new ATOM 0 HG13 VAL A 104 4.438 7.806 2.502 1.00 0.00 H new ATOM 0 HG21 VAL A 104 4.691 10.503 1.065 1.00 0.00 H new ATOM 0 HG22 VAL A 104 4.231 10.282 2.770 1.00 0.00 H new ATOM 0 HG23 VAL A 104 5.598 11.340 2.347 1.00 0.00 H new ATOM 1705 N SER A 105 8.411 10.171 4.758 1.00 0.00 N ATOM 1706 CA SER A 105 9.270 11.325 5.144 1.00 0.00 C ATOM 1707 C SER A 105 10.475 11.451 4.210 1.00 0.00 C ATOM 1708 O SER A 105 10.991 10.474 3.704 1.00 0.00 O ATOM 1709 CB SER A 105 9.730 11.013 6.568 1.00 0.00 C ATOM 1710 OG SER A 105 10.223 12.201 7.173 1.00 0.00 O ATOM 0 H SER A 105 8.685 9.273 5.157 1.00 0.00 H new ATOM 0 HA SER A 105 8.730 12.270 5.079 1.00 0.00 H new ATOM 0 HB2 SER A 105 8.901 10.612 7.151 1.00 0.00 H new ATOM 0 HB3 SER A 105 10.508 10.249 6.552 1.00 0.00 H new ATOM 0 HG SER A 105 10.517 12.005 8.087 1.00 0.00 H new ATOM 1716 N ASP A 106 10.931 12.656 3.995 1.00 0.00 N ATOM 1717 CA ASP A 106 12.116 12.882 3.113 1.00 0.00 C ATOM 1718 C ASP A 106 11.799 12.545 1.651 1.00 0.00 C ATOM 1719 O ASP A 106 12.677 12.193 0.889 1.00 0.00 O ATOM 1720 CB ASP A 106 13.201 11.949 3.654 1.00 0.00 C ATOM 1721 CG ASP A 106 14.578 12.552 3.369 1.00 0.00 C ATOM 1722 OD1 ASP A 106 14.632 13.557 2.681 1.00 0.00 O ATOM 1723 OD2 ASP A 106 15.555 11.997 3.845 1.00 0.00 O ATOM 0 H ASP A 106 10.529 13.503 4.397 1.00 0.00 H new ATOM 0 HA ASP A 106 12.425 13.927 3.123 1.00 0.00 H new ATOM 0 HB2 ASP A 106 13.070 11.804 4.726 1.00 0.00 H new ATOM 0 HB3 ASP A 106 13.118 10.967 3.187 1.00 0.00 H new ATOM 1728 N GLY A 107 10.565 12.661 1.245 1.00 0.00 N ATOM 1729 CA GLY A 107 10.228 12.357 -0.176 1.00 0.00 C ATOM 1730 C GLY A 107 10.417 10.865 -0.451 1.00 0.00 C ATOM 1731 O GLY A 107 10.728 10.470 -1.557 1.00 0.00 O ATOM 0 H GLY A 107 9.781 12.951 1.829 1.00 0.00 H new ATOM 0 HA2 GLY A 107 9.198 12.646 -0.384 1.00 0.00 H new ATOM 0 HA3 GLY A 107 10.863 12.941 -0.842 1.00 0.00 H new ATOM 1735 N THR A 108 10.246 10.042 0.554 1.00 0.00 N ATOM 1736 CA THR A 108 10.421 8.564 0.378 1.00 0.00 C ATOM 1737 C THR A 108 9.857 8.092 -0.966 1.00 0.00 C ATOM 1738 O THR A 108 8.715 8.343 -1.295 1.00 0.00 O ATOM 1739 CB THR A 108 9.629 7.938 1.522 1.00 0.00 C ATOM 1740 OG1 THR A 108 10.221 8.302 2.761 1.00 0.00 O ATOM 1741 CG2 THR A 108 9.636 6.417 1.375 1.00 0.00 C ATOM 0 H THR A 108 9.990 10.332 1.498 1.00 0.00 H new ATOM 0 HA THR A 108 11.474 8.283 0.389 1.00 0.00 H new ATOM 0 HB THR A 108 8.600 8.298 1.493 1.00 0.00 H new ATOM 0 HG1 THR A 108 9.953 9.215 2.996 1.00 0.00 H new ATOM 0 HG21 THR A 108 9.070 5.970 2.192 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.180 6.141 0.424 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.663 6.053 1.403 1.00 0.00 H new ATOM 1749 N GLN A 109 10.653 7.409 -1.742 1.00 0.00 N ATOM 1750 CA GLN A 109 10.167 6.918 -3.062 1.00 0.00 C ATOM 1751 C GLN A 109 10.419 5.410 -3.206 1.00 0.00 C ATOM 1752 O GLN A 109 10.051 4.806 -4.194 1.00 0.00 O ATOM 1753 CB GLN A 109 10.984 7.696 -4.094 1.00 0.00 C ATOM 1754 CG GLN A 109 10.348 7.537 -5.476 1.00 0.00 C ATOM 1755 CD GLN A 109 11.356 7.941 -6.553 1.00 0.00 C ATOM 1756 OE1 GLN A 109 11.874 7.101 -7.263 1.00 0.00 O ATOM 1757 NE2 GLN A 109 11.659 9.201 -6.707 1.00 0.00 N ATOM 0 H GLN A 109 11.619 7.170 -1.519 1.00 0.00 H new ATOM 0 HA GLN A 109 9.094 7.068 -3.185 1.00 0.00 H new ATOM 0 HB2 GLN A 109 11.025 8.750 -3.820 1.00 0.00 H new ATOM 0 HB3 GLN A 109 12.011 7.331 -4.111 1.00 0.00 H new ATOM 0 HG2 GLN A 109 10.034 6.504 -5.626 1.00 0.00 H new ATOM 0 HG3 GLN A 109 9.454 8.156 -5.550 1.00 0.00 H new ATOM 0 HE21 GLN A 109 11.225 9.906 -6.112 1.00 0.00 H new ATOM 0 HE22 GLN A 109 12.330 9.480 -7.423 1.00 0.00 H new ATOM 1766 N GLU A 110 11.042 4.795 -2.234 1.00 0.00 N ATOM 1767 CA GLU A 110 11.310 3.332 -2.330 1.00 0.00 C ATOM 1768 C GLU A 110 11.051 2.660 -0.978 1.00 0.00 C ATOM 1769 O GLU A 110 11.638 3.017 0.025 1.00 0.00 O ATOM 1770 CB GLU A 110 12.789 3.227 -2.707 1.00 0.00 C ATOM 1771 CG GLU A 110 13.429 4.616 -2.652 1.00 0.00 C ATOM 1772 CD GLU A 110 14.934 4.497 -2.901 1.00 0.00 C ATOM 1773 OE1 GLU A 110 15.422 3.379 -2.940 1.00 0.00 O ATOM 1774 OE2 GLU A 110 15.573 5.526 -3.049 