USER MOD reduce.3.24.130724 H: found=0, std=0, add=676, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 672 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 23 MET CE :methyl -99:sc= -0.136 (180deg=-1.29) USER MOD Set 1.2: A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 147:sc= 0.0168 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 43:sc= 0.127 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0.011) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 ASN : amide:sc= -0.0621 K(o=-0.062,f=-0.75) USER MOD Single : A 30 SER OG : rot 72:sc= 0.00163 USER MOD Single : A 35 SER OG : rot 180:sc= -0.186 USER MOD Single : A 46 HIS : no HE2:sc= -1.13 K(o=-1.1,f=-4.1!) USER MOD Single : A 50 LYS NZ :NH3+ -144:sc= 0.728 (180deg=0.2) USER MOD Single : A 54 GLN : amide:sc= -1.47 X(o=-1.5,f=-1.5) USER MOD Single : A 57 SER OG : rot 180:sc= -0.0553 USER MOD Single : A 59 ASN : amide:sc= -3.03! C(o=-3!,f=-4.4!) USER MOD Single : A 62 SER OG : rot 35:sc= 0.33 USER MOD Single : A 67 GLN : amide:sc= -2.24 K(o=-2.2,f=-5.8!) USER MOD Single : A 68 HIS : no HE2:sc= -2.93! C(o=-2.9!,f=-5.1!) USER MOD Single : A 70 LYS NZ :NH3+ -128:sc= -0.0877 (180deg=-0.949) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.107 X(o=-0.11,f=-0.00073) USER MOD Single : A 81 SER OG : rot 32:sc= 0.16 USER MOD Single : A 83 LYS NZ :NH3+ -159:sc= -0.297 (180deg=-0.939) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.333 -4.008 -20.842 1.00 0.00 N ATOM 2 CA GLY A 1 2.851 -3.608 -19.546 1.00 0.00 C ATOM 3 C GLY A 1 2.199 -4.363 -18.404 1.00 0.00 C ATOM 4 O GLY A 1 1.018 -4.703 -18.469 1.00 0.00 O ATOM 0 H1 GLY A 1 2.336 -3.190 -21.485 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.931 -4.761 -21.237 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.360 -4.359 -20.734 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.928 -3.776 -19.521 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.692 -2.539 -19.409 1.00 0.00 H new ATOM 8 N SER A 2 2.971 -4.627 -17.355 1.00 0.00 N ATOM 9 CA SER A 2 2.464 -5.351 -16.195 1.00 0.00 C ATOM 10 C SER A 2 1.729 -4.410 -15.246 1.00 0.00 C ATOM 11 O SER A 2 0.604 -4.685 -14.828 1.00 0.00 O ATOM 12 CB SER A 2 3.611 -6.044 -15.458 1.00 0.00 C ATOM 13 OG SER A 2 4.156 -7.095 -16.236 1.00 0.00 O ATOM 0 H SER A 2 3.950 -4.350 -17.284 1.00 0.00 H new ATOM 0 HA SER A 2 1.761 -6.105 -16.548 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.390 -5.318 -15.226 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.251 -6.439 -14.508 1.00 0.00 H new ATOM 0 HG SER A 2 4.888 -7.521 -15.743 1.00 0.00 H new ATOM 19 N SER A 3 2.374 -3.297 -14.909 1.00 0.00 N ATOM 20 CA SER A 3 1.785 -2.316 -14.006 1.00 0.00 C ATOM 21 C SER A 3 0.616 -1.596 -14.673 1.00 0.00 C ATOM 22 O SER A 3 0.503 -1.576 -15.898 1.00 0.00 O ATOM 23 CB SER A 3 2.840 -1.299 -13.565 1.00 0.00 C ATOM 24 OG SER A 3 3.597 -1.792 -12.473 1.00 0.00 O ATOM 0 H SER A 3 3.304 -3.053 -15.248 1.00 0.00 H new ATOM 0 HA SER A 3 1.411 -2.845 -13.129 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.504 -1.073 -14.400 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.354 -0.365 -13.283 1.00 0.00 H new ATOM 0 HG SER A 3 4.265 -1.125 -12.211 1.00 0.00 H new ATOM 30 N GLY A 4 -0.251 -1.006 -13.856 1.00 0.00 N ATOM 31 CA GLY A 4 -1.400 -0.293 -14.384 1.00 0.00 C ATOM 32 C GLY A 4 -2.595 -1.200 -14.602 1.00 0.00 C ATOM 33 O GLY A 4 -3.738 -0.792 -14.395 1.00 0.00 O ATOM 0 H GLY A 4 -0.179 -1.009 -12.839 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.675 0.506 -13.696 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.129 0.179 -15.328 1.00 0.00 H new ATOM 37 N SER A 5 -2.331 -2.432 -15.023 1.00 0.00 N ATOM 38 CA SER A 5 -3.394 -3.398 -15.275 1.00 0.00 C ATOM 39 C SER A 5 -4.132 -3.743 -13.985 1.00 0.00 C ATOM 40 O SER A 5 -5.320 -3.457 -13.841 1.00 0.00 O ATOM 41 CB SER A 5 -2.819 -4.669 -15.903 1.00 0.00 C ATOM 42 OG SER A 5 -3.768 -5.293 -16.751 1.00 0.00 O ATOM 0 H SER A 5 -1.390 -2.785 -15.197 1.00 0.00 H new ATOM 0 HA SER A 5 -4.103 -2.947 -15.969 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.923 -4.423 -16.473 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.517 -5.362 -15.118 1.00 0.00 H new ATOM 0 HG SER A 5 -3.376 -6.102 -17.141 1.00 0.00 H new ATOM 48 N SER A 6 -3.417 -4.360 -13.049 1.00 0.00 N ATOM 49 CA SER A 6 -4.003 -4.749 -11.772 1.00 0.00 C ATOM 50 C SER A 6 -4.389 -3.519 -10.955 1.00 0.00 C ATOM 51 O SER A 6 -4.136 -2.386 -11.361 1.00 0.00 O ATOM 52 CB SER A 6 -3.023 -5.615 -10.979 1.00 0.00 C ATOM 53 OG SER A 6 -3.069 -6.963 -11.412 1.00 0.00 O ATOM 0 H SER A 6 -2.431 -4.601 -13.151 1.00 0.00 H new ATOM 0 HA SER A 6 -4.904 -5.327 -11.975 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.012 -5.226 -11.097 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.263 -5.562 -9.917 1.00 0.00 H new ATOM 0 HG SER A 6 -2.432 -7.496 -10.891 1.00 0.00 H new ATOM 59 N GLY A 7 -5.004 -3.753 -9.799 1.00 0.00 N ATOM 60 CA GLY A 7 -5.415 -2.656 -8.943 1.00 0.00 C ATOM 61 C GLY A 7 -4.262 -1.744 -8.575 1.00 0.00 C ATOM 62 O GLY A 7 -3.502 -2.033 -7.650 1.00 0.00 O ATOM 0 H GLY A 7 -5.225 -4.682 -9.441 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.187 -2.075 -9.448 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.862 -3.057 -8.033 1.00 0.00 H new ATOM 66 N VAL A 8 -4.128 -0.639 -9.301 1.00 0.00 N ATOM 67 CA VAL A 8 -3.059 0.319 -9.047 1.00 0.00 C ATOM 68 C VAL A 8 -3.606 1.606 -8.440 1.00 0.00 C ATOM 69 O VAL A 8 -4.356 2.339 -9.085 1.00 0.00 O ATOM 70 CB VAL A 8 -2.291 0.659 -10.338 1.00 0.00 C ATOM 71 CG1 VAL A 8 -1.204 1.686 -10.058 1.00 0.00 C ATOM 72 CG2 VAL A 8 -1.701 -0.601 -10.953 1.00 0.00 C ATOM 0 H VAL A 8 -4.747 -0.385 -10.071 1.00 0.00 H new ATOM 0 HA VAL A 8 -2.376 -0.151 -8.340 1.00 0.00 H new ATOM 0 HB VAL A 8 -2.990 1.092 -11.054 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.672 1.914 -10.982 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -1.656 2.597 -9.666 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.504 1.284 -9.326 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -1.162 -0.343 -11.864 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -1.015 -1.065 -10.244 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.503 -1.299 -11.192 1.00 0.00 H new ATOM 82 N VAL A 9 -3.226 1.876 -7.195 1.00 0.00 N ATOM 83 CA VAL A 9 -3.678 3.076 -6.501 1.00 0.00 C ATOM 84 C VAL A 9 -2.589 4.143 -6.483 1.00 0.00 C ATOM 85 O VAL A 9 -1.485 3.908 -5.993 1.00 0.00 O ATOM 86 CB VAL A 9 -4.098 2.762 -5.053 1.00 0.00 C ATOM 87 CG1 VAL A 9 -4.522 4.032 -4.332 1.00 0.00 C ATOM 88 CG2 VAL A 9 -5.215 1.730 -5.034 1.00 0.00 C ATOM 0 H VAL A 9 -2.606 1.280 -6.646 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.542 3.452 -7.048 1.00 0.00 H new ATOM 0 HB VAL A 9 -3.240 2.344 -4.527 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -4.815 3.790 -3.310 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -3.689 4.735 -4.314 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -5.366 4.483 -4.855 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.499 1.520 -4.003 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.077 2.117 -5.576 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.870 0.812 -5.509 1.00 0.00 H new ATOM 98 N GLU A 10 -2.909 5.316 -7.020 1.00 0.00 N ATOM 99 CA GLU A 10 -1.956 6.419 -7.066 1.00 0.00 C ATOM 100 C GLU A 10 -2.321 7.495 -6.047 1.00 0.00 C ATOM 101 O GLU A 10 -3.340 8.174 -6.182 1.00 0.00 O ATOM 102 CB GLU A 10 -1.911 7.025 -8.470 1.00 0.00 C ATOM 103 CG GLU A 10 -0.686 7.888 -8.721 1.00 0.00 C ATOM 104 CD GLU A 10 -0.795 9.258 -8.080 1.00 0.00 C ATOM 105 OE1 GLU A 10 -1.334 10.177 -8.732 1.00 0.00 O ATOM 106 OE2 GLU A 10 -0.342 9.411 -6.927 1.00 0.00 O ATOM 0 H GLU A 10 -3.819 5.527 -7.429 1.00 0.00 H new ATOM 0 HA GLU A 10 -0.971 6.025 -6.817 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -1.935 6.220 -9.205 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.807 7.626 -8.626 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.197 7.380 -8.334 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -0.542 8.004 -9.795 1.00 0.00 H new ATOM 113 N LEU A 11 -1.483 7.645 -5.027 1.00 0.00 N ATOM 114 CA LEU A 11 -1.716 8.637 -3.984 1.00 0.00 C ATOM 115 C LEU A 11 -0.619 9.697 -3.986 1.00 0.00 C ATOM 116 O LEU A 11 0.547 9.419 -4.268 1.00 0.00 O ATOM 117 CB LEU A 11 -1.784 7.960 -2.614 1.00 0.00 C ATOM 118 CG LEU A 11 -2.931 6.970 -2.411 1.00 0.00 C ATOM 119 CD1 LEU A 11 -2.662 6.080 -1.208 1.00 0.00 C ATOM 120 CD2 LEU A 11 -4.251 7.709 -2.245 1.00 0.00 C ATOM 0 H LEU A 11 -0.636 7.092 -4.900 1.00 0.00 H new ATOM 0 HA LEU A 11 -2.669 9.126 -4.188 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -0.844 7.436 -2.443 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.860 8.735 -1.851 1.00 0.00 H new ATOM 0 HG LEU A 11 -3.000 6.338 -3.296 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.489 5.382 -1.080 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -1.739 5.523 -1.367 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.565 6.696 -0.314 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -5.056 6.988 -2.102 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.193 8.366 -1.377 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -4.450 8.303 -3.137 1.00 0.00 H new ATOM 132 N PRO A 12 -0.999 10.943 -3.663 1.00 0.00 N ATOM 133 CA PRO A 12 -0.062 12.069 -3.617 1.00 0.00 C ATOM 134 C PRO A 12 0.919 11.961 -2.455 1.00 0.00 C ATOM 135 O PRO A 12 0.534 11.631 -1.333 1.00 0.00 O ATOM 136 CB PRO A 12 -0.975 13.283 -3.435 1.00 0.00 C ATOM 137 CG PRO A 12 -2.200 12.742 -2.781 1.00 0.00 C ATOM 138 CD PRO A 12 -2.372 11.347 -3.316 1.00 0.00 C ATOM 0 HA PRO A 12 0.561 12.117 -4.510 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -0.501 14.046 -2.818 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -1.210 13.748 -4.392 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -2.092 12.734 -1.696 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -3.069 13.358 -3.010 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -2.810 10.682 -2.572 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -3.028 11.328 -4.186 1.00 0.00 H new ATOM 146 N LYS A 13 2.189 12.241 -2.730 1.00 0.00 N ATOM 147 CA LYS A 13 3.225 12.177 -1.707 1.00 0.00 C ATOM 148 C LYS A 13 3.178 13.407 -0.807 1.00 0.00 C ATOM 149 O LYS A 13 3.455 14.523 -1.248 1.00 0.00 O ATOM 150 CB LYS A 13 4.606 12.060 -2.357 1.00 0.00 C ATOM 151 CG LYS A 13 5.755 12.203 -1.374 1.00 0.00 C ATOM 152 CD LYS A 13 6.141 10.864 -0.768 1.00 0.00 C ATOM 153 CE LYS A 13 5.357 10.581 0.504 1.00 0.00 C ATOM 154 NZ LYS A 13 5.948 11.271 1.684 1.00 0.00 N ATOM 0 H LYS A 13 2.525 12.514 -3.653 1.00 0.00 H new ATOM 0 HA LYS A 13 3.042 11.294 -1.095 1.00 0.00 H new ATOM 0 HB2 LYS A 13 4.683 11.094 -2.855 1.00 0.00 H new ATOM 0 HB3 LYS A 13 4.701 12.824 -3.128 1.00 0.00 H new ATOM 0 HG2 LYS A 13 6.617 12.636 -1.881 1.00 0.00 H new ATOM 0 HG3 LYS A 13 5.472 12.894 -0.580 1.00 0.00 H new ATOM 0 HD2 LYS A 13 5.960 10.070 -1.492 1.00 0.00 H new ATOM 0 HD3 LYS A 13 7.208 10.857 -0.548 1.00 0.00 H new ATOM 0 HE2 LYS A 13 4.324 10.904 0.374 1.00 0.00 H new ATOM 0 HE3 LYS A 13 5.334 9.506 0.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 5.385 11.053 2.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 6.925 10.944 1.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 5.947 12.298 1.522 1.00 0.00 H new ATOM 168 N THR A 14 2.828 13.197 0.458 1.00 0.00 N ATOM 169 CA THR A 14 2.745 14.289 1.420 1.00 0.00 C ATOM 170 C THR A 14 3.304 13.871 2.775 1.00 0.00 C ATOM 171 O THR A 14 2.728 13.027 3.462 1.00 0.00 O ATOM 172 CB THR A 14 1.292 14.768 1.602 1.00 0.00 C ATOM 173 OG1 THR A 14 0.419 13.642 1.743 1.00 0.00 O ATOM 174 CG2 THR A 14 0.850 15.615 0.419 1.00 0.00 C ATOM 0 H THR A 14 2.597 12.280 0.840 1.00 0.00 H new ATOM 0 HA THR A 14 3.342 15.109 1.021 1.00 0.00 H new ATOM 0 HB THR A 14 1.244 15.379 2.504 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.828 12.984 2.344 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.179 15.942 0.570 1.00 0.00 H new ATOM 0 HG22 THR A 14 1.499 16.487 0.333 1.00 0.00 H new ATOM 0 HG23 THR A 14 0.913 15.024 -0.495 1.00 0.00 H new ATOM 182 N ASP A 15 4.428 14.467 3.156 1.00 0.00 N ATOM 183 CA ASP A 15 5.065 14.158 4.431 1.00 0.00 C ATOM 184 C ASP A 15 4.020 13.934 5.519 1.00 0.00 C ATOM 185 O ASP A 15 4.206 13.105 6.410 1.00 0.00 O ATOM 186 CB ASP A 15 6.011 15.288 4.840 1.00 0.00 C ATOM 187 CG ASP A 15 6.753 14.984 6.126 1.00 0.00 C ATOM 188 OD1 ASP A 15 7.329 13.881 6.232 1.00 0.00 O ATOM 189 OD2 ASP A 15 6.758 15.848 7.028 1.00 0.00 O ATOM 0 H ASP A 15 4.918 15.168 2.600 1.00 0.00 H new ATOM 0 HA ASP A 15 5.640 13.240 4.309 1.00 0.00 H new ATOM 0 HB2 ASP A 15 6.731 15.462 4.041 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.441 16.209 4.962 1.00 0.00 H new ATOM 194 N GLU A 16 2.921 14.678 5.441 1.00 0.00 N ATOM 195 CA GLU A 16 1.848 14.561 6.421 1.00 0.00 C ATOM 196 C GLU A 16 1.532 13.096 6.710 1.00 0.00 C ATOM 197 O GLU A 16 1.402 12.694 7.865 1.00 0.00 O ATOM 198 CB GLU A 16 0.591 15.276 5.921 1.00 0.00 C ATOM 199 CG GLU A 16 -0.673 14.874 6.662 1.00 0.00 C ATOM 200 CD GLU A 16 -0.454 14.733 8.156 1.00 0.00 C ATOM 201 OE1 GLU A 16 0.414 15.450 8.698 1.00 0.00 O ATOM 202 OE2 GLU A 16 -1.149 13.907 8.783 1.00 0.00 O ATOM 0 H GLU A 16 2.751 15.368 4.709 1.00 0.00 H new ATOM 0 HA GLU A 16 2.182 15.032 7.346 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.732 16.352 6.018 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.462 15.066 4.859 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.448 15.619 6.481 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -1.039 13.929 6.262 1.00 0.00 H new ATOM 209 N GLY A 17 1.410 12.303 5.649 1.00 0.00 N ATOM 210 CA GLY A 17 1.110 10.892 5.809 1.00 0.00 C ATOM 211 C GLY A 17 0.140 10.384 4.762 1.00 0.00 C ATOM 212 O GLY A 17 -0.533 11.170 4.094 1.00 0.00 O ATOM 0 H GLY A 17 1.514 12.613 4.683 1.00 0.00 H new ATOM 0 HA2 GLY A 17 2.035 10.318 5.752 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.691 10.723 6.801 1.00 0.00 H new ATOM 216 N LEU A 18 0.067 9.065 4.615 1.00 0.00 N ATOM 217 CA LEU A 18 -0.827 8.452 3.640 1.00 0.00 C ATOM 218 C LEU A 18 -2.143 8.039 4.292 1.00 0.00 C ATOM 219 O LEU A 18 -3.219 8.272 3.743 1.00 0.00 O ATOM 220 CB LEU A 18 -0.158 7.234 2.999 1.00 0.00 C ATOM 221 CG LEU A 18 1.027 7.527 2.078 1.00 0.00 C ATOM 222 CD1 LEU A 18 0.574 8.326 0.865 1.00 0.00 C ATOM 223 CD2 LEU A 18 2.118 8.272 2.832 1.00 0.00 C ATOM 0 H LEU A 18 0.617 8.400 5.159 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.041 9.190 2.867 1.00 0.00 H new ATOM 0 HB2 LEU A 18 0.181 6.570 3.794 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.910 6.690 2.428 1.00 0.00 H new ATOM 0 HG LEU A 18 1.437 6.578 1.731 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.430 8.526 0.220 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.172 7.756 0.311 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.139 9.270 1.193 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.953 8.472 2.160 1.00 0.00 H new ATOM 0 HD22 LEU A 18 1.721 9.215 3.208 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.463 7.664 3.668 1.00 0.00 H new ATOM 235 N GLY A 19 -2.048 7.425 5.467 1.00 0.00 N ATOM 236 CA GLY A 19 -3.238 6.991 6.176 1.00 0.00 C ATOM 237 C GLY A 19 -3.476 5.499 6.050 1.00 0.00 C ATOM 238 O GLY A 19 -4.617 5.054 5.923 1.00 0.00 O ATOM 0 H GLY A 19 -1.168 7.220 5.941 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -3.145 7.253 7.230 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -4.104 7.528 5.789 1.00 0.00 H new ATOM 242 N PHE A 20 -2.397 4.724 6.082 1.00 0.00 N ATOM 243 CA PHE A 20 -2.494 3.274 5.967 1.00 0.00 C ATOM 244 C PHE A 20 -1.404 2.590 6.787 1.00 0.00 C ATOM 245 O PHE A 20 -0.343 3.163 7.030 1.00 0.00 O ATOM 246 CB PHE A 20 -2.388 2.849 4.501 1.00 0.00 C ATOM 247 CG PHE A 20 -0.977 2.825 3.985 1.00 0.00 C ATOM 248 CD1 PHE A 20 -0.357 3.993 3.573 1.00 0.00 C ATOM 249 CD2 PHE A 20 -0.273 1.634 3.910 1.00 0.00 C ATOM 250 CE1 PHE A 20 0.941 3.975 3.097 1.00 0.00 C ATOM 251 CE2 PHE A 20 1.025 1.610 3.436 1.00 0.00 C ATOM 252 CZ PHE A 20 1.633 2.782 3.028 1.00 0.00 C ATOM 0 H PHE A 20 -1.445 5.076 6.187 1.00 0.00 H new ATOM 0 HA PHE A 20 -3.464 2.967 6.357 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -2.826 1.857 4.386 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -2.979 3.531 3.889 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -0.894 4.929 3.624 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -0.744 0.715 4.225 1.00 0.00 H new ATOM 0 HE1 PHE A 20 1.413 4.893 2.780 1.00 0.00 H new ATOM 0 HE2 PHE A 20 1.564 0.676 3.384 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.647 2.765 2.656 1.00 0.00 H new ATOM 262 N ASN A 21 -1.676 1.360 7.212 1.00 0.00 N ATOM 263 CA ASN A 21 -0.719 0.597 8.006 1.00 0.00 C ATOM 264 C ASN A 21 -0.481 -0.781 7.395 1.00 0.00 C ATOM 265 O ASN A 21 -1.386 -1.375 6.807 1.00 0.00 O ATOM 266 CB ASN A 21 -1.222 0.449 9.444 1.00 0.00 C ATOM 267 CG ASN A 21 -1.461 1.789 10.113 1.00 0.00 C ATOM 268 OD1 ASN A 21 -2.564 2.333 10.060 1.00 0.00 O ATOM 269 ND2 ASN A 21 -0.425 2.328 10.746 1.00 0.00 N ATOM 0 H ASN A 21 -2.550 0.871 7.020 1.00 0.00 H new ATOM 0 HA ASN A 21 0.226 1.141 8.012 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -2.149 -0.125 9.445 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -0.495 -0.119 10.024 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -0.526 3.229 11.214 1.00 0.00 H new ATOM 0 HD22 ASN A 21 0.471 1.841 10.764 1.00 0.00 H new ATOM 276 N ILE A 22 0.741 -1.282 7.538 1.00 0.00 N ATOM 277 CA ILE A 22 1.097 -2.590 7.002 1.00 0.00 C ATOM 278 C ILE A 22 1.996 -3.354 7.968 1.00 0.00 C ATOM 279 O ILE A 22 2.993 -2.822 8.455 1.00 0.00 O ATOM 280 CB ILE A 22 1.811 -2.465 5.643 1.00 0.00 C ATOM 281 CG1 ILE A 22 2.962 -1.461 5.736 1.00 0.00 C ATOM 282 CG2 ILE A 22 0.824 -2.049 4.562 1.00 0.00 C ATOM 283 CD1 ILE A 22 3.744 -1.317 4.450 1.00 0.00 C ATOM 0 H ILE A 22 1.501 -0.802 8.020 1.00 0.00 H new ATOM 0 HA ILE A 22 0.166 -3.140 6.865 1.00 0.00 H new ATOM 0 HB ILE A 22 2.224 -3.438 5.376 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.562 -0.487 6.019 1.00 0.00 H new ATOM 0 HG13 ILE A 22 3.640 -1.771 6.531 1.00 0.00 H new ATOM 0 HG21 ILE A 22 1.344 -1.965 3.608 1.00 0.00 H new ATOM 0 HG22 ILE A 22 0.036 -2.798 4.481 1.00 0.00 H new ATOM 0 HG23 ILE A 22 0.384 -1.086 4.822 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.544 -0.590 4.590 1.00 0.00 H new ATOM 0 HD12 ILE A 22 4.174 -2.280 4.176 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.079 -0.977 3.656 1.00 0.00 H new ATOM 295 N MET A 23 1.637 -4.604 8.238 1.00 0.00 N ATOM 296 CA MET A 23 2.414 -5.443 9.144 1.00 0.00 C ATOM 297 C MET A 23 2.920 -6.692 8.429 1.00 0.00 C ATOM 298 O MET A 23 2.418 -7.057 7.367 1.00 0.00 O ATOM 299 CB MET A 23 1.569 -5.842 10.355 1.00 0.00 C ATOM 300 CG MET A 23 0.480 -6.852 10.030 1.00 0.00 C ATOM 301 SD MET A 23 -0.305 -7.527 11.506 1.00 0.00 S ATOM 302 CE MET A 23 -2.035 -7.369 11.072 1.00 0.00 C ATOM 0 H MET A 23 0.814 -5.059 7.843 1.00 0.00 H new ATOM 0 HA MET A 23 3.274 -4.867 9.484 1.00 0.00 H new ATOM 0 HB2 MET A 23 2.222 -6.258 11.122 1.00 0.00 H new ATOM 0 HB3 MET A 23 1.110 -4.948 10.778 1.00 0.00 H new ATOM 0 HG2 MET A 23 -0.277 -6.376 9.406 1.00 0.00 H new ATOM 0 HG3 MET A 23 0.908 -7.667 9.446 1.00 0.00 H new ATOM 0 HE1 MET A 23 -2.447 -6.474 11.539 1.00 0.00 H new ATOM 0 HE2 MET A 23 -2.133 -7.291 9.989 1.00 0.00 H new ATOM 0 HE3 MET A 23 -2.580 -8.245 11.423 1.00 0.00 H new ATOM 312 N GLY A 24 3.919 -7.342 9.018 1.00 0.00 N ATOM 313 CA GLY A 24 4.476 -8.543 8.423 1.00 0.00 C ATOM 314 C GLY A 24 5.458 -8.235 7.309 1.00 0.00 C ATOM 315 O GLY A 24 5.527 -7.105 6.828 1.00 0.00 O ATOM 0 H GLY A 24 4.353 -7.058 9.897 1.00 0.00 H new ATOM 0 HA2 GLY A 24 4.977 -9.128 9.194 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.667 -9.159 8.030 1.00 0.00 H new ATOM 319 N GLY A 25 6.221 -9.244 6.900 1.00 0.00 N ATOM 320 CA GLY A 25 7.194 -9.055 5.840 1.00 0.00 C ATOM 321 C GLY A 25 7.983 -10.316 5.546 1.00 0.00 C ATOM 322 O GLY A 25 7.700 -11.378 6.101 1.00 0.00 O ATOM 0 H GLY A 25 6.183 -10.188 7.284 1.00 0.00 H new ATOM 0 HA2 GLY A 25 6.682 -8.731 4.934 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.881 -8.257 6.120 1.00 0.00 H new ATOM 326 N LYS A 26 8.975 -10.200 4.669 1.00 0.00 N ATOM 327 CA LYS A 26 9.807 -11.339 4.301 1.00 0.00 C ATOM 328 C LYS A 26 10.523 -11.908 5.522 1.00 0.00 C ATOM 329 O LYS A 26 10.679 -13.122 5.651 1.00 0.00 O ATOM 330 CB LYS A 26 10.833 -10.926 3.242 1.00 0.00 C ATOM 331 CG LYS A 26 10.280 -10.925 1.828 1.00 0.00 C ATOM 332 CD LYS A 26 10.323 -12.314 1.211 1.00 0.00 C ATOM 333 CE LYS A 26 11.691 -12.620 0.623 1.00 0.00 C ATOM 334 NZ LYS A 26 11.859 -14.072 0.336 1.00 0.00 N ATOM 0 H LYS A 26 9.222 -9.328 4.200 1.00 0.00 H new ATOM 0 HA LYS A 26 9.159 -12.112 3.889 1.00 0.00 H new ATOM 0 HB2 LYS A 26 11.205 -9.929 3.478 1.00 0.00 H new ATOM 0 HB3 LYS A 26 11.685 -11.604 3.290 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.252 -10.562 1.839 1.00 0.00 H new ATOM 0 HG3 LYS A 26 10.855 -10.234 1.212 1.00 0.00 H new ATOM 0 HD2 LYS A 26 10.077 -13.058 1.969 1.00 0.00 H new ATOM 0 HD3 LYS A 26 9.565 -12.391 0.431 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.827 -12.050 -0.296 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.466 -12.295 1.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 12.804 -14.240 -0.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 11.754 -14.614 1.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.136 -14.377 -0.346 1.00 0.00 H new ATOM 348 N GLU A 27 10.953 -11.023 6.416 1.00 0.00 N ATOM 349 CA GLU A 27 11.651 -11.439 7.627 1.00 0.00 C ATOM 350 C GLU A 27 10.806 -12.424 8.430 1.00 0.00 C ATOM 351 O GLU A 27 11.334 -13.341 9.058 1.00 0.00 O ATOM 352 CB GLU A 27 11.993 -10.222 8.488 1.00 0.00 C ATOM 353 CG GLU A 27 10.780 -9.575 9.137 1.00 0.00 C ATOM 354 CD GLU A 27 10.474 -10.152 10.506 1.00 0.00 C ATOM 355 OE1 GLU A 27 11.090 -11.177 10.868 1.00 0.00 O ATOM 356 OE2 GLU A 27 9.619 -9.580 11.214 1.00 0.00 O ATOM 0 H GLU A 27 10.830 -10.015 6.325 1.00 0.00 H new ATOM 0 HA GLU A 27 12.575 -11.936 7.331 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.694 -10.524 9.267 1.00 0.00 H new ATOM 0 HB3 GLU A 27 12.502 -9.482 7.870 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.950 -8.502 9.229 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.913 -9.706 8.490 1.00 0.00 H new ATOM 363 N GLN A 28 9.492 -12.225 8.406 1.00 0.00 N ATOM 364 CA GLN A 28 8.575 -13.094 9.133 1.00 0.00 C ATOM 365 C GLN A 28 7.945 -14.122 8.200 1.00 0.00 C ATOM 366 O GLN A 28 6.980 -14.795 8.562 1.00 0.00 O ATOM 367 CB GLN A 28 7.482 -12.265 9.810 1.00 0.00 C ATOM 368 CG GLN A 28 7.836 -11.832 11.224 1.00 0.00 C ATOM 369 CD GLN A 28 7.392 -12.835 12.270 1.00 0.00 C ATOM 370 OE1 GLN A 28 6.233 -12.844 12.686 1.00 0.00 O ATOM 371 NE2 GLN A 28 8.314 -13.687 12.702 1.00 0.00 N ATOM 0 H GLN A 28 9.039 -11.470 7.891 1.00 0.00 H new ATOM 0 HA GLN A 28 9.145 -13.624 9.896 1.00 0.00 H new ATOM 0 HB2 GLN A 28 7.283 -11.379 9.207 1.00 0.00 H new ATOM 0 HB3 GLN A 28 6.560 -12.846 9.837 1.00 0.00 H new ATOM 0 HG2 GLN A 28 8.914 -11.690 11.297 1.00 0.00 H new ATOM 0 HG3 GLN A 28 7.373 -10.867 11.431 1.00 0.00 H new ATOM 0 HE21 GLN A 28 9.263 -13.644 12.330 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.074 -14.385 13.406 1.00 0.00 H new ATOM 380 N ASN A 29 8.496 -14.238 6.996 1.00 0.00 N ATOM 381 CA ASN A 29 7.987 -15.184 6.010 1.00 0.00 C ATOM 382 C ASN A 29 6.510 -14.930 5.724 1.00 0.00 C ATOM 383 O ASN A 29 5.724 -15.867 5.579 1.00 0.00 O ATOM 384 CB ASN A 29 8.182 -16.620 6.501 1.00 0.00 C ATOM 385 CG ASN A 29 8.293 -17.612 5.359 1.00 0.00 C ATOM 386 OD1 ASN A 29 8.929 -17.336 4.342 1.00 0.00 O ATOM 387 ND2 ASN A 29 7.672 -18.774 5.523 1.00 0.00 N ATOM 0 H ASN A 29 9.295 -13.689 6.680 1.00 0.00 H new ATOM 0 HA ASN A 29 8.548 -15.043 5.086 1.00 0.00 H new ATOM 0 HB2 ASN A 29 9.082 -16.673 7.113 1.00 0.00 H new ATOM 0 HB3 ASN A 29 7.345 -16.899 7.141 1.00 0.00 H new ATOM 0 HD21 ASN A 29 7.711 -19.481 4.789 1.00 0.00 H new ATOM 0 HD22 ASN A 29 7.156 -18.960 6.383 1.00 0.00 H new ATOM 394 N SER A 30 6.139 -13.656 5.643 1.00 0.00 N ATOM 395 CA SER A 30 4.756 -13.277 5.378 1.00 0.00 C ATOM 396 C SER A 30 4.691 -12.111 4.397 1.00 0.00 C ATOM 397 O SER A 30 5.530 -11.210 4.408 1.00 0.00 O ATOM 398 CB SER A 30 4.049 -12.902 6.681 1.00 0.00 C ATOM 399 OG SER A 30 3.881 -14.036 7.515 1.00 0.00 O ATOM 0 H SER A 30 6.777 -12.869 5.757 1.00 0.00 H new ATOM 0 HA SER A 30 4.250 -14.133 4.932 1.00 0.00 H new ATOM 0 HB2 SER A 30 4.628 -12.143 7.207 1.00 0.00 H new ATOM 0 HB3 SER A 30 3.076 -12.464 6.458 1.00 0.00 H new ATOM 0 HG SER A 30 4.749 -14.300 7.886 1.00 0.00 H new ATOM 405 N PRO A 31 3.671 -12.127 3.526 1.00 0.00 N ATOM 406 CA PRO A 31 3.470 -11.078 2.522 1.00 0.00 C ATOM 407 C PRO A 31 3.046 -9.752 3.145 1.00 0.00 C ATOM 408 O PRO A 31 2.596 -9.710 4.290 1.00 0.00 O ATOM 409 CB PRO A 31 2.349 -11.638 1.643 1.00 0.00 C ATOM 410 CG PRO A 31 1.608 -12.580 2.529 1.00 0.00 C ATOM 411 CD PRO A 31 2.634 -13.170 3.456 1.00 0.00 C ATOM 0 HA PRO A 31 4.387 -10.855 1.977 1.00 0.00 H new ATOM 0 HB2 PRO A 31 1.698 -10.844 1.277 1.00 0.00 H new ATOM 0 HB3 PRO A 31 2.750 -12.150 0.768 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.830 -12.060 3.088 1.00 0.00 H new ATOM 0 HG3 PRO A 31 1.115 -13.358 1.946 1.00 0.00 H new ATOM 0 HD2 PRO A 31 2.212 -13.384 4.438 1.00 0.00 H new ATOM 0 HD3 PRO A 31 3.033 -14.108 3.069 1.00 0.00 H new ATOM 419 N ILE A 32 3.193 -8.673 2.385 1.00 0.00 N ATOM 420 CA ILE A 32 2.824 -7.346 2.863 1.00 0.00 C ATOM 421 C ILE A 32 1.378 -7.016 2.506 1.00 0.00 C ATOM 422 O ILE A 32 0.967 -7.147 1.353 1.00 0.00 O ATOM 423 CB ILE A 32 3.746 -6.260 2.278 1.00 0.00 C ATOM 424 CG1 ILE A 32 5.203 -6.543 2.651 1.00 0.00 C ATOM 425 CG2 ILE A 32 3.324 -4.885 2.773 1.00 0.00 C ATOM 426 CD1 ILE A 32 6.197 -6.034 1.630 1.00 0.00 C ATOM 0 H ILE A 32 3.565 -8.691 1.435 1.00 0.00 H new ATOM 0 HA ILE A 32 2.935 -7.359 3.947 1.00 0.00 H new ATOM 0 HB ILE A 32 3.659 -6.276 1.192 1.00 0.00 H new ATOM 0 HG12 ILE A 32 5.418 -6.084 3.616 1.00 0.00 H new ATOM 0 HG13 ILE A 32 5.337 -7.618 2.772 1.00 0.00 H new ATOM 0 HG21 ILE A 32 3.985 -4.128 2.351 1.00 0.00 H new ATOM 0 HG22 ILE A 32 2.298 -4.685 2.462 1.00 0.00 H new ATOM 0 HG23 ILE A 32 3.386 -4.855 3.861 1.00 0.00 H new ATOM 0 HD11 ILE A 32 7.209 -6.269 1.959 1.00 0.00 H new ATOM 0 HD12 ILE A 32 6.008 -6.512 0.669 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.091 -4.954 1.526 1.00 0.00 H new ATOM 438 N TYR A 33 0.612 -6.586 3.502 1.00 0.00 N ATOM 439 CA TYR A 33 -0.788 -6.238 3.294 1.00 0.00 C ATOM 440 C TYR A 33 -1.196 -5.067 4.183 1.00 0.00 C ATOM 441 O TYR A 33 -0.409 -4.593 5.004 1.00 0.00 O ATOM 442 CB TYR A 33 -1.684 -7.444 3.579 1.00 0.00 C ATOM 443 CG TYR A 33 -1.407 -8.103 4.911 1.00 0.00 C ATOM 444 CD1 TYR A 33 -0.372 -9.019 5.053 1.00 0.00 C ATOM 445 CD2 TYR A 33 -2.181 -7.811 6.027 1.00 0.00 C ATOM 446 CE1 TYR A 33 -0.115 -9.625 6.269 1.00 0.00 C ATOM 447 CE2 TYR A 33 -1.931 -8.410 7.247 1.00 0.00 C ATOM 448 CZ TYR A 33 -0.897 -9.316 7.362 1.00 0.00 C ATOM 449 OH TYR A 33 -0.646 -9.916 8.575 1.00 0.00 O ATOM 0 H TYR A 33 0.937 -6.470 4.462 1.00 0.00 H new ATOM 0 HA TYR A 33 -0.910 -5.941 2.252 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -2.726 -7.126 3.550 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -1.553 -8.179 2.785 1.00 0.00 H new ATOM 0 HD1 TYR A 33 0.242 -9.262 4.199 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -2.992 -7.103 5.940 1.00 0.00 H new ATOM 0 HE1 TYR A 33 0.693 -10.336 6.362 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -2.541 -8.170 8.105 1.00 0.00 H new ATOM 0 HH TYR A 33 -1.286 -9.588 9.241 1.00 0.00 H new ATOM 459 N ILE A 34 -2.431 -4.606 4.014 1.00 0.00 N ATOM 460 CA ILE A 34 -2.945 -3.493 4.802 1.00 0.00 C ATOM 461 C ILE A 34 -3.534 -3.978 6.122 1.00 0.00 C ATOM 462 O ILE A 34 -4.592 -4.608 6.147 1.00 0.00 O ATOM 463 CB ILE A 34 -4.021 -2.707 4.030 1.00 0.00 C ATOM 464 CG1 ILE A 34 -3.459 -2.201 2.700 1.00 0.00 C ATOM 465 CG2 ILE A 34 -4.534 -1.547 4.870 1.00 0.00 C ATOM 466 CD1 ILE A 34 -2.402 -1.130 2.859 1.00 0.00 C ATOM 0 H ILE A 34 -3.094 -4.986 3.338 1.00 0.00 H new ATOM 0 HA ILE A 34 -2.101 -2.834 5.005 1.00 0.00 H new ATOM 0 HB ILE A 34 -4.856 -3.375 3.819 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -3.034 -3.041 2.151 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -4.276 -1.807 2.096 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.294 -1.001 4.311 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.968 -1.930 5.793 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -3.708 -0.877 5.109 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -2.049 -0.819 1.876 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -2.828 -0.273 3.380 