1.00 0.00 O ATOM 0 H GLU A 110 11.375 5.243 -1.380 1.00 0.00 H new ATOM 0 HA GLU A 110 10.667 2.839 -3.059 1.00 0.00 H new ATOM 0 HB2 GLU A 110 13.302 2.551 -2.023 1.00 0.00 H new ATOM 0 HB3 GLU A 110 12.891 2.807 -3.708 1.00 0.00 H new ATOM 0 HG2 GLU A 110 12.976 5.266 -3.401 1.00 0.00 H new ATOM 0 HG3 GLU A 110 13.246 5.074 -1.680 1.00 0.00 H new ATOM 1781 N LEU A 111 10.183 1.685 -0.945 1.00 0.00 N ATOM 1782 CA LEU A 111 9.895 0.988 0.343 1.00 0.00 C ATOM 1783 C LEU A 111 9.871 -0.527 0.127 1.00 0.00 C ATOM 1784 O LEU A 111 9.326 -1.016 -0.843 1.00 0.00 O ATOM 1785 CB LEU A 111 8.513 1.480 0.809 1.00 0.00 C ATOM 1786 CG LEU A 111 7.815 2.286 -0.293 1.00 0.00 C ATOM 1787 CD1 LEU A 111 6.320 2.373 0.019 1.00 0.00 C ATOM 1788 CD2 LEU A 111 8.400 3.700 -0.341 1.00 0.00 C ATOM 0 H LEU A 111 9.662 1.341 -1.752 1.00 0.00 H new ATOM 0 HA LEU A 111 10.661 1.204 1.088 1.00 0.00 H new ATOM 0 HB2 LEU A 111 7.894 0.627 1.087 1.00 0.00 H new ATOM 0 HB3 LEU A 111 8.625 2.097 1.700 1.00 0.00 H new ATOM 0 HG LEU A 111 7.966 1.795 -1.255 1.00 0.00 H new ATOM 0 HD11 LEU A 111 5.818 2.945 -0.761 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.898 1.369 0.061 1.00 0.00 H new ATOM 0 HD13 LEU A 111 6.177 2.867 0.980 1.00 0.00 H new ATOM 0 HD21 LEU A 111 7.904 4.273 -1.124 1.00 0.00 H new ATOM 0 HD22 LEU A 111 8.246 4.190 0.620 1.00 0.00 H new ATOM 0 HD23 LEU A 111 9.468 3.645 -0.553 1.00 0.00 H new ATOM 1800 N LYS A 112 10.457 -1.274 1.023 1.00 0.00 N ATOM 1801 CA LYS A 112 10.465 -2.757 0.866 1.00 0.00 C ATOM 1802 C LYS A 112 9.138 -3.346 1.351 1.00 0.00 C ATOM 1803 O LYS A 112 8.910 -3.493 2.536 1.00 0.00 O ATOM 1804 CB LYS A 112 11.621 -3.243 1.740 1.00 0.00 C ATOM 1805 CG LYS A 112 12.932 -3.150 0.954 1.00 0.00 C ATOM 1806 CD LYS A 112 13.699 -1.898 1.385 1.00 0.00 C ATOM 1807 CE LYS A 112 14.161 -1.127 0.148 1.00 0.00 C ATOM 1808 NZ LYS A 112 15.204 -0.189 0.649 1.00 0.00 N ATOM 0 H LYS A 112 10.930 -0.922 1.856 1.00 0.00 H new ATOM 0 HA LYS A 112 10.586 -3.062 -0.173 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.684 -2.640 2.646 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.445 -4.272 2.054 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.538 -4.039 1.130 1.00 0.00 H new ATOM 0 HG3 LYS A 112 12.725 -3.112 -0.116 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.063 -1.265 2.004 1.00 0.00 H new ATOM 0 HD3 LYS A 112 14.559 -2.178 1.994 1.00 0.00 H new ATOM 0 HE2 LYS A 112 14.565 -1.800 -0.609 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.334 -0.588 -0.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 15.571 0.377 -0.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 14.789 0.443 1.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 15.982 -0.731 1.077 1.00 0.00 H new ATOM 1822 N ILE A 113 8.262 -3.682 0.446 1.00 0.00 N ATOM 1823 CA ILE A 113 6.948 -4.258 0.854 1.00 0.00 C ATOM 1824 C ILE A 113 7.130 -5.687 1.375 1.00 0.00 C ATOM 1825 O ILE A 113 7.706 -6.529 0.717 1.00 0.00 O ATOM 1826 CB ILE A 113 6.106 -4.258 -0.420 1.00 0.00 C ATOM 1827 CG1 ILE A 113 5.148 -3.065 -0.398 1.00 0.00 C ATOM 1828 CG2 ILE A 113 5.299 -5.556 -0.499 1.00 0.00 C ATOM 1829 CD1 ILE A 113 5.419 -2.172 -1.609 1.00 0.00 C ATOM 0 H ILE A 113 8.398 -3.583 -0.560 1.00 0.00 H new ATOM 0 HA ILE A 113 6.480 -3.687 1.656 1.00 0.00 H new ATOM 0 HB ILE A 113 6.761 -4.183 -1.288 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.115 -3.414 -0.414 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.279 -2.497 0.523 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.698 -5.556 -1.408 1.00 0.00 H new ATOM 0 HG22 ILE A 113 5.980 -6.407 -0.514 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.644 -5.630 0.369 1.00 0.00 H new ATOM 0 HD11 ILE A 113 4.737 -1.322 -1.594 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.447 -1.813 -1.573 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.266 -2.744 -2.524 1.00 0.00 H new ATOM 1841 N VAL A 114 6.635 -5.968 2.550 1.00 0.00 N ATOM 1842 CA VAL A 114 6.774 -7.344 3.108 1.00 0.00 C ATOM 1843 C VAL A 114 5.393 -7.924 3.418 1.00 0.00 C ATOM 1844 O VAL A 114 4.691 -7.440 4.281 1.00 0.00 O ATOM 1845 CB VAL A 114 7.578 -7.171 4.395 1.00 0.00 C ATOM 1846 CG1 VAL A 114 8.427 -8.419 4.641 1.00 0.00 C ATOM 1847 CG2 VAL A 114 8.490 -5.950 4.265 1.00 0.00 C ATOM 0 H VAL A 114 6.141 -5.305 3.147 1.00 0.00 H new ATOM 0 HA VAL A 114 7.262 -8.026 2.411 1.00 0.00 H new ATOM 0 HB VAL A 114 6.895 -7.028 5.233 1.00 0.00 H new ATOM 0 HG11 VAL A 114 9.000 -8.294 5.560 1.00 0.00 H new ATOM 0 HG12 VAL A 114 7.777 -9.289 4.735 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.110 -8.565 3.804 1.00 0.00 H new ATOM 0 HG21 VAL A 114 9.064 -5.825 5.183 1.00 0.00 H new ATOM 0 HG22 VAL A 114 9.172 -6.093 3.427 1.00 0.00 H new ATOM 0 HG23 VAL A 114 7.884 -5.060 4.092 1.00 0.00 H new ATOM 1857 N SER A 115 4.997 -8.956 2.724 1.00 0.00 N ATOM 1858 CA SER A 115 3.657 -9.554 2.989 1.00 0.00 C ATOM 1859 C SER A 115 3.579 -10.972 2.416 1.00 0.00 C ATOM 1860 O SER A 115 4.434 -11.399 1.666 1.00 0.00 O ATOM 1861 CB SER A 115 2.670 -8.635 2.271 1.00 0.00 C ATOM 1862 OG SER A 115 3.208 -8.263 1.009 1.00 0.00 O ATOM 0 H SER A 115 5.540 -9.409 1.989 1.00 0.00 H new ATOM 0 HA SER A 115 3.446 -9.634 4.055 1.00 0.00 H new ATOM 0 HB2 SER A 115 1.715 -9.142 2.137 1.00 0.00 H new ATOM 0 HB3 SER A 115 2.478 -7.747 2.873 1.00 0.00 H new ATOM 0 HG SER A 115 2.584 -7.662 0.552 1.00 0.00 H new ATOM 1868 N SER A 116 2.556 -11.704 2.766 1.00 0.00 N ATOM 1869 CA SER A 116 2.415 -13.093 2.244 1.00 0.00 C ATOM 1870 C SER A 116 0.965 -13.353 1.827 1.00 0.00 C ATOM 1871 O SER A 116 0.050 -13.221 2.615 1.00 0.00 O ATOM 1872 CB SER A 116 2.807 -13.996 3.413 1.00 0.00 C ATOM 1873 OG SER A 116 2.764 -15.354 2.993 1.00 0.00 O ATOM 0 H SER A 116 1.811 -11.399 3.392 1.00 0.00 H new ATOM 0 HA SER A 116 3.036 -13.271 1.366 1.00 0.00 H new ATOM 0 HB2 SER A 116 3.808 -13.743 3.763 1.00 0.00 H new ATOM 0 HB3 SER A 116 2.128 -13.841 4.251 1.00 0.00 H new ATOM 0 HG SER A 116 3.041 -15.934 3.733 1.00 0.00 H new ATOM 1879 N THR A 117 0.746 -13.717 0.593 1.00 0.00 N ATOM 1880 CA THR A 117 -0.648 -13.980 0.131 1.00 0.00 C ATOM 1881 C THR A 117 -0.794 -15.436 -0.321 1.00 0.00 C ATOM 1882 O THR A 117 0.114 -16.016 -0.883 1.00 0.00 O ATOM 1883 CB THR A 117 -0.859 -13.027 -1.047 1.00 0.00 C ATOM 1884 OG1 THR A 117 -0.519 -13.689 -2.257 1.00 0.00 O ATOM 1885 CG2 THR A 117 0.024 -11.792 -0.871 1.00 0.00 C ATOM 0 H THR A 117 1.470 -13.844 -0.114 1.00 0.00 H new ATOM 0 HA THR A 117 -1.382 -13.822 0.921 1.00 0.00 H new ATOM 0 HB THR A 117 -1.904 -12.720 -1.084 1.00 0.00 H new ATOM 0 HG1 THR A 117 -0.655 -13.080 -3.013 1.00 0.00 H new ATOM 0 HG21 THR A 117 -0.127 -11.114 -1.711 1.00 0.00 H new ATOM 0 HG22 THR A 117 -0.240 -11.285 0.057 1.00 0.00 H new ATOM 0 HG23 THR A 117 1.070 -12.095 -0.833 1.00 0.00 H new ATOM 1893 N GLN A 118 -1.930 -16.030 -0.079 1.00 0.00 N ATOM 1894 CA GLN A 118 -2.136 -17.448 -0.494 1.00 0.00 C ATOM 1895 C GLN A 118 -3.492 -17.603 -1.189 1.00 0.00 C ATOM 1896 O GLN A 118 -4.526 -17.304 -0.625 1.00 0.00 O ATOM 1897 CB GLN A 118 -2.106 -18.251 0.807 1.00 0.00 C ATOM 1898 CG GLN A 118 -2.749 -17.432 1.928 1.00 0.00 C ATOM 1899 CD GLN A 118 -3.206 -18.370 3.048 1.00 0.00 C ATOM 1900 OE1 GLN A 118 -4.333 -18.296 3.497 1.00 0.00 O ATOM 1901 NE2 GLN A 118 -2.373 -19.256 3.521 1.00 0.00 N ATOM 0 H GLN A 118 -2.726 -15.595 0.388 1.00 0.00 H new ATOM 0 HA GLN A 118 -1.376 -17.786 -1.199 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -2.640 -19.192 0.678 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -1.078 -18.501 1.069 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.036 -16.705 2.316 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -3.599 -16.870 1.541 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -1.427 -19.319 3.145 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -2.668 -19.886 4.267 1.00 0.00 H new ATOM 1910 N ILE A 119 -3.496 -18.067 -2.409 1.00 0.00 N ATOM 1911 CA ILE A 119 -4.788 -18.239 -3.135 1.00 0.00 C ATOM 1912 C ILE A 119 -5.076 -19.725 -3.369 1.00 0.00 C ATOM 1913 O ILE A 119 -5.879 -20.086 -4.205 1.00 0.00 O ATOM 1914 CB ILE A 119 -4.590 -17.516 -4.467 1.00 0.00 C ATOM 1915 CG1 ILE A 119 -4.023 -16.118 -4.209 1.00 0.00 