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -1.566 -1.526 3.436 1.00 0.00 H new ATOM 478 N SER A 35 -2.843 -3.680 7.217 1.00 0.00 N ATOM 479 CA SER A 35 -3.297 -4.088 8.542 1.00 0.00 C ATOM 480 C SER A 35 -4.437 -3.197 9.024 1.00 0.00 C ATOM 481 O SER A 35 -5.501 -3.684 9.406 1.00 0.00 O ATOM 482 CB SER A 35 -2.138 -4.037 9.539 1.00 0.00 C ATOM 483 OG SER A 35 -1.633 -2.719 9.667 1.00 0.00 O ATOM 0 H SER A 35 -1.967 -3.158 7.214 1.00 0.00 H new ATOM 0 HA SER A 35 -3.664 -5.112 8.474 1.00 0.00 H new ATOM 0 HB2 SER A 35 -2.474 -4.397 10.511 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.342 -4.705 9.210 1.00 0.00 H new ATOM 0 HG SER A 35 -0.894 -2.713 10.311 1.00 0.00 H new ATOM 489 N ARG A 36 -4.206 -1.888 9.003 1.00 0.00 N ATOM 490 CA ARG A 36 -5.212 -0.928 9.439 1.00 0.00 C ATOM 491 C ARG A 36 -5.263 0.271 8.497 1.00 0.00 C ATOM 492 O ARG A 36 -4.269 0.615 7.858 1.00 0.00 O ATOM 493 CB ARG A 36 -4.916 -0.457 10.864 1.00 0.00 C ATOM 494 CG ARG A 36 -6.108 0.185 11.554 1.00 0.00 C ATOM 495 CD ARG A 36 -5.680 0.992 12.770 1.00 0.00 C ATOM 496 NE ARG A 36 -5.087 0.150 13.805 1.00 0.00 N ATOM 497 CZ ARG A 36 -5.778 -0.727 14.524 1.00 0.00 C ATOM 498 NH1 ARG A 36 -7.080 -0.876 14.322 1.00 0.00 N ATOM 499 NH2 ARG A 36 -5.167 -1.458 15.448 1.00 0.00 N ATOM 0 H ARG A 36 -3.331 -1.469 8.689 1.00 0.00 H new ATOM 0 HA ARG A 36 -6.182 -1.424 9.422 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -4.579 -1.308 11.456 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -4.094 0.258 10.838 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -6.631 0.834 10.851 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -6.813 -0.588 11.859 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -4.961 1.752 12.465 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -6.544 1.516 13.180 1.00 0.00 H new ATOM 0 HE ARG A 36 -4.087 0.240 13.986 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -7.553 -0.316 13.613 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -7.608 -1.550 14.876 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -4.166 -1.347 15.607 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -5.699 -2.131 16.000 1.00 0.00 H new ATOM 513 N VAL A 37 -6.430 0.904 8.415 1.00 0.00 N ATOM 514 CA VAL A 37 -6.611 2.065 7.552 1.00 0.00 C ATOM 515 C VAL A 37 -7.127 3.262 8.342 1.00 0.00 C ATOM 516 O VAL A 37 -8.130 3.166 9.049 1.00 0.00 O ATOM 517 CB VAL A 37 -7.590 1.762 6.402 1.00 0.00 C ATOM 518 CG1 VAL A 37 -7.826 3.006 5.559 1.00 0.00 C ATOM 519 CG2 VAL A 37 -7.068 0.618 5.545 1.00 0.00 C ATOM 0 H VAL A 37 -7.264 0.632 8.936 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.633 2.304 7.134 1.00 0.00 H new ATOM 0 HB VAL A 37 -8.544 1.458 6.832 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -8.520 2.772 4.752 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -8.247 3.794 6.183 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.880 3.345 5.137 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -7.772 0.418 4.738 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -6.101 0.891 5.123 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -6.957 -0.275 6.159 1.00 0.00 H new ATOM 529 N ILE A 38 -6.434 4.389 8.216 1.00 0.00 N ATOM 530 CA ILE A 38 -6.823 5.606 8.918 1.00 0.00 C ATOM 531 C ILE A 38 -8.172 6.119 8.422 1.00 0.00 C ATOM 532 O ILE A 38 -8.361 6.399 7.239 1.00 0.00 O ATOM 533 CB ILE A 38 -5.770 6.717 8.745 1.00 0.00 C ATOM 534 CG1 ILE A 38 -4.406 6.238 9.246 1.00 0.00 C ATOM 535 CG2 ILE A 38 -6.200 7.974 9.486 1.00 0.00 C ATOM 536 CD1 ILE A 38 -4.409 5.818 10.699 1.00 0.00 C ATOM 0 H ILE A 38 -5.601 4.485 7.635 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.899 5.350 9.975 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.685 6.955 7.685 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -4.078 5.398 8.634 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -3.677 7.036 9.109 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.446 8.750 9.354 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -7.153 8.323 9.088 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.310 7.751 10.547 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.410 5.490 10.985 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.706 6.662 11.321 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.114 4.998 10.839 1.00 0.00 H new ATOM 548 N PRO A 39 -9.133 6.247 9.349 1.00 0.00 N ATOM 549 CA PRO A 39 -10.480 6.729 9.031 1.00 0.00 C ATOM 550 C PRO A 39 -10.495 8.210 8.670 1.00 0.00 C ATOM 551 O PRO A 39 -11.554 8.790 8.432 1.00 0.00 O ATOM 552 CB PRO A 39 -11.258 6.487 10.327 1.00 0.00 C ATOM 553 CG PRO A 39 -10.224 6.501 11.399 1.00 0.00 C ATOM 554 CD PRO A 39 -8.978 5.931 10.779 1.00 0.00 C ATOM 0 HA PRO A 39 -10.901 6.221 8.164 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -12.007 7.262 10.490 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -11.786 5.534 10.299 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -10.051 7.514 11.762 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -10.541 5.906 12.255 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -8.078 6.384 11.195 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -8.901 4.857 10.947 1.00 0.00 H new ATOM 562 N GLY A 40 -9.313 8.818 8.630 1.00 0.00 N ATOM 563 CA GLY A 40 -9.214 10.226 8.296 1.00 0.00 C ATOM 564 C GLY A 40 -7.866 10.588 7.704 1.00 0.00 C ATOM 565 O GLY A 40 -7.186 11.488 8.195 1.00 0.00 O ATOM 0 H GLY A 40 -8.422 8.360 8.823 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.000 10.484 7.586 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.386 10.822 9.192 1.00 0.00 H new ATOM 569 N GLY A 41 -7.477 9.883 6.646 1.00 0.00 N ATOM 570 CA GLY A 41 -6.202 10.149 6.006 1.00 0.00 C ATOM 571 C GLY A 41 -6.346 10.439 4.525 1.00 0.00 C ATOM 572 O GLY A 41 -7.400 10.886 4.072 1.00 0.00 O ATOM 0 H GLY A 41 -8.022 9.133 6.221 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -5.724 10.998 6.495 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.544 9.291 6.143 1.00 0.00 H new ATOM 576 N VAL A 42 -5.284 10.186 3.767 1.00 0.00 N ATOM 577 CA VAL A 42 -5.296 10.423 2.329 1.00 0.00 C ATOM 578 C VAL A 42 -5.771 9.187 1.572 1.00 0.00 C ATOM 579 O VAL A 42 -6.526 9.291 0.607 1.00 0.00 O ATOM 580 CB VAL A 42 -3.901 10.823 1.814 1.00 0.00 C ATOM 581 CG1 VAL A 42 -3.922 11.007 0.304 1.00 0.00 C ATOM 582 CG2 VAL A 42 -3.420 12.089 2.507 1.00 0.00 C ATOM 0 H VAL A 42 -4.404 9.816 4.126 1.00 0.00 H new ATOM 0 HA VAL A 42 -5.990 11.244 2.150 1.00 0.00 H new ATOM 0 HB VAL A 42 -3.202 10.020 2.049 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.928 11.289 -0.042 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.220 10.073 -0.172 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -4.633 11.791 0.043 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.433 12.357 2.131 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.118 12.902 2.306 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -3.364 11.917 3.582 1.00 0.00 H new ATOM 592 N ALA A 43 -5.321 8.019 2.018 1.00 0.00 N ATOM 593 CA ALA A 43 -5.702 6.762 1.384 1.00 0.00 C ATOM 594 C ALA A 43 -7.196 6.502 1.536 1.00 0.00 C ATOM 595 O ALA A 43 -7.848 6.015 0.611 1.00 0.00 O ATOM 596 CB ALA A 43 -4.901 5.611 1.974 1.00 0.00 C ATOM 0 H ALA A 43 -4.693 7.917 2.815 1.00 0.00 H new ATOM 0 HA ALA A 43 -5.480 6.837 0.320 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.195 4.679 1.492 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -3.838 5.785 1.809 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.096 5.543 3.044 1.00 0.00 H new ATOM 602 N ASP A 44 -7.733 6.827 2.706 1.00 0.00 N ATOM 603 CA ASP A 44 -9.152 6.628 2.979 1.00 0.00 C ATOM 604 C ASP A 44 -10.010 7.450 2.021 1.00 0.00 C ATOM 605 O ASP A 44 -10.749 6.898 1.206 1.00 0.00 O ATOM 606 CB ASP A 44 -9.474 7.008 4.425 1.00 0.00 C ATOM 607 CG ASP A 44 -10.839 6.514 4.863 1.00 0.00 C ATOM 608 OD1 ASP A 44 -11.062 5.286 4.834 1.00 0.00 O ATOM 609 OD2 ASP A 44 -11.684 7.355 5.234 1.00 0.00 O ATOM 0 H ASP A 44 -7.207 7.230 3.482 1.00 0.00 H new ATOM 0 HA ASP A 44 -9.381 5.573 2.830 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -8.712 6.594 5.085 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -9.432 8.092 4.531 1.00 0.00 H new ATOM 614 N ARG A 45 -9.906 8.770 2.126 1.00 0.00 N ATOM 615 CA ARG A 45 -10.673 9.668 1.271 1.00 0.00 C ATOM 616 C ARG A 45 -10.542 9.266 -0.195 1.00 0.00 C ATOM 617 O ARG A 45 -11.527 8.910 -0.843 1.00 0.00 O ATOM 618 CB ARG A 45 -10.204 11.111 1.459 1.00 0.00 C ATOM 619 CG ARG A 45 -10.351 11.619 2.884 1.00 0.00 C ATOM 620 CD ARG A 45 -10.309 13.138 2.942 1.00 0.00 C ATOM 621 NE ARG A 45 -11.599 13.734 2.608 1.00 0.00 N ATOM 622 CZ ARG A 45 -11.936 14.115 1.381 1.00 0.00 C ATOM 623 NH1 ARG A 45 -11.084 13.962 0.377 1.00 0.00 N ATOM 624 NH2 ARG A 45 -13.130 14.650 1.155 1.00 0.00 N ATOM 0 H ARG A 45 -9.298 9.242 2.795 1.00 0.00 H new ATOM 0 HA ARG A 45 -11.722 9.594 1.558 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -9.158 11.186 1.162 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -10.772 11.759 0.791 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -11.293 11.264 3.302 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -9.553 11.208 3.502 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -10.011 13.455 3.942 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -9.550 13.506 2.252 1.00 0.00 H new ATOM 0 HE ARG A 45 -12.278 13.865 3.357 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -10.166 13.550 0.545 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -11.346 14.256 -0.564 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -13.789 14.769 