C ATOM 1916 CG2 ILE A 119 -5.936 -17.395 -5.186 1.00 0.00 C ATOM 1917 CD1 ILE A 119 -2.554 -16.078 -4.636 1.00 0.00 C ATOM 0 H ILE A 119 -2.663 -18.334 -2.934 1.00 0.00 H new ATOM 0 HA ILE A 119 -5.632 -17.840 -2.573 1.00 0.00 H new ATOM 0 HB ILE A 119 -3.895 -18.081 -5.088 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -4.595 -15.374 -4.764 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -4.113 -15.867 -3.152 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -5.796 -16.879 -6.136 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.341 -18.390 -5.369 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -6.631 -16.829 -4.565 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -2.149 -15.083 -4.453 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -1.988 -16.812 -4.062 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -2.477 -16.311 -5.698 1.00 0.00 H new ATOM 1929 N ASP A 120 -4.429 -20.591 -2.635 1.00 0.00 N ATOM 1930 CA ASP A 120 -4.671 -22.051 -2.818 1.00 0.00 C ATOM 1931 C ASP A 120 -4.510 -22.440 -4.291 1.00 0.00 C ATOM 1932 O ASP A 120 -5.143 -23.359 -4.773 1.00 0.00 O ATOM 1933 CB ASP A 120 -6.113 -22.274 -2.360 1.00 0.00 C ATOM 1934 CG ASP A 120 -6.116 -23.028 -1.029 1.00 0.00 C ATOM 1935 OD1 ASP A 120 -5.450 -22.575 -0.112 1.00 0.00 O ATOM 1936 OD2 ASP A 120 -6.782 -24.046 -0.949 1.00 0.00 O ATOM 0 H ASP A 120 -3.745 -20.351 -1.918 1.00 0.00 H new ATOM 0 HA ASP A 120 -3.963 -22.658 -2.253 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -6.622 -21.317 -2.249 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -6.661 -22.841 -3.112 1.00 0.00 H new ATOM 1941 N ASP A 121 -3.668 -21.749 -5.010 1.00 0.00 N ATOM 1942 CA ASP A 121 -3.469 -22.084 -6.450 1.00 0.00 C ATOM 1943 C ASP A 121 -2.298 -23.056 -6.606 1.00 0.00 C ATOM 1944 O ASP A 121 -2.299 -23.913 -7.466 1.00 0.00 O ATOM 1945 CB ASP A 121 -3.153 -20.749 -7.127 1.00 0.00 C ATOM 1946 CG ASP A 121 -4.452 -19.977 -7.360 1.00 0.00 C ATOM 1947 OD1 ASP A 121 -5.471 -20.398 -6.836 1.00 0.00 O ATOM 1948 OD2 ASP A 121 -4.408 -18.979 -8.060 1.00 0.00 O ATOM 0 H ASP A 121 -3.110 -20.968 -4.664 1.00 0.00 H new ATOM 0 HA ASP A 121 -4.343 -22.565 -6.889 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -2.476 -20.164 -6.504 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -2.644 -20.921 -8.076 1.00 0.00 H new ATOM 1953 N GLY A 122 -1.297 -22.928 -5.777 1.00 0.00 N ATOM 1954 CA GLY A 122 -0.126 -23.843 -5.871 1.00 0.00 C ATOM 1955 C GLY A 122 0.694 -23.746 -4.584 1.00 0.00 C ATOM 1956 O GLY A 122 0.537 -24.536 -3.675 1.00 0.00 O ATOM 0 H GLY A 122 -1.241 -22.227 -5.038 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -0.462 -24.868 -6.025 1.00 0.00 H new ATOM 0 HA3 GLY A 122 0.490 -23.577 -6.730 1.00 0.00 H new ATOM 1960 N GLU A 123 1.567 -22.780 -4.497 1.00 0.00 N ATOM 1961 CA GLU A 123 2.393 -22.630 -3.264 1.00 0.00 C ATOM 1962 C GLU A 123 2.198 -21.234 -2.669 1.00 0.00 C ATOM 1963 O GLU A 123 1.946 -20.277 -3.374 1.00 0.00 O ATOM 1964 CB GLU A 123 3.838 -22.820 -3.726 1.00 0.00 C ATOM 1965 CG GLU A 123 4.766 -22.835 -2.510 1.00 0.00 C ATOM 1966 CD GLU A 123 5.813 -23.939 -2.676 1.00 0.00 C ATOM 1967 OE1 GLU A 123 6.144 -24.248 -3.809 1.00 0.00 O ATOM 1968 OE2 GLU A 123 6.263 -24.457 -1.667 1.00 0.00 O ATOM 0 H GLU A 123 1.744 -22.088 -5.225 1.00 0.00 H new ATOM 0 HA GLU A 123 2.117 -23.348 -2.491 1.00 0.00 H new ATOM 0 HB2 GLU A 123 3.934 -23.753 -4.281 1.00 0.00 H new ATOM 0 HB3 GLU A 123 4.123 -22.015 -4.404 1.00 0.00 H new ATOM 0 HG2 GLU A 123 5.257 -21.868 -2.403 1.00 0.00 H new ATOM 0 HG3 GLU A 123 4.188 -23.002 -1.601 1.00 0.00 H new ATOM 1975 N GLU A 124 2.309 -21.109 -1.374 1.00 0.00 N ATOM 1976 CA GLU A 124 2.126 -19.774 -0.735 1.00 0.00 C ATOM 1977 C GLU A 124 3.159 -18.781 -1.275 1.00 0.00 C ATOM 1978 O GLU A 124 4.342 -19.057 -1.310 1.00 0.00 O ATOM 1979 CB GLU A 124 2.344 -20.017 0.758 1.00 0.00 C ATOM 1980 CG GLU A 124 2.048 -18.732 1.534 1.00 0.00 C ATOM 1981 CD GLU A 124 3.261 -18.360 2.389 1.00 0.00 C ATOM 1982 OE1 GLU A 124 4.262 -17.960 1.819 1.00 0.00 O ATOM 1983 OE2 GLU A 124 3.167 -18.483 3.599 1.00 0.00 O ATOM 0 H