1.924 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -13.388 14.942 0.212 1.00 0.00 H new ATOM 638 N HIS A 46 -9.319 9.327 -0.713 1.00 0.00 N ATOM 639 CA HIS A 46 -9.058 8.969 -2.103 1.00 0.00 C ATOM 640 C HIS A 46 -9.647 7.600 -2.431 1.00 0.00 C ATOM 641 O HIS A 46 -10.340 7.436 -3.434 1.00 0.00 O ATOM 642 CB HIS A 46 -7.555 8.970 -2.379 1.00 0.00 C ATOM 643 CG HIS A 46 -7.198 8.511 -3.759 1.00 0.00 C ATOM 644 ND1 HIS A 46 -7.431 7.229 -4.209 1.00 0.00 N ATOM 645 CD2 HIS A 46 -6.625 9.172 -4.792 1.00 0.00 C ATOM 646 CE1 HIS A 46 -7.015 7.121 -5.458 1.00 0.00 C ATOM 647 NE2 HIS A 46 -6.521 8.286 -5.835 1.00 0.00 N ATOM 0 H HIS A 46 -8.493 9.621 -0.191 1.00 0.00 H new ATOM 0 HA HIS A 46 -9.536 9.713 -2.740 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -7.167 9.978 -2.229 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.060 8.326 -1.652 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -7.858 6.481 -3.663 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -6.309 10.205 -4.795 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -7.070 6.231 -6.067 1.00 0.00 H new ATOM 655 N GLY A 47 -9.365 6.620 -1.578 1.00 0.00 N ATOM 656 CA GLY A 47 -9.873 5.278 -1.796 1.00 0.00 C ATOM 657 C GLY A 47 -8.891 4.402 -2.549 1.00 0.00 C ATOM 658 O GLY A 47 -7.711 4.731 -2.657 1.00 0.00 O ATOM 0 H GLY A 47 -8.794 6.731 -0.740 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.102 4.819 -0.834 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.808 5.333 -2.354 1.00 0.00 H new ATOM 662 N GLY A 48 -9.380 3.280 -3.069 1.00 0.00 N ATOM 663 CA GLY A 48 -8.524 2.370 -3.807 1.00 0.00 C ATOM 664 C GLY A 48 -7.831 1.367 -2.906 1.00 0.00 C ATOM 665 O GLY A 48 -7.636 0.211 -3.285 1.00 0.00 O ATOM 0 H GLY A 48 -10.353 2.985 -2.992 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -9.119 1.837 -4.549 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -7.774 2.943 -4.352 1.00 0.00 H new ATOM 669 N LEU A 49 -7.456 1.809 -1.710 1.00 0.00 N ATOM 670 CA LEU A 49 -6.778 0.942 -0.752 1.00 0.00 C ATOM 671 C LEU A 49 -7.688 0.620 0.429 1.00 0.00 C ATOM 672 O LEU A 49 -8.560 1.411 0.789 1.00 0.00 O ATOM 673 CB LEU A 49 -5.492 1.605 -0.255 1.00 0.00 C ATOM 674 CG LEU A 49 -4.268 1.456 -1.159 1.00 0.00 C ATOM 675 CD1 LEU A 49 -3.254 2.552 -0.869 1.00 0.00 C ATOM 676 CD2 LEU A 49 -3.637 0.082 -0.980 1.00 0.00 C ATOM 0 H LEU A 49 -7.610 2.762 -1.381 1.00 0.00 H new ATOM 0 HA LEU A 49 -6.526 0.010 -1.257 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -5.686 2.668 -0.113 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -5.249 1.192 0.724 1.00 0.00 H new ATOM 0 HG LEU A 49 -4.591 1.553 -2.195 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.390 2.430 -1.522 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.710 3.526 -1.048 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.935 2.487 0.171 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.767 -0.007 -1.631 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -3.328 -0.044 0.058 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -4.363 -0.688 -1.238 1.00 0.00 H new ATOM 688 N LYS A 50 -7.477 -0.545 1.032 1.00 0.00 N ATOM 689 CA LYS A 50 -8.274 -0.971 2.176 1.00 0.00 C ATOM 690 C LYS A 50 -7.642 -2.178 2.860 1.00 0.00 C ATOM 691 O LYS A 50 -6.821 -2.880 2.269 1.00 0.00 O ATOM 692 CB LYS A 50 -9.699 -1.311 1.732 1.00 0.00 C ATOM 693 CG LYS A 50 -9.791 -2.579 0.902 1.00 0.00 C ATOM 694 CD LYS A 50 -11.147 -3.248 1.053 1.00 0.00 C ATOM 695 CE LYS A 50 -11.127 -4.676 0.530 1.00 0.00 C ATOM 696 NZ LYS A 50 -10.565 -5.625 1.531 1.00 0.00 N ATOM 0 H LYS A 50 -6.760 -1.212 0.747 1.00 0.00 H new ATOM 0 HA LYS A 50 -8.309 -0.148 2.890 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -10.330 -1.418 2.614 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -10.099 -0.478 1.153 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -9.617 -2.341 -0.147 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -9.007 -3.272 1.207 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -11.438 -3.248 2.103 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -11.899 -2.673 0.514 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -12.140 -4.981 0.269 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -10.535 -4.720 -0.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -10.015 -6.360 1.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -9.946 -5.109 2.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -11.341 -6.069 2.062 1.00 0.00 H new ATOM 710 N ARG A 51 -8.030 -2.416 4.109 1.00 0.00 N ATOM 711 CA ARG A 51 -7.501 -3.539 4.873 1.00 0.00 C ATOM 712 C ARG A 51 -7.660 -4.845 4.101 1.00 0.00 C ATOM 713 O ARG A 51 -8.766 -5.215 3.709 1.00 0.00 O ATOM 714 CB ARG A 51 -8.210 -3.643 6.225 1.00 0.00 C ATOM 715 CG ARG A 51 -7.555 -4.624 7.182 1.00 0.00 C ATOM 716 CD ARG A 51 -8.431 -4.885 8.398 1.00 0.00 C ATOM 717 NE ARG A 51 -9.516 -5.815 8.103 1.00 0.00 N ATOM 718 CZ ARG A 51 -10.121 -6.556 9.024 1.00 0.00 C ATOM 719 NH1 ARG A 51 -9.748 -6.475 10.294 1.00 0.00 N ATOM 720 NH2 ARG A 51 -11.101 -7.380 8.677 1.00 0.00 N ATOM 0 H ARG A 51 -8.709 -1.846 4.613 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.438 -3.363 5.040 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -8.235 -2.657 6.689 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -9.245 -3.944 6.061 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -7.359 -5.563 6.665 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -6.591 -4.231 7.504 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -7.819 -5.287 9.206 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -8.848 -3.943 8.753 1.00 0.00 H new ATOM 0 HE ARG A 51 -9.827 -5.901 7.135 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -8.995 -5.843 10.565 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -10.214 -7.045 11.000 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -11.391 -7.445 7.701 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -11.564 -7.948 9.386 1.00 0.00 H new ATOM 734 N GLY A 52 -6.547 -5.539 3.886 1.00 0.00 N ATOM 735 CA GLY A 52 -6.585 -6.796 3.161 1.00 0.00 C ATOM 736 C GLY A 52 -5.781 -6.749 1.877 1.00 0.00 C ATOM 737 O GLY A 52 -5.090 -7.708 1.534 1.00 0.00 O ATOM 0 H GLY A 52 -5.620 -5.254 4.201 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.199 -7.591 3.799 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.620 -7.047 2.929 1.00 0.00 H new ATOM 741 N ASP A 53 -5.872 -5.631 1.165 1.00 0.00 N ATOM 742 CA ASP A 53 -5.148 -5.463 -0.090 1.00 0.00 C ATOM 743 C ASP A 53 -3.657 -5.721 0.104 1.00 0.00 C ATOM 744 O ASP A 53 -2.968 -4.955 0.777 1.00 0.00 O ATOM 745 CB ASP A 53 -5.367 -4.055 -0.645 1.00 0.00 C ATOM 746 CG ASP A 53 -6.825 -3.772 -0.948 1.00 0.00 C ATOM 747 OD1 ASP A 53 -7.555 -4.723 -1.296 1.00 0.00 O ATOM 748 OD2 ASP A 53 -7.237 -2.598 -0.836 1.00 0.00 O ATOM 0 H ASP A 53 -6.440 -4.828 1.435 1.00 0.00 H new ATOM 0 HA ASP A 53 -5.534 -6.190 -0.804 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.000 -3.323 0.074 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -4.779 -3.931 -1.554 1.00 0.00 H new ATOM 753 N GLN A 54 -3.167 -6.805 -0.488 1.00 0.00 N ATOM 754 CA GLN A 54 -1.758 -7.164 -0.378 1.00 0.00 C ATOM 755 C GLN A 54 -0.903 -6.302 -1.301 1.00 0.00 C ATOM 756 O GLN A 54 -1.202 -6.158 -2.487 1.00 0.00 O ATOM 757 CB GLN A 54 -1.560 -8.643 -0.714 1.00 0.00 C ATOM 758 CG GLN A 54 -0.349 -9.264 -0.036 1.00 0.00 C ATOM 759 CD GLN A 54 -0.380 -10.779 -0.059 1.00 0.00 C ATOM 760 OE1 GLN A 54 -1.026 -11.411 0.777 1.00 0.00 O ATOM 761 NE2 GLN A 54 0.321 -11.372 -1.019 1.00 0.00 N ATOM 0 H GLN A 54 -3.724 -7.450 -1.048 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.443 -6.986 0.650 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.453 -9.196 -0.422 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.457 -8.751 -1.794 1.00 0.00 H new ATOM 0 HG2 GLN A 54 0.558 -8.916 -0.530 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.300 -8.921 0.998 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.842 -10.810 -1.691 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.338 -12.390 -1.084 1.00 0.00 H new ATOM 770 N LEU A 55 0.161 -5.730 -0.749 1.00 0.00 N ATOM 771 CA LEU A 55 1.061 -4.881 -1.523 1.00 0.00 C ATOM 772 C LEU A 55 1.857 -5.706 -2.529 1.00 0.00 C ATOM 773 O LEU A 55 2.685 -6.536 -2.151 1.00 0.00 O ATOM 774 CB LEU A 55 2.015 -4.133 -0.591 1.00 0.00 C ATOM 775 CG LEU A 55 2.686 -2.889 -1.175 1.00 0.00 C ATOM 776 CD1 LEU A 55 1.652 -1.815 -1.475 1.00 0.00 C ATOM 777 CD2 LEU A 55 3.748 -2.359 -0.223 1.00 0.00 C ATOM 0 H LEU A 55 0.422 -5.838 0.231 1.00 0.00 H new ATOM 0 HA LEU A 55 0.457 -4.158 -2.071 1.00 0.00 H new ATOM 0 HB2 LEU A 55 1.463 -3.838 0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.794 -4.825 -0.270 1.00 0.00 H new ATOM 0 HG LEU A 55 3.172 -3.167 -2.110 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.148 -0.938 -1.890 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.929 -2.197 -2.195 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.137 -1.539 -0.555 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.215 -1.474 -0.655 1.00 0.00 H new ATOM 0 HD22 LEU A 55 3.286 -2.097 0.729 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.506 -3.126 -0.060 1.00 0.00 H new ATOM 789 N LEU A 56 1.604 -5.471 -3.811 1.00 0.00 N ATOM 790 CA LEU A 56 2.299 -6.191 -4.873 1.00 0.00 C ATOM 791 C LEU A 56 3.602 -5.490 -5.243 1.00 0.00 C ATOM 792 O LEU A 56 4.662 -6.113 -5.290 1.00 0.00 O ATOM 793 CB LEU A 56 1.402 -6.310 -6.107 1.00 0.00 C ATOM 794 CG LEU A 56 0.127 -7.136 -5.933 1.00 0.00 C ATOM 795 CD1 LEU A 56 -0.682 -7.146 -7.220 1.00 0.00 C ATOM 796 CD2 LEU A 