GLU A 124 2.518 -21.873 -0.731 1.00 0.00 H new ATOM 0 HA GLU A 124 1.143 -19.350 -0.940 1.00 0.00 H new ATOM 0 HB2 GLU A 124 1.695 -20.821 1.105 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.371 -20.335 0.939 1.00 0.00 H new ATOM 0 HG2 GLU A 124 1.816 -17.922 0.842 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.172 -18.871 2.168 1.00 0.00 H new ATOM 1990 N THR A 125 2.722 -17.625 -1.696 1.00 0.00 N ATOM 1991 CA THR A 125 3.680 -16.614 -2.231 1.00 0.00 C ATOM 1992 C THR A 125 4.183 -15.715 -1.099 1.00 0.00 C ATOM 1993 O THR A 125 3.423 -14.999 -0.476 1.00 0.00 O ATOM 1994 CB THR A 125 2.874 -15.801 -3.245 1.00 0.00 C ATOM 1995 OG1 THR A 125 2.118 -16.682 -4.063 1.00 0.00 O ATOM 1996 CG2 THR A 125 3.827 -14.982 -4.119 1.00 0.00 C ATOM 0 H THR A 125 1.744 -17.337 -1.693 1.00 0.00 H new ATOM 0 HA THR A 125 4.557 -17.075 -2.685 1.00 0.00 H new ATOM 0 HB THR A 125 2.200 -15.127 -2.716 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.600 -16.162 -4.712 1.00 0.00 H new ATOM 0 HG21 THR A 125 3.251 -14.403 -4.841 1.00 0.00 H new ATOM 0 HG22 THR A 125 4.406 -14.305 -3.491 1.00 0.00 H new ATOM 0 HG23 THR A 125 4.503 -15.654 -4.648 1.00 0.00 H new ATOM 2004 N ASN A 126 5.459 -15.747 -0.824 1.00 0.00 N ATOM 2005 CA ASN A 126 6.008 -14.896 0.270 1.00 0.00 C ATOM 2006 C ASN A 126 6.868 -13.770 -0.311 1.00 0.00 C ATOM 2007 O ASN A 126 7.791 -14.008 -1.064 1.00 0.00 O ATOM 2008 CB ASN A 126 6.861 -15.840 1.116 1.00 0.00 C ATOM 2009 CG ASN A 126 7.178 -15.179 2.458 1.00 0.00 C ATOM 2010 OD1 ASN A 126 7.715 -14.089 2.500 1.00 0.00 O ATOM 2011 ND2 ASN A 126 6.869 -15.795 3.566 1.00 0.00 N ATOM 0 H ASN A 126 6.145 -16.325 -1.310 1.00 0.00 H new ATOM 0 HA ASN A 126 5.221 -14.421 0.856 1.00 0.00 H new ATOM 0 HB2 ASN A 126 6.332 -16.779 1.277 1.00 0.00 H new ATOM 0 HB3 ASN A 126 7.785 -16.081 0.590 1.00 0.00 H new ATOM 0 HD21 ASN A 126 7.078 -15.362 4.466 1.00 0.00 H new ATOM 0 HD22 ASN A 126 6.418 -16.709 3.533 1.00 0.00 H new ATOM 2018 N TYR A 127 6.574 -12.548 0.036 1.00 0.00 N ATOM 2019 CA TYR A 127 7.378 -11.409 -0.493 1.00 0.00 C ATOM 2020 C TYR A 127 8.428 -10.984 0.536 1.00 0.00 C ATOM 2021 O TYR A 127 8.335 -9.930 1.135 1.00 0.00 O ATOM 2022 CB TYR A 127 6.367 -10.288 -0.731 1.00 0.00 C ATOM 2023 CG TYR A 127 5.532 -10.615 -1.945 1.00 0.00 C ATOM 2024 CD1 TYR A 127 6.074 -10.463 -3.228 1.00 0.00 C ATOM 2025 CD2 TYR A 127 4.218 -11.073 -1.791 1.00 0.00 C ATOM 2026 CE1 TYR A 127 5.302 -10.770 -4.355 1.00 0.00 C ATOM 2027 CE2 TYR A 127 3.446 -11.380 -2.918 1.00 0.00 C ATOM 2028 CZ TYR A 127 3.988 -11.228 -4.200 1.00 0.00 C ATOM 2029 OH TYR A 127 3.229 -11.531 -5.311 1.00 0.00 O ATOM 0 H TYR A 127 5.812 -12.288 0.663 1.00 0.00 H new ATOM 0 HA TYR A 127 7.916 -11.668 -1.405 1.00 0.00 H new ATOM 0 HB2 TYR A 127 5.727 -10.169 0.143 1.00 0.00 H new ATOM 0 HB3 TYR A 127 6.886 -9.341 -0.877 1.00 0.00 H new ATOM 0 HD1 TYR A 127 7.087 -10.109 -3.348 1.00 0.00 H new ATOM 0 HD2 TYR A 127 3.800 -11.190 -0.802 1.00 0.00 H new ATOM 0 HE1 TYR A 127 5.720 -10.654 -5.344 1.00 0.00 H new ATOM 0 HE2 TYR A 127 2.433 -11.734 -2.798 1.00 0.00 H new ATOM 0 HH TYR A 127 2.342 -11.836 -5.028 1.00 0.00 H new ATOM 2039 N ASP A 128 9.424 -11.799 0.748 1.00 0.00 N ATOM 2040 CA ASP A 128 10.479 -11.448 1.740 1.00 0.00 C ATOM 2041 C ASP A 128 11.054 -10.060 1.444 1.00 0.00 C ATOM 2042 O ASP A 128 11.539 -9.380 2.326 1.00 0.00 O ATOM 2043 CB ASP A 128 11.555 -12.522 1.568 1.00 0.00 C ATOM 2044 CG ASP A 128 12.933 -11.861 1.521 1.00 0.00 C ATOM 2045 OD1 ASP A 128 13.281 -11.334 0.478 1.00 0.00 O ATOM 2046 OD2 ASP A 128 13.620 -11.895 2.530 1.00 0.00 O ATOM 0 H ASP A 128 9.553 -12.694 0.276 1.00 0.00 H new ATOM 0 HA ASP A 128 10.091 -11.415 2.758 1.00 0.00 H new ATOM 0 HB2 ASP A 128 11.509 -13.233 2.393 1.00 0.00 H new ATOM 0 HB3 ASP A 128 11.379 -13.085 0.651 1.00 0.00 H new ATOM 2051 N TYR A 129 11.004 -9.633 0.213 1.00 0.00 N ATOM 2052 CA TYR A 129 11.550 -8.287 -0.129 1.00 0.00 C ATOM 2053 C TYR A 129 10.990 -7.804 -1.470 1.00 0.00 C ATOM 2054 O TYR A 129 11.362 -8.288 -2.521 1.00 0.00 O ATOM 2055 CB TYR A 129 13.063 -8.487 -0.221 1.00 0.00 C ATOM 2056 CG