56 0.467 -8.556 -5.503 1.00 0.00 C ATOM 0 H LEU A 56 0.923 -4.787 -4.141 1.00 0.00 H new ATOM 0 HA LEU A 56 2.536 -7.190 -4.506 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.120 -5.306 -6.425 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.987 -6.748 -6.916 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.478 -6.676 -5.152 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.586 -7.739 -7.077 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.956 -6.125 -7.486 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.085 -7.582 -8.021 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.452 -9.130 -5.384 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.093 -9.026 -6.262 1.00 0.00 H new ATOM 0 HD23 LEU A 56 1.004 -8.530 -4.555 1.00 0.00 H new ATOM 808 N SER A 57 3.515 -4.189 -5.504 1.00 0.00 N ATOM 809 CA SER A 57 4.687 -3.403 -5.871 1.00 0.00 C ATOM 810 C SER A 57 4.453 -1.920 -5.601 1.00 0.00 C ATOM 811 O SER A 57 3.316 -1.448 -5.603 1.00 0.00 O ATOM 812 CB SER A 57 5.028 -3.616 -7.347 1.00 0.00 C ATOM 813 OG SER A 57 4.016 -3.087 -8.186 1.00 0.00 O ATOM 0 H SER A 57 2.645 -3.658 -5.468 1.00 0.00 H new ATOM 0 HA SER A 57 5.525 -3.738 -5.259 1.00 0.00 H new ATOM 0 HB2 SER A 57 5.981 -3.139 -7.576 1.00 0.00 H new ATOM 0 HB3 SER A 57 5.149 -4.681 -7.545 1.00 0.00 H new ATOM 0 HG SER A 57 4.259 -3.234 -9.124 1.00 0.00 H new ATOM 819 N VAL A 58 5.539 -1.189 -5.367 1.00 0.00 N ATOM 820 CA VAL A 58 5.454 0.241 -5.096 1.00 0.00 C ATOM 821 C VAL A 58 6.401 1.028 -5.994 1.00 0.00 C ATOM 822 O VAL A 58 7.545 0.630 -6.207 1.00 0.00 O ATOM 823 CB VAL A 58 5.782 0.553 -3.623 1.00 0.00 C ATOM 824 CG1 VAL A 58 5.787 2.055 -3.384 1.00 0.00 C ATOM 825 CG2 VAL A 58 4.792 -0.139 -2.699 1.00 0.00 C ATOM 0 H VAL A 58 6.488 -1.564 -5.360 1.00 0.00 H new ATOM 0 HA VAL A 58 4.427 0.542 -5.304 1.00 0.00 H new ATOM 0 HB VAL A 58 6.779 0.171 -3.402 1.00 0.00 H new ATOM 0 HG11 VAL A 58 6.020 2.256 -2.338 1.00 0.00 H new ATOM 0 HG12 VAL A 58 6.539 2.522 -4.020 1.00 0.00 H new ATOM 0 HG13 VAL A 58 4.805 2.465 -3.622 1.00 0.00 H new ATOM 0 HG21 VAL A 58 5.039 0.092 -1.663 1.00 0.00 H new ATOM 0 HG22 VAL A 58 3.783 0.211 -2.919 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.843 -1.217 -2.852 1.00 0.00 H new ATOM 835 N ASN A 59 5.915 2.148 -6.519 1.00 0.00 N ATOM 836 CA ASN A 59 6.719 2.993 -7.395 1.00 0.00 C ATOM 837 C ASN A 59 7.323 2.176 -8.533 1.00 0.00 C ATOM 838 O ASN A 59 8.429 2.456 -8.994 1.00 0.00 O ATOM 839 CB ASN A 59 7.831 3.678 -6.598 1.00 0.00 C ATOM 840 CG ASN A 59 7.295 4.727 -5.643 1.00 0.00 C ATOM 841 OD1 ASN A 59 7.182 4.488 -4.441 1.00 0.00 O ATOM 842 ND2 ASN A 59 6.962 5.897 -6.176 1.00 0.00 N ATOM 0 H ASN A 59 4.969 2.492 -6.353 1.00 0.00 H new ATOM 0 HA ASN A 59 6.067 3.754 -7.823 1.00 0.00 H new ATOM 0 HB2 ASN A 59 8.386 2.928 -6.035 1.00 0.00 H new ATOM 0 HB3 ASN A 59 8.535 4.144 -7.288 1.00 0.00 H new ATOM 0 HD21 ASN A 59 6.596 6.642 -5.583 1.00 0.00 H new ATOM 0 HD22 ASN A 59 7.073 6.051 -7.178 1.00 0.00 H new ATOM 849 N GLY A 60 6.588 1.163 -8.983 1.00 0.00 N ATOM 850 CA GLY A 60 7.067 0.321 -10.064 1.00 0.00 C ATOM 851 C GLY A 60 8.216 -0.571 -9.638 1.00 0.00 C ATOM 852 O GLY A 60 9.092 -0.893 -10.440 1.00 0.00 O ATOM 0 H GLY A 60 5.670 0.911 -8.618 1.00 0.00 H new ATOM 0 HA2 GLY A 60 6.247 -0.297 -10.429 1.00 0.00 H new ATOM 0 HA3 GLY A 60 7.387 0.949 -10.895 1.00 0.00 H new ATOM 856 N VAL A 61 8.214 -0.971 -8.370 1.00 0.00 N ATOM 857 CA VAL A 61 9.264 -1.831 -7.838 1.00 0.00 C ATOM 858 C VAL A 61 8.674 -3.036 -7.114 1.00 0.00 C ATOM 859 O VAL A 61 7.816 -2.891 -6.244 1.00 0.00 O ATOM 860 CB VAL A 61 10.182 -1.063 -6.869 1.00 0.00 C ATOM 861 CG1 VAL A 61 11.254 -1.983 -6.306 1.00 0.00 C ATOM 862 CG2 VAL A 61 10.809 0.135 -7.567 1.00 0.00 C ATOM 0 H VAL A 61 7.497 -0.713 -7.692 1.00 0.00 H new ATOM 0 HA VAL A 61 9.852 -2.174 -8.689 1.00 0.00 H new ATOM 0 HB VAL A 61 9.579 -0.697 -6.038 1.00 0.00 H new ATOM 0 HG11 VAL A 61 11.893 -1.422 -5.624 1.00 0.00 H new ATOM 0 HG12 VAL A 61 10.782 -2.805 -5.768 1.00 0.00 H new ATOM 0 HG13 VAL A 61 11.857 -2.382 -7.122 1.00 0.00 H new ATOM 0 HG21 VAL A 61 11.455 0.667 -6.868 1.00 0.00 H new ATOM 0 HG22 VAL A 61 11.399 -0.207 -8.417 1.00 0.00 H new ATOM 0 HG23 VAL A 61 10.023 0.805 -7.916 1.00 0.00 H new ATOM 872 N SER A 62 9.140 -4.226 -7.479 1.00 0.00 N ATOM 873 CA SER A 62 8.656 -5.457 -6.867 1.00 0.00 C ATOM 874 C SER A 62 9.014 -5.504 -5.384 1.00 0.00 C ATOM 875 O SER A 62 10.190 -5.529 -5.018 1.00 0.00 O ATOM 876 CB SER A 62 9.244 -6.674 -7.584 1.00 0.00 C ATOM 877 OG SER A 62 10.658 -6.600 -7.638 1.00 0.00 O ATOM 0 H SER A 62 9.852 -4.363 -8.196 1.00 0.00 H new ATOM 0 HA SER A 62 7.570 -5.478 -6.962 1.00 0.00 H new ATOM 0 HB2 SER A 62 8.944 -7.585 -7.066 1.00 0.00 H new ATOM 0 HB3 SER A 62 8.841 -6.734 -8.595 1.00 0.00 H new ATOM 0 HG SER A 62 10.995 -6.178 -6.820 1.00 0.00 H new ATOM 883 N VAL A 63 7.992 -5.516 -4.535 1.00 0.00 N ATOM 884 CA VAL A 63 8.197 -5.561 -3.092 1.00 0.00 C ATOM 885 C VAL A 63 7.866 -6.939 -2.532 1.00 0.00 C ATOM 886 O VAL A 63 8.488 -7.396 -1.574 1.00 0.00 O ATOM 887 CB VAL A 63 7.338 -4.505 -2.370 1.00 0.00 C ATOM 888 CG1 VAL A 63 7.668 -3.110 -2.877 1.00 0.00 C ATOM 889 CG2 VAL A 63 5.859 -4.811 -2.548 1.00 0.00 C ATOM 0 H VAL A 63 7.013 -5.495 -4.821 1.00 0.00 H new ATOM 0 HA VAL A 63 9.251 -5.344 -2.915 1.00 0.00 H new ATOM 0 HB VAL A 63 7.567 -4.541 -1.305 1.00 0.00 H new ATOM 0 HG11 VAL A 63 7.051 -2.378 -2.355 1.00 0.00 H new ATOM 0 HG12 VAL A 63 8.721 -2.895 -2.692 1.00 0.00 H new ATOM 0 HG13 VAL A 63 7.469 -3.055 -3.947 1.00 0.00 H new ATOM 0 HG21 VAL A 63 5.266 -4.056 -2.032 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.611 -4.804 -3.609 1.00 0.00 H new ATOM 0 HG23 VAL A 63 5.638 -5.793 -2.130 1.00 0.00 H new ATOM 899 N GLU A 64 6.882 -7.597 -3.138 1.00 0.00 N ATOM 900 CA GLU A 64 6.468 -8.925 -2.699 1.00 0.00 C ATOM 901 C GLU A 64 7.678 -9.771 -2.310 1.00 0.00 C ATOM 902 O GLU A 64 7.650 -10.492 -1.314 1.00 0.00 O ATOM 903 CB GLU A 64 5.675 -9.627 -3.803 1.00 0.00 C ATOM 904 CG GLU A 64 4.179 -9.370 -3.734 1.00 0.00 C ATOM 905 CD GLU A 64 3.479 -10.264 -2.730 1.00 0.00 C ATOM 906 OE1 GLU A 64 3.344 -11.475 -3.006 1.00 0.00 O ATOM 907 OE2 GLU A 64 3.065 -9.754 -1.667 1.00 0.00 O ATOM 0 H GLU A 64 6.357 -7.233 -3.933 1.00 0.00 H new ATOM 0 HA GLU A 64 5.831 -8.808 -1.822 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.048 -9.297 -4.773 1.00 0.00 H new ATOM 0 HB3 GLU A 64 5.854 -10.700 -3.741 1.00 0.00 H new ATOM 0 HG2 GLU A 64 4.005 -8.327 -3.469 1.00 0.00 H new ATOM 0 HG3 GLU A 64 3.742 -9.526 -4.720 1.00 0.00 H new ATOM 914 N GLY A 65 8.739 -9.677 -3.106 1.00 0.00 N ATOM 915 CA GLY A 65 9.943 -10.439 -2.830 1.00 0.00 C ATOM 916 C GLY A 65 11.037 -9.591 -2.212 1.00 0.00 C ATOM 917 O GLY A 65 12.204 -9.704 -2.585 1.00 0.00 O ATOM 0 H GLY A 65 8.786 -9.087 -3.937 1.00 0.00 H new ATOM 0 HA2 GLY A 65 9.702 -11.262 -2.157 1.00 0.00 H new ATOM 0 HA3 GLY A 65 10.310 -10.881 -3.756 1.00 0.00 H new ATOM 921 N GLU A 66 10.658 -8.737 -1.265 1.00 0.00 N ATOM 922 CA GLU A 66 11.617 -7.865 -0.597 1.00 0.00 C ATOM 923 C GLU A 66 11.189 -7.588 0.841 1.00 0.00 C ATOM 924 O GLU A 66 10.019 -7.741 1.192 1.00 0.00 O ATOM 925 CB GLU A 66 11.759 -6.547 -1.361 1.00 0.00 C ATOM 926 CG GLU A 66 12.453 -6.694 -2.705 1.00 0.00 C ATOM 927 CD GLU A 66 13.774 -7.431 -2.602 1.00 0.00 C ATOM 928 OE1 GLU A 66 14.376 -7.420 -1.508 1.00 0.00 O ATOM 929 OE2 GLU A 66 14.205 -8.020 -3.616 1.00 0.00 O ATOM 0 H GLU A 66 9.696 -8.631 -0.944 1.00 0.00 H new ATOM 0 HA GLU A 66 12.581 -8.373 -0.580 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.769 -6.119 -1.518 1.00 0.00 H new ATOM 0 HB3 GLU A 66 12.318 -5.840 -0.748 1.00 0.00 H new ATOM 0 HG2 GLU A 66 11.796 -7.227 -3.392 1.00 0.00 H new ATOM 0 HG3 GLU A 66 12.625 -5.706 -3.131 1.00 0.00 H new ATOM 936 N GLN A 67 12.146 -7.180 1.669 1.00 0.00 N ATOM 937 CA GLN A 67 11.869 -6.883 3.069 1.00 0.00 C ATOM 938 C GLN A 67 10.778 -5.824 3.196 1.00 0.00 C ATOM 939 O GLN A 67 10.670 -4.926 2.360 1.00 0.00 O ATOM 940 CB GLN A 67 13.141 -6.407 3.773 1.00 0.00 C ATOM 941 CG GLN A 67 14.111 -7.531 4.101 1.00 0.00 C ATOM 942 CD GLN A 67 14.402 -8.417 2.906 1.00 0.00 C ATOM 943 OE1 GLN A 67 13.555 -9.203 2.480 1.00 0.00 O ATOM 944 NE2 GLN A 67 15.605 -8.295 2.357 1.00 0.00 N ATOM 0 H GLN A 67 13.119 -7.048 1.394 1.00 0.00 H new ATOM 0 HA GLN A 67 11.519 -7.799 3.545 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.645 -5.676 3.140 1.00 0.00 H new ATOM 0 HB3 GLN A 67 12.866 -5.895 4.695 1.00 0.00 H new ATOM 0 HG2 GLN A 67 15.044 -7.105 4.468 1.00 0.00 H new ATOM 0 HG3 GLN A 67 13.699 -8.138 4.907 1.00 0.00 H new ATOM 0 HE21 GLN A 67 16.276 -7.631 2.742 1.00 0.00 H new ATOM 0 HE22 GLN A 67 15.858 -8.865 1.550 1.00 0.00 H new ATOM 953 N HIS A 68 9.970 -5.937 4.245 1.00 0.00 N ATOM 954 CA HIS A 68 8.887 -4.989 4.481 1.00 0.00 C ATOM 955 C HIS A 68 9.398 -3.553 4.419 1.00 0.00 C ATOM 956 O HIS A 68 8.823 -2.709 3.733 1.00 0.00 O ATOM 957 CB HIS A 68 8.237 -5.253 5.840 1.00 0.00 C ATOM 958 CG HIS A 68 7.275 -4.185 6.261 1.00 0.00 C ATOM 959 ND1 HIS A 68 6.860 -4.017 7.565 1.00 0.00 N ATOM 960 CD2 HIS A 68 6.646 -3.226 5.542 1.00 0.00 C ATOM 961 CE1 HIS A 68 6.017 -3.002 7.630 1.00 0.00 C ATOM 962 NE2 HIS A 68 5.870 -2.504 6.415 1.00 0.00 N ATOM 0 H HIS A 68 10.045 -6.675 4.945 1.00 0.00 H new ATOM 0 HA HIS A 68 8.142 -5.125 3.697 1.00 0.00 H new ATOM 0 HB2 HIS A 68 7.714 -6.208 5.804 1.00 0.00 H new ATOM 0 HB3 HIS A 68 9.018 -5.346 6.595 1.00 0.00 H new ATOM 0 HD1 HIS A 68 7.158 -4.588 8.356 1.00 0.00 H new ATOM 0 HD2 HIS A 68 6.738 -3.060 4.479 1.00 0.00 H new ATOM 0 HE1 HIS A 68 5.531 -2.641 8.524 1.00 0.00 H new ATOM 970 N GLU A 69 10.482 -3.284 5.141 1.00 0.00 N ATOM 971 CA GLU A 69 11.069 -1.949 5.169 1.00 0.00 C ATOM 972 C GLU A 69 11.133 -1.354 3.765 1.00 0.00 C ATOM 973 O GLU A 69 10.648 -0.248 3.524 1.00 0.00 O ATOM 974 CB GLU A 69 12.471 -1.997 5.779 1.00 0.00 C ATOM 975 CG GLU A 69 12.472 -2.097 7.295 1.00 0.00 C ATOM 976 CD GLU A 69 11.666 -0.995 7.953 1.00 0.00 C ATOM 977 OE1 GLU A 69 12.229 0.095 8.185 1.00 0.00 O ATOM 978 OE2 GLU A 69 10.471 -1.223 8.236 1.00 0.00 O ATOM 0 H GLU A 69 10.971 -3.972 5.714 1.00 0.00 H new ATOM 0 HA GLU A 69 10.434 -1.313 5.786 1.00 0.00 H new ATOM 0 HB2 GLU A 69 13.008 -2.851 5.367 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.018 -1.102 5.482 1.00 0.00 H new ATOM 0 HG2 GLU A 69 12.067 -3.065 7.592 1.00 0.00 H new ATOM 0 HG3 GLU A 69 13.499 -2.056 7.657 1.00 0.00 H new ATOM 985 N LYS A 70 11.734 -2.096 2.841 1.00 0.00 N ATOM 986 CA LYS A 70 11.863 -1.644 1.461 1.00 0.00 C ATOM 987 C LYS A 70 10.628 -0.860 1.028 1.00 0.00 C ATOM 988 O LYS A 70 10.736 0.164 0.355 1.00 0.00 O ATOM 989 CB LYS A 70 12.074 -2.840 0.529 1.00 0.00 C ATOM 990 CG LYS A 70 12.013 -2.480 -0.945 1.00 0.00 C ATOM 991 CD LYS A 70 13.235 -1.686 -1.376 1.00 0.00 C ATOM 992 CE LYS A 70 14.388 -2.602 -1.758 1.00 0.00 C ATOM 993 NZ LYS A 70 14.104 -3.358 -3.009 1.00 0.00 N ATOM 0 H LYS A 70 12.140 -3.014 3.023 1.00 0.00 H new ATOM 0 HA LYS A 70 12.730 -0.986 1.399 1.00 0.00 H new ATOM 0 HB2 LYS A 70 13.042 -3.291 0.744 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.316 -3.594 0.742 1.00 0.00 H new ATOM 0 HG2 LYS A 70 11.941 -3.390 -1.540 1.00 0.00 H new ATOM 0 HG3 LYS A 70 11.112 -1.899 -1.142 1.00 0.00 H new ATOM 0 HD2 LYS A 70 12.977 -1.051 -2.223 1.00 0.00 H new ATOM 0 HD3 LYS A 70 13.546 -1.026 -0.566 1.00 0.00 H new ATOM 0 HE2 LYS A 70 15.294 -2.010 -1.889 1.00 0.00 H new ATOM 0 HE3 LYS A 70 14.580 -3.303 -0.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 14.262 -4.373 -2.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 13.115 -3.203 -3.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 14.736 -3.027 -3.766 1.00 0.00 H new ATOM 1007 N ALA A 71 9.455 -1.348 1.420 1.00 0.00 N ATOM 1008 CA ALA A 71 8.201 -0.691 1.075 1.00 0.00 C ATOM 1009 C ALA A 71 8.135 0.712 1.667 1.00 0.00 C ATOM 1010 O ALA A 71 7.885 1.686 0.956 1.00 0.00 O ATOM 1011 CB ALA A 71 7.020 -1.524 1.554 1.00 0.00 C ATOM 0 H ALA A 71 9.348 -2.196 1.977 1.00 0.00 H new ATOM 0 HA ALA A 71 8.153 -0.601 -0.010 1.00 0.00 H new ATOM 0 HB1 ALA A 71 6.089 -1.022 1.290 1.00 0.00 H new ATOM 0 HB2 ALA A 71 7.050 -2.505 1.079 1.00 0.00 H new ATOM 0 HB3 ALA A 71 7.074 -1.643 2.636 1.00 0.00 H new ATOM 1017 N VAL A 72 8.361 0.810 2.974 1.00 0.00 N ATOM 1018 CA VAL A 72 8.328 2.095 3.661 1.00 0.00 C ATOM 1019 C VAL A 72 9.348 3.061 3.069 1.00 0.00 C ATOM 1020 O VAL A 72 8.985 4.095 2.510 1.00 0.00 O ATOM 1021 CB VAL A 72 8.605 1.933 5.168 1.00 0.00 C ATOM 1022 CG1 VAL A 72 8.632 3.289 5.855 1.00 0.00 C ATOM 1023 CG2 VAL A 72 7.565 1.024 5.805 1.00 0.00 C ATOM 0 H VAL A 72 8.569 0.014 3.578 1.00 0.00 H new ATOM 0 HA VAL A 72 7.326 2.501 3.525 1.00 0.00 H new ATOM 0 HB VAL A 72 9.584 1.471 5.292 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.829 3.154 6.919 1.00 0.00 H new ATOM 0 HG12 VAL A 72 9.417 3.904 5.416 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.669 3.782 5.724 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.775 0.920 6.869 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.573 1.456 5.672 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.600 0.043 5.331 1.00 0.00 H new ATOM 1033 N GLU A 73 10.625 2.717 3.197 1.00 0.00 N ATOM 1034 CA GLU A 73 11.698 3.555 2.675 1.00 0.00 C ATOM 1035 C GLU A 73 11.351 4.079 1.284 1.00 0.00 C ATOM 1036 O GLU A 73 11.588 5.246 0.971 1.00 0.00 O ATOM 1037 CB GLU A 73 13.010 2.769 2.623 1.00 0.00 C ATOM 1038 CG GLU A 73 12.926 1.498 1.795 1.00 0.00 C ATOM 1039 CD GLU A 73 14.286 0.882 1.531 1.00 0.00 C ATOM 1040 OE1 GLU A 73 14.913 0.392 2.493 1.00 0.00 O ATOM 1041 OE2 GLU A 73 14.723 0.890 0.361 1.00 0.00 O ATOM 0 H GLU A 73 10.942 1.864 3.658 1.00 0.00 H new ATOM 0 HA GLU A 73 11.819 4.406 3.346 1.00 0.00 H new ATOM 0 HB2 GLU A 73 13.791 3.409 2.212 1.00 0.00 H new ATOM 0 HB3 GLU A 73 13.310 2.512 3.639 1.00 0.00 H new ATOM 0 HG2 GLU A 73 12.297 0.773 2.312 1.00 0.00 H new ATOM 0 HG3 GLU A 73 12.441 1.720 0.844 1.00 0.00 H new ATOM 1048 N LEU A 74 10.788 3.208 0.454 1.00 0.00 N ATOM 1049 CA LEU A 74 10.408 3.581 -0.904 1.00 0.00 C ATOM 1050 C LEU A 74 9.459 4.775 -0.895 1.00 0.00 C ATOM 1051 O LEU A 74 9.710 5.786 -1.554 1.00 0.00 O ATOM 1052 CB LEU A 74 9.749 2.397 -1.614 1.00 0.00 C ATOM 1053 CG LEU A 74 10.699 1.390 -2.263 1.00 0.00 C ATOM 1054 CD1 LEU A 74 9.938 0.154 -2.718 1.00 0.00 C ATOM 1055 CD2 LEU A 74 11.433 2.027 -3.434 1.00 0.00 C ATOM 0 H LEU A 74 10.585 2.239 0.698 1.00 0.00 H new ATOM 0 HA LEU A 74 11.312 3.863 -1.443 1.00 0.00 H new ATOM 0 HB2 LEU A 74 9.127 1.867 -0.893 1.00 0.00 H new ATOM 0 HB3 LEU A 74 9.083 2.786 -2.384 1.00 0.00 H new ATOM 0 HG LEU A 74 11.436 1.085 -1.520 1.00 0.00 H new ATOM 0 HD11 LEU A 74 10.631 -0.551 -3.177 1.00 0.00 H new ATOM 0 HD12 LEU A 74 9.459 -0.315 -1.859 1.00 0.00 H new ATOM 0 HD13 LEU A 74 9.178 0.442 -3.445 1.00 0.00 H new ATOM 0 HD21 LEU A 74 12.105 1.296 -3.884 1.00 0.00 H new ATOM 0 HD22 LEU A 74 10.710 2.361 -4.178 1.00 0.00 H new ATOM 0 HD23 LEU A 74 12.011 2.881 -3.080 1.00 0.00 H new ATOM 1067 N LEU A 75 8.371 4.654 -0.144 1.00 0.00 N ATOM 1068 CA LEU A 75 7.385 5.725 -0.047 1.00 0.00 C ATOM 1069 C LEU A 75 8.055 7.053 0.292 1.00 0.00 C ATOM 1070 O LEU A 75 7.873 8.049 -0.409 1.00 0.00 O ATOM 1071 CB LEU A 75 6.336 5.384 1.013 1.00 0.00 C ATOM 1072 CG LEU A 75 5.318 4.310 0.629 1.00 0.00 C ATOM 1073 CD1 LEU A 75 4.852 3.551 1.862 1.00 0.00 C ATOM 1074 CD2 LEU A 75 4.133 4.932 -0.096 1.00 0.00 C ATOM 0 H LEU A 75 8.149 3.825 0.407 1.00 0.00 H new ATOM 0 HA LEU A 75 6.895 5.824 -1.016 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.853 5.060 1.916 1.00 0.00 H new ATOM 0 HB3 LEU A 75 5.795 6.296 1.266 1.00 0.00 H new ATOM 0 HG LEU A 75 5.801 3.604 -0.046 1.00 0.00 H new ATOM 0 HD11 LEU A 75 4.128 2.791 1.569 1.00 0.00 H new ATOM 0 HD12 LEU A 75 5.707 3.073 2.340 1.00 0.00 H new ATOM 0 HD13 LEU A 75 4.387 4.245 2.562 1.00 0.00 H new ATOM 0 HD21 LEU A 75 3.419 4.152 -0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 75 3.650 5.660 0.555 1.00 0.00 H new ATOM 0 HD23 LEU A 75 4.481 5.429 -1.002 1.00 0.00 H new ATOM 1086 N LYS A 76 8.831 7.059 1.370 1.00 0.00 N ATOM 1087 CA LYS A 76 9.532 8.263 1.801 1.00 0.00 C ATOM 1088 C LYS A 76 10.492 8.750 0.720 1.00 0.00 C ATOM 1089 O LYS A 76 10.596 9.950 0.464 1.00 0.00 O ATOM 1090 CB LYS A 76 10.301 7.994 3.097 1.00 0.00 C ATOM 1091 CG LYS A 76 9.424 7.489 4.230 1.00 0.00 C ATOM 1092 CD LYS A 76 10.202 6.594 5.180 1.00 0.00 C ATOM 1093 CE LYS A 76 11.008 7.409 6.180 1.00 0.00 C ATOM 1094 NZ LYS A 76 12.236 6.690 6.620 1.00 0.00 N ATOM 0 H LYS A 76 8.991 6.244 1.962 1.00 0.00 H new ATOM 0 HA LYS A 76 8.790 9.041 1.981 1.00 0.00 H new ATOM 0 HB2 LYS A 76 11.084 7.261 2.900 1.00 0.00 H new ATOM 0 HB3 LYS A 76 10.796 8.912 3.413 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.015 8.336 4.780 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.579 6.937 3.819 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.511 5.941 5.714 1.00 0.00 H new ATOM 0 HD3 LYS A 76 10.872 5.951 4.609 1.00 0.00 H new ATOM 0 HE2 LYS A 76 11.287 8.362 5.731 1.00 0.00 H new ATOM 0 HE3 LYS A 76 10.388 7.634 7.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 12.758 7.278 7.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 11.969 5.792 7.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 12.840 6.497 5.795 1.00 0.00 H new ATOM 1108 N ALA A 77 11.190 7.813 0.089 1.00 0.00 N ATOM 1109 CA ALA A 77 12.138 8.147 -0.967 1.00 0.00 C ATOM 1110 C ALA A 77 11.433 8.795 -2.154 1.00 0.00 C ATOM 1111 O ALA A 77 11.947 9.738 -2.754 1.00 0.00 O ATOM 1112 CB ALA A 77 12.892 6.903 -1.413 1.00 0.00 C ATOM 0 H ALA A 77 11.117 6.816 0.290 1.00 0.00 H new ATOM 0 HA ALA A 77 12.852 8.866 -0.565 1.00 0.00 H new ATOM 0 HB1 ALA A 77 13.596 7.168 -2.202 1.00 0.00 H new ATOM 0 HB2 ALA A 77 13.436 6.484 -0.566 1.00 0.00 H new ATOM 0 HB3 ALA A 77 12.185 6.165 -1.791 1.00 0.00 H new ATOM 1118 N ALA A 78 10.253 8.282 -2.487 1.00 0.00 N ATOM 1119 CA ALA A 78 9.477 8.811 -3.601 1.00 0.00 C ATOM 1120 C ALA A 78 9.211 10.302 -3.425 1.00 0.00 C ATOM 1121 O ALA A 78 9.473 10.867 -2.364 1.00 0.00 O ATOM 1122 CB ALA A 78 8.165 8.052 -3.739 1.00 0.00 C ATOM 0 H ALA A 78 9.814 7.500 -2.001 1.00 0.00 H new ATOM 0 HA ALA A 78 10.059 8.677 -4.513 1.00 0.00 H new ATOM 0 HB1 ALA A 78 7.596 8.458 -4.575 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.372 6.997 -3.919 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.586 8.156 -2.821 1.00 0.00 H new ATOM 1128 N GLN A 79 8.689 10.933 -4.472 1.00 0.00 N ATOM 1129 CA GLN A 79 8.390 12.360 -4.432 1.00 0.00 C ATOM 1130 C GLN A 79 7.217 12.695 -5.348 1.00 0.00 C ATOM 1131 O GLN A 79 7.007 12.042 -6.369 1.00 0.00 O ATOM 1132 CB GLN A 79 9.620 13.172 -4.840 1.00 0.00 C ATOM 1133 CG GLN A 79 9.866 13.193 -6.340 1.00 0.00 C ATOM 1134 CD GLN A 79 10.747 14.348 -6.772 1.00 0.00 C ATOM 1135 OE1 GLN A 79 11.814 14.147 -7.353 1.00 0.00 O ATOM 1136 NE2 GLN A 79 10.305 15.568 -6.489 1.00 0.00 N ATOM 0 H GLN A 79 8.465 10.479 -5.358 1.00 0.00 H new ATOM 0 HA GLN A 79 8.115 12.620 -3.410 1.00 0.00 H new ATOM 0 HB2 GLN A 79 9.503 14.196 -4.485 1.00 0.00 H new ATOM 0 HB3 GLN A 79 10.498 12.761 -4.342 1.00 0.00 H new ATOM 0 HG2 GLN A 79 10.331 12.254 -6.641 