TYR A 129 13.685 -7.303 -0.923 1.00 0.00 C ATOM 2057 CD1 TYR A 129 14.025 -6.157 -0.193 1.00 0.00 C ATOM 2058 CD2 TYR A 129 13.920 -7.352 -2.302 1.00 0.00 C ATOM 2059 CE1 TYR A 129 14.601 -5.059 -0.844 1.00 0.00 C ATOM 2060 CE2 TYR A 129 14.496 -6.254 -2.952 1.00 0.00 C ATOM 2061 CZ TYR A 129 14.836 -5.108 -2.224 1.00 0.00 C ATOM 2062 OH TYR A 129 15.404 -4.024 -2.865 1.00 0.00 O ATOM 0 H TYR A 129 10.610 -10.155 -0.570 1.00 0.00 H new ATOM 0 HA TYR A 129 11.279 -7.535 0.612 1.00 0.00 H new ATOM 0 HB2 TYR A 129 13.488 -8.596 0.777 1.00 0.00 H new ATOM 0 HB3 TYR A 129 13.287 -9.405 -0.765 1.00 0.00 H new ATOM 0 HD1 TYR A 129 13.843 -6.120 0.871 1.00 0.00 H new ATOM 0 HD2 TYR A 129 13.657 -8.236 -2.864 1.00 0.00 H new ATOM 0 HE1 TYR A 129 14.864 -4.175 -0.282 1.00 0.00 H new ATOM 0 HE2 TYR A 129 14.678 -6.291 -4.016 1.00 0.00 H new ATOM 0 HH TYR A 129 15.456 -4.203 -3.827 1.00 0.00 H new ATOM 2072 N THR A 130 10.103 -6.847 -1.439 1.00 0.00 N ATOM 2073 CA THR A 130 9.523 -6.323 -2.710 1.00 0.00 C ATOM 2074 C THR A 130 9.905 -4.850 -2.884 1.00 0.00 C ATOM 2075 O THR A 130 9.336 -3.974 -2.263 1.00 0.00 O ATOM 2076 CB THR A 130 8.009 -6.472 -2.545 1.00 0.00 C ATOM 2077 OG1 THR A 130 7.698 -7.828 -2.258 1.00 0.00 O ATOM 2078 CG2 THR A 130 7.306 -6.046 -3.834 1.00 0.00 C ATOM 0 H THR A 130 9.754 -6.405 -0.589 1.00 0.00 H new ATOM 0 HA THR A 130 9.888 -6.856 -3.588 1.00 0.00 H new ATOM 0 HB THR A 130 7.669 -5.839 -1.725 1.00 0.00 H new ATOM 0 HG1 THR A 130 7.090 -8.176 -2.943 1.00 0.00 H new ATOM 0 HG21 THR A 130 6.228 -6.153 -3.713 1.00 0.00 H new ATOM 0 HG22 THR A 130 7.545 -5.005 -4.052 1.00 0.00 H new ATOM 0 HG23 THR A 130 7.643 -6.676 -4.657 1.00 0.00 H new ATOM 2086 N LYS A 131 10.872 -4.571 -3.715 1.00 0.00 N ATOM 2087 CA LYS A 131 11.297 -3.155 -3.915 1.00 0.00 C ATOM 2088 C LYS A 131 10.272 -2.395 -4.761 1.00 0.00 C ATOM 2089 O LYS A 131 10.287 -2.452 -5.975 1.00 0.00 O ATOM 2090 CB LYS A 131 12.636 -3.241 -4.646 1.00 0.00 C ATOM 2091 CG LYS A 131 13.051 -1.846 -5.114 1.00 0.00 C ATOM 2092 CD LYS A 131 14.559 -1.669 -4.925 1.00 0.00 C ATOM 2093 CE LYS A 131 14.888 -0.180 -4.814 1.00 0.00 C ATOM 2094 NZ LYS A 131 16.347 -0.129 -4.520 1.00 0.00 N ATOM 0 H LYS A 131 11.386 -5.261 -4.264 1.00 0.00 H new ATOM 0 HA LYS A 131 11.379 -2.619 -2.970 1.00 0.00 H new ATOM 0 HB2 LYS A 131 13.397 -3.656 -3.985 1.00 0.00 H new ATOM 0 HB3 LYS A 131 12.554 -3.913 -5.500 1.00 0.00 H new ATOM 0 HG2 LYS A 131 12.787 -1.710 -6.163 1.00 0.00 H new ATOM 0 HG3 LYS A 131 12.512 -1.086 -4.548 1.00 0.00 H new ATOM 0 HD2 LYS A 131 14.888 -2.193 -4.027 1.00 0.00 H new ATOM 0 HD3 LYS A 131 15.096 -2.109 -5.765 1.00 0.00 H new ATOM 0 HE2 LYS A 131 14.653 0.346 -5.739 1.00 0.00 H new ATOM 0 HE3 LYS A 131 14.309 0.294 -4.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 16.648 0.862 -4.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 16.540 -0.632 -3.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 16.873 -0.582 -5.295 1.00 0.00 H new ATOM 2108 N LEU A 132 9.389 -1.672 -4.128 1.00 0.00 N ATOM 2109 CA LEU A 132 8.370 -0.896 -4.890 1.00 0.00 C ATOM 2110 C LEU A 132 8.776 0.580 -4.936 1.00 0.00 C ATOM 2111 O LEU A 132 8.560 1.322 -3.999 1.00 0.00 O ATOM 2112 CB LEU A 132 7.066 -1.072 -4.109 1.00 0.00 C ATOM 2113 CG LEU A 132 5.949 -0.289 -4.800 1.00 0.00 C ATOM 2114 CD1 LEU A 132 4.716 -1.183 -4.953 1.00 0.00 C ATOM 2115 CD2 LEU A 132 5.589 0.935 -3.953 1.00 0.00 C ATOM 0 H LEU A 132 9.329 -1.585 -3.113 1.00 0.00 H new ATOM 0 HA LEU A 132 8.270 -1.237 -5.920 1.00 0.00 H new ATOM 0 HB2 LEU A 132 6.803 -2.128 -4.052 1.00 0.00 H new ATOM 0 HB3 LEU A 132 7.192 -0.720 -3.085 1.00 0.00 H new ATOM 0 HG LEU A 132 6.286 0.034 -5.785 1.00 0.00 H new ATOM 0 HD11 LEU A 132 3.920 -0.624 -5.446 1.00 0.00 H new ATOM 0 HD12 LEU A 132 4.972 -2.056 -5.554 1.00 0.00 H new ATOM 0 HD13 LEU A 132 4.377 -1.506 -3.969 1.00 0.00 H new ATOM 0 HD21 LEU A 132 4.793 1.495 -4.443 1.00 0.00 H new ATOM 0 HD22 LEU A 132 5.251 0.610 -2.969 1.00 0.00 H new ATOM 0 HD23 LEU A 132 6.466 1.572 -3.843 1.00 0.00 H new ATOM 2127 N VAL A 133 9.371 1.006 -6.017 1.00 0.00 N ATOM 2128 CA VAL A 133 9.802 2.431 -6.119 1.00 0.00 C ATOM 2129 C VAL A 133 8.685 3.289 -6.721 1.00 0.00 C ATOM 2130 O VAL A 133 8.299 3.115 -7.860 1.00 0.00 O ATOM 2131 CB VAL A 133 11.015 2.409 -7.047 1.00 0.00 C ATOM 2132 CG1 VAL A 133 11.359 3.837 -7.473 1.00 0.00 C ATOM 2133 CG2 VAL A 133 12.209 1.795 -6.310 1.00 0.00 C ATOM 0 H VAL A 133 9.577 0.430 -6.833 1.00 0.00 H new ATOM 0 HA VAL A 133 10.036 2.859 -5.144 1.00 0.00 H new ATOM 0 HB VAL A 133 10.786 1.813 -7.930 1.00 0.00 H new ATOM 0 HG11 VAL A 133 12.225 3.821 -8.135 1.00 0.00 H new ATOM 0 HG12 VAL A 133 10.510 4.275 -7.997 1.00 0.00 H new ATOM 0 HG13 VAL A 133 11.588 4.435 -6.591 1.00 0.00 H new ATOM 0 HG21 VAL A 133 13.075 1.779 -6.971 1.00 0.00 H new ATOM 0 HG22 VAL A 133 12.438 2.392 -5.427 1.00 0.00 H new ATOM 0 HG23 VAL A 133 11.965 0.777 -6.007 1.00 0.00 H new ATOM 2143 N PHE A 134 8.170 4.220 -5.966 1.00 0.00 N ATOM 2144 CA PHE A 134 7.084 5.096 -6.494 1.00 0.00 C ATOM 2145 C PHE A 134 7.503 5.705 -7.833 1.00 0.00 C ATOM 2146 O PHE A 134 8.653 5.646 -8.220 1.00 0.00 O ATOM 2147 CB PHE A 134 6.928 6.203 -5.451 1.00 0.00 C ATOM 2148 CG PHE A 134 6.027 5.739 -4.335 1.00 0.00 C ATOM 2149 CD1 PHE A 134 4.776 5.182 -4.629 1.00 0.00 C ATOM 2150 CD2 PHE A 134 6.441 5.871 -3.006 1.00 0.00 C ATOM 2151 CE1 PHE A 134 3.940 4.757 -3.590 1.00 0.00 C ATOM 2152 CE2 PHE A 134 5.606 5.446 -1.967 1.00 0.00 C ATOM 2153 CZ PHE A 134 4.354 4.889 -2.259 1.00 0.00 C ATOM 0 H PHE A 134 8.454 4.413 -5.005 1.00 0.00 H new ATOM 0 HA PHE A 134 6.158 4.545 -6.659 1.00 0.00 H new ATOM 0 HB2 PHE A 134 7.904 6.477 -5.051 1.00 0.00 H new ATOM 0 HB3 PHE A 134 6.512 7.097 -5.917 1.00 0.00 H new ATOM 0 HD1 PHE A 134 4.457 5.081 -5.656 1.00 0.00 H new ATOM 0 HD2 PHE A 134 7.406 6.301 -2.781 1.00 0.00 H new ATOM 0 HE1 PHE A 134 2.975 4.327 -3.815 1.00 0.00 H new ATOM 0 HE2 PHE A 134 5.926 5.547 -0.941 1.00 0.00 H new ATOM 0 HZ PHE A 134 3.708 4.562 -1.458 1.00 0.00 H new ATOM 2163 N ALA A 135 6.585 6.314 -8.530 1.00 0.00 N ATOM 2164 CA ALA A 135 6.942 6.951 -9.826 1.00 0.00 C ATOM 2165 C ALA A 135 7.692 8.252 -9.541 1.00 0.00 C ATOM 2166 O ALA A 135 8.502 8.706 -10.324 1.00 0.00 O ATOM 2167 CB ALA A 135 5.607 7.235 -10.517 1.00 0.00 C ATOM 0 H ALA A 135 5.605 6.398 -8.258 1.00 0.00 H new ATOM 0 HA ALA A 135 7.581 6.325 -10.449 1.00 0.00 H new ATOM 0 HB1 ALA A 135 5.790 7.707 -11.483 1.00 0.00 H new ATOM 0 HB2 ALA A 135 5.068 6.299 -10.667 1.00 0.00 H new ATOM 0 HB3 ALA A 135 5.010 7.902 -9.895 1.00 0.00 H new ATOM 2173 N LYS A 136 7.429 8.844 -8.407 1.00 0.00 N ATOM 2174 CA LYS A 136 8.122 10.106 -8.035 1.00 0.00 C ATOM 2175 C LYS A 136 8.279 10.172 -6.513 1.00 0.00 C ATOM 2176 O LYS A 136 7.686 9.390 -5.796 1.00 0.00 O ATOM 2177 CB LYS A 136 7.212 11.229 -8.538 1.00 0.00 C ATOM 2178 CG LYS A 136 7.823 11.856 -9.793 1.00 0.00 C ATOM 2179 CD LYS A 136 7.027 13.104 -10.181 1.00 0.00 C ATOM 2180 CE LYS A 136 6.072 12.764 -11.328 1.00 0.00 C ATOM 2181 NZ LYS A 136 6.762 13.248 -12.558 1.00 0.00 N ATOM 0 H LYS A 136 6.758 8.503 -7.719 1.00 0.00 H new ATOM 0 HA LYS A 136 9.120 10.181 -8.467 1.00 0.00 H new ATOM 0 HB2 LYS A 136 6.220 10.836 -8.761 1.00 0.00 H new ATOM 0 HB3 LYS A 136 7.088 11.986 -7.764 1.00 0.00 H new ATOM 0 HG2 LYS A 136 8.865 12.119 -9.610 1.00 0.00 H new ATOM 0 HG3 LYS A 136 7.814 11.137 -10.612 1.00 0.00 H new ATOM 0 HD2 LYS A 136 6.465 13.471 -9.322 1.00 0.00 H new ATOM 0 HD3 LYS A 136 7.705 13.902 -10.483 1.00 0.00 H new ATOM 0 HE2 LYS A 136 5.881 11.692 -11.378 1.00 0.00 H new ATOM 0 HE3 LYS A 136 5.107 13.254 -11.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 6.169 13.051 -13.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 6.925 14.273 -12.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 7.674 12.759 -12.660 1.00 0.00 H new ATOM 2195 N PRO A 137 9.076 11.103 -6.067 1.00 0.00 N ATOM 2196 CA PRO A 137 9.316 11.265 -4.610 1.00 0.00 C ATOM 2197 C PRO A 137 8.066 11.814 -3.917 1.00 0.00 C ATOM 2198 O PRO A 137 7.440 12.741 -4.389 1.00 0.00 O ATOM 2199 CB PRO A 137 10.465 12.268 -4.546 1.00 0.00 C ATOM 2200 CG PRO A 137 10.382 13.029 -5.831 1.00 0.00 C ATOM 2201 CD PRO A 137 9.820 12.085 -6.862 1.00 0.00 C ATOM 0 HA PRO A 137 9.549 10.327 -4.107 1.00 0.00 H new ATOM 0 HB2 PRO A 137 10.364 12.931 -3.687 1.00 0.00 H new ATOM 0 HB3 PRO A 137 11.426 11.763 -4.447 1.00 0.00 H new ATOM 0 HG2 PRO A 137 9.743 13.905 -5.721 1.00 0.00 H new ATOM 0 HG3 PRO A 137 11.366 13.388 -6.132 1.00 0.00 H new ATOM 0 HD2 PRO A 137 9.171 12.603 -7.567 1.00 0.00 H new ATOM 0 HD3 PRO A 137 10.610 11.612 -7.445 1.00 0.00 H new ATOM 2209 N ILE A 138 7.697 11.246 -2.799 1.00 0.00 N ATOM 2210 CA ILE A 138 6.487 11.737 -2.082 1.00 0.00 C ATOM 2211 C ILE A 138 6.877 12.791 -1.042 1.00 0.00 C ATOM 2212 O ILE A 138 7.079 12.486 0.116 1.00 0.00 O ATOM 2213 CB ILE A 138 5.902 10.506 -1.395 1.00 0.00 C ATOM 2214 CG1 ILE A 138 5.953 9.312 -2.349 1.00 0.00 C ATOM 2215 CG2 ILE A 138 4.451 10.787 -1.006 1.00 0.00 C ATOM 2216 CD1 ILE A 138 5.371 9.714 -3.705 1.00 0.00 C ATOM 0 H ILE A 138 8.180 10.466 -2.354 1.00 0.00 H new ATOM 0 HA ILE A 138 5.773 12.205 -2.759 1.00 0.00 H new ATOM 0 HB ILE A 138 6.483 10.277 -0.501 1.00 0.00 H new ATOM 0 HG12 ILE A 138 6.982 8.974 -2.469 1.00 0.00 H new ATOM 0 HG13 ILE A 138 5.389 8.477 -1.933 1.00 0.00 H new ATOM 0 HG21 ILE A 138 4.030 9.910 -0.515 1.00 0.00 H new ATOM 0 HG22 ILE A 138 4.415 11.637 -0.324 1.00 0.00 H new ATOM 0 HG23 ILE A 138 3.872 11.015 -1.901 1.00 0.00 H new ATOM 0 HD11 ILE A 138 5.408 8.862 -4.384 1.00 0.00 H new ATOM 0 HD12 ILE A 138 4.336 10.031 -3.577 1.00 0.00 H new ATOM 0 HD13 ILE A 138 5.954 10.536 -4.122 1.00 0.00 H new ATOM 2228 N TYR A 139 6.984 14.026 -1.444 1.00 0.00 N ATOM 2229 CA TYR A 139 7.363 15.093 -0.474 1.00 0.00 C ATOM 2230 C TYR A 139 6.113 15.797 0.061 1.00 0.00 C ATOM 2231 O TYR A 139 5.312 16.318 -0.689 1.00 0.00 O ATOM 2232 CB TYR A 139 8.224 16.069 -1.274 1.00 0.00 C ATOM 2233 CG TYR A 139 9.681 15.711 -1.104 1.00 0.00 C ATOM 2234 CD1 TYR A 139 10.313 15.915 0.128 1.00 0.00 C ATOM 2235 CD2 TYR A 139 10.400 15.178 -2.180 1.00 0.00 C ATOM 2236 CE1 TYR A 139 11.663 15.584 0.285 1.00 0.00 C ATOM 2237 CE2 TYR A 139 11.751 14.847 -2.024 1.00 0.00 C ATOM 2238 CZ TYR A 139 12.384 15.050 -0.791 1.00 0.00 C ATOM 2239 OH TYR A 139 13.715 14.725 -0.636 1.00 0.00 O ATOM 0 H TYR A 139 6.826 14.344 -2.400 1.00 0.00 H new ATOM 0 HA TYR A 139 7.894 14.692 0.389 1.00 0.00 H new ATOM 0 HB2 TYR A 139 7.950 16.032 -2.328 1.00 0.00 H new ATOM 0 HB3 TYR A 139 8.047 17.089 -0.934 1.00 0.00 H new ATOM 0 HD1 TYR A 139 9.758 16.328 0.958 1.00 0.00 H new ATOM 0 HD2 TYR A 139 9.912 15.022 -3.131 1.00 0.00 H new ATOM 0 HE1 TYR A 139 12.150 15.740 1.236 1.00 0.00 H new ATOM 0 HE2 TYR A 139 12.305 14.435 -2.854 1.00 0.00 H new ATOM 0 HH TYR A 139 13.791 13.883 -0.140 1.00 0.00 H new ATOM 2249 N ASN A 140 5.942 15.821 1.355 1.00 0.00 N ATOM 2250 CA ASN A 140 4.747 16.495 1.938 1.00 0.00 C ATOM 2251 C ASN A 140 4.783 17.992 1.619 1.00 0.00 C ATOM 2252 O ASN A 140 5.760 18.505 1.110 1.00 0.00 O ATOM 2253 CB ASN A 140 4.858 16.264 3.444 1.00 0.00 C ATOM 2254 CG ASN A 140 3.591 16.769 4.135 1.00 0.00 C ATOM 2255 OD1 ASN A 140 2.530 16.197 3.978 1.00 0.00 O ATOM 2256 ND2 ASN A 140 3.656 17.825 4.898 1.00 0.00 N ATOM 0 H ASN A 140 6.578 15.403 2.034 1.00 0.00 H new ATOM 0 HA ASN A 140 3.812 16.105 1.536 1.00 0.00 H new ATOM 0 HB2 ASN A 140 4.998 15.203 3.650 1.00 0.00 H new ATOM 0 HB3 ASN A 140 5.731 16.784 3.838 1.00 0.00 H new ATOM 0 HD21 ASN A 140 2.817 18.171 5.363 1.00 0.00 H new ATOM 0 HD22 ASN A 140 4.546 18.305 5.030 1.00 0.00 H new ATOM 2263 N ASP A 141 3.726 18.699 1.911 1.00 0.00 N ATOM 2264 CA ASP A 141 3.705 20.162 1.622 1.00 0.00 C ATOM 2265 C ASP A 141 3.700 20.960 2.928 1.00 0.00 C ATOM 2266 O ASP A 141 2.654 21.274 3.461 1.00 0.00 O ATOM 2267 CB ASP A 141 2.408 20.393 0.845 1.00 0.00 C ATOM 2268 CG ASP A 141 2.320 19.397 -0.312 1.00 0.00 C ATOM 2269 OD1 ASP A 141 3.330 18.783 -0.617 1.00 0.00 O ATOM 2270 OD2 ASP A 141 1.245 19.263 -0.872 1.00 0.00 O ATOM 0 H ASP A 141 2.877 18.328 2.337 1.00 0.00 H new ATOM 0 HA ASP A 141 4.580 20.485 1.058 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.550 20.275 1.506 1.00 0.00 H new ATOM 0 HB3 ASP A 141 2.378 21.413 0.463 1.00 0.00 H new