1.00 0.00 H new ATOM 0 HG3 GLN A 79 8.910 13.256 -6.860 1.00 0.00 H new ATOM 0 HE21 GLN A 79 9.415 15.689 -6.006 1.00 0.00 H new ATOM 0 HE22 GLN A 79 10.856 16.384 -6.755 1.00 0.00 H new ATOM 1145 N GLY A 80 6.456 13.720 -4.975 1.00 0.00 N ATOM 1146 CA GLY A 80 5.313 14.124 -5.774 1.00 0.00 C ATOM 1147 C GLY A 80 4.129 13.193 -5.604 1.00 0.00 C ATOM 1148 O GLY A 80 3.055 13.616 -5.177 1.00 0.00 O ATOM 0 H GLY A 80 6.610 14.277 -4.135 1.00 0.00 H new ATOM 0 HA2 GLY A 80 5.019 15.136 -5.496 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.600 14.153 -6.825 1.00 0.00 H new ATOM 1152 N SER A 81 4.324 11.922 -5.941 1.00 0.00 N ATOM 1153 CA SER A 81 3.261 10.930 -5.829 1.00 0.00 C ATOM 1154 C SER A 81 3.832 9.516 -5.862 1.00 0.00 C ATOM 1155 O SER A 81 4.900 9.278 -6.427 1.00 0.00 O ATOM 1156 CB SER A 81 2.246 11.109 -6.960 1.00 0.00 C ATOM 1157 OG SER A 81 1.299 12.114 -6.641 1.00 0.00 O ATOM 0 H SER A 81 5.208 11.555 -6.294 1.00 0.00 H new ATOM 0 HA SER A 81 2.759 11.078 -4.873 1.00 0.00 H new ATOM 0 HB2 SER A 81 2.766 11.374 -7.881 1.00 0.00 H new ATOM 0 HB3 SER A 81 1.732 10.166 -7.144 1.00 0.00 H new ATOM 0 HG SER A 81 1.725 12.801 -6.087 1.00 0.00 H new ATOM 1163 N VAL A 82 3.113 8.579 -5.252 1.00 0.00 N ATOM 1164 CA VAL A 82 3.546 7.188 -5.212 1.00 0.00 C ATOM 1165 C VAL A 82 2.448 6.256 -5.712 1.00 0.00 C ATOM 1166 O VAL A 82 1.272 6.439 -5.398 1.00 0.00 O ATOM 1167 CB VAL A 82 3.951 6.767 -3.787 1.00 0.00 C ATOM 1168 CG1 VAL A 82 5.213 7.497 -3.353 1.00 0.00 C ATOM 1169 CG2 VAL A 82 2.813 7.027 -2.811 1.00 0.00 C ATOM 0 H VAL A 82 2.228 8.759 -4.779 1.00 0.00 H new ATOM 0 HA VAL A 82 4.413 7.108 -5.867 1.00 0.00 H new ATOM 0 HB VAL A 82 4.161 5.697 -3.789 1.00 0.00 H new ATOM 0 HG11 VAL A 82 5.484 7.187 -2.344 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.026 7.256 -4.037 1.00 0.00 H new ATOM 0 HG13 VAL A 82 5.034 8.572 -3.366 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.117 6.724 -1.809 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.570 8.090 -2.810 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.936 6.454 -3.113 1.00 0.00 H new ATOM 1179 N LYS A 83 2.840 5.254 -6.493 1.00 0.00 N ATOM 1180 CA LYS A 83 1.891 4.291 -7.036 1.00 0.00 C ATOM 1181 C LYS A 83 1.990 2.957 -6.303 1.00 0.00 C ATOM 1182 O LYS A 83 2.955 2.211 -6.478 1.00 0.00 O ATOM 1183 CB LYS A 83 2.143 4.083 -8.531 1.00 0.00 C ATOM 1184 CG LYS A 83 1.409 5.077 -9.415 1.00 0.00 C ATOM 1185 CD LYS A 83 1.958 5.074 -10.832 1.00 0.00 C ATOM 1186 CE LYS A 83 1.238 4.058 -11.707 1.00 0.00 C ATOM 1187 NZ LYS A 83 1.761 2.679 -11.500 1.00 0.00 N ATOM 0 H LYS A 83 3.809 5.089 -6.764 1.00 0.00 H new ATOM 0 HA LYS A 83 0.886 4.690 -6.895 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.213 4.158 -8.725 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.840 3.073 -8.805 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.347 4.833 -9.435 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.498 6.077 -8.991 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.853 6.068 -11.266 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.024 4.846 -10.810 1.00 0.00 H new ATOM 0 HE2 LYS A 83 0.171 4.079 -11.485 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.351 4.336 -12.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.524 2.091 -12.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.794 2.713 -11.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.330 2.269 -10.647 1.00 0.00 H new ATOM 1201 N LEU A 84 0.987 2.661 -5.484 1.00 0.00 N ATOM 1202 CA LEU A 84 0.960 1.415 -4.726 1.00 0.00 C ATOM 1203 C LEU A 84 0.079 0.377 -5.414 1.00 0.00 C ATOM 1204 O LEU A 84 -1.142 0.525 -5.473 1.00 0.00 O ATOM 1205 CB LEU A 84 0.453 1.670 -3.306 1.00 0.00 C ATOM 1206 CG LEU A 84 1.194 2.746 -2.511 1.00 0.00 C ATOM 1207 CD1 LEU A 84 0.258 3.419 -1.520 1.00 0.00 C ATOM 1208 CD2 LEU A 84 2.393 2.146 -1.791 1.00 0.00 C ATOM 0 H LEU A 84 0.181 3.267 -5.328 1.00 0.00 H new ATOM 0 HA LEU A 84 1.977 1.026 -4.678 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.599 1.948 -3.362 1.00 0.00 H new ATOM 0 HB3 LEU A 84 0.506 0.734 -2.749 1.00 0.00 H new ATOM 0 HG LEU A 84 1.554 3.502 -3.209 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.804 4.181 -0.964 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.568 3.884 -2.058 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.134 2.675 -0.826 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.908 2.926 -1.230 1.00 0.00 H new ATOM 0 HD22 LEU A 84 2.054 1.370 -1.105 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.076 1.712 -2.521 1.00 0.00 H new ATOM 1220 N VAL A 85 0.705 -0.674 -5.931 1.00 0.00 N ATOM 1221 CA VAL A 85 -0.022 -1.739 -6.612 1.00 0.00 C ATOM 1222 C VAL A 85 -0.507 -2.793 -5.623 1.00 0.00 C ATOM 1223 O VAL A 85 0.259 -3.278 -4.791 1.00 0.00 O ATOM 1224 CB VAL A 85 0.852 -2.419 -7.683 1.00 0.00 C ATOM 1225 CG1 VAL A 85 0.101 -3.573 -8.331 1.00 0.00 C ATOM 1226 CG2 VAL A 85 1.296 -1.408 -8.729 1.00 0.00 C ATOM 0 H VAL A 85 1.715 -0.812 -5.892 1.00 0.00 H new ATOM 0 HA VAL A 85 -0.882 -1.276 -7.096 1.00 0.00 H new ATOM 0 HB VAL A 85 1.742 -2.821 -7.199 1.00 0.00 H new ATOM 0 HG11 VAL A 85 0.734 -4.041 -9.085 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.162 -4.308 -7.571 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.807 -3.197 -8.802 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.912 -1.906 -9.478 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.420 -0.974 -9.211 1.00 0.00 H new ATOM 0 HG23 VAL A 85 1.875 -0.618 -8.249 1.00 0.00 H new ATOM 1236 N VAL A 86 -1.785 -3.144 -5.721 1.00 0.00 N ATOM 1237 CA VAL A 86 -2.374 -4.142 -4.836 1.00 0.00 C ATOM 1238 C VAL A 86 -3.032 -5.263 -5.632 1.00 0.00 C ATOM 1239 O VAL A 86 -3.334 -5.104 -6.815 1.00 0.00 O ATOM 1240 CB VAL A 86 -3.420 -3.513 -3.896 1.00 0.00 C ATOM 1241 CG1 VAL A 86 -2.773 -2.464 -3.004 1.00 0.00 C ATOM 1242 CG2 VAL A 86 -4.563 -2.910 -4.699 1.00 0.00 C ATOM 0 H VAL A 86 -2.433 -2.752 -6.405 1.00 0.00 H new ATOM 0 HA VAL A 86 -1.560 -4.553 -4.239 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.828 -4.297 -3.258 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.527 -2.030 -2.347 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -1.992 -2.929 -2.403 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -2.336 -1.680 -3.622 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -5.293 -2.470 -4.019 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -4.174 -2.138 -5.363 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -5.043 -3.689 -5.291 1.00 0.00 H new ATOM 1252 N ARG A 87 -3.252 -6.398 -4.976 1.00 0.00 N ATOM 1253 CA ARG A 87 -3.874 -7.546 -5.623 1.00 0.00 C ATOM 1254 C ARG A 87 -5.294 -7.759 -5.106 1.00 0.00 C ATOM 1255 O ARG A 87 -5.499 -8.054 -3.929 1.00 0.00 O ATOM 1256 CB ARG A 87 -3.039 -8.806 -5.385 1.00 0.00 C ATOM 1257 CG ARG A 87 -3.170 -9.841 -6.491 1.00 0.00 C ATOM 1258 CD ARG A 87 -4.445 -10.656 -6.343 1.00 0.00 C ATOM 1259 NE ARG A 87 -4.340 -11.648 -5.276 1.00 0.00 N ATOM 1260 CZ ARG A 87 -5.388 -12.265 -4.742 1.00 0.00 C ATOM 1261 NH1 ARG A 87 -6.612 -11.995 -5.173 1.00 0.00 N ATOM 1262 NH2 ARG A 87 -5.212 -13.156 -3.774 1.00 0.00 N ATOM 0 H ARG A 87 -3.008 -6.547 -3.997 1.00 0.00 H new ATOM 0 HA ARG A 87 -3.922 -7.346 -6.693 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -1.991 -8.524 -5.285 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -3.339 -9.257 -4.439 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -3.166 -9.342 -7.460 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -2.307 -10.507 -6.472 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -5.280 -9.987 -6.135 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -4.665 -11.159 -7.285 1.00 0.00 H new ATOM 0 HE ARG A 87 -3.412 -11.879 -4.922 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -6.751 -11.311 -5.917 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -7.414 -12.471 -4.761 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -4.272 -13.367 -3.440 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -6.017 -13.630 -3.364 1.00 0.00 H new ATOM 1276 N SER A 88 -6.270 -7.605 -5.995 1.00 0.00 N ATOM 1277 CA SER A 88 -7.671 -7.776 -5.628 1.00 0.00 C ATOM 1278 C SER A 88 -8.339 -8.828 -6.508 1.00 0.00 C ATOM 1279 O SER A 88 -7.804 -9.217 -7.545 1.00 0.00 O ATOM 1280 CB SER A 88 -8.418 -6.445 -5.748 1.00 0.00 C ATOM 1281 OG SER A 88 -7.818 -5.449 -4.939 1.00 0.00 O ATOM 0 H SER A 88 -6.117 -7.362 -6.974 1.00 0.00 H new ATOM 0 HA SER A 88 -7.711 -8.115 -4.593 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.422 -6.119 -6.788 1.00 0.00 H new ATOM 0 HB3 SER A 88 -9.458 -6.580 -5.452 1.00 0.00 H new ATOM 0 HG SER A 88 -8.312 -4.608 -5.035 1.00 0.00 H new ATOM 1287 N GLY A 89 -9.514 -9.285 -6.085 1.00 0.00 N ATOM 1288 CA GLY A 89 -10.237 -10.288 -6.845 1.00 0.00 C ATOM 1289 C GLY A 89 -11.230 -11.056 -5.995 1.00 0.00 C ATOM 1290 O GLY A 89 -11.079 -11.171 -4.778 1.00 0.00 O ATOM 0 H GLY A 89 -9.978 -8.979 -5.230 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -10.765 -9.805 -7.668 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -9.526 -10.986 -7.288 1.00 0.00 H new ATOM 1294 N PRO A 90 -12.274 -11.596 -6.640 1.00 0.00 N ATOM 1295 CA PRO A 90 -13.317 -12.365 -5.954 1.00 0.00 C ATOM 1296 C PRO A 90 -12.807 -13.710 -5.449 1.00 0.00 C ATOM 1297 O PRO A 90 -11.978 -14.353 -6.094 1.00 0.00 O ATOM 1298 CB PRO A 90 -14.379 -12.568 -7.038 1.00 0.00 C ATOM 1299 CG PRO A 90 -13.630 -12.483 -8.323 1.00 0.00 C ATOM 1300 CD PRO A 90 -12.517 -11.498 -8.089 1.00 0.00 C ATOM 0 HA PRO A 90 -13.687 -11.850 -5.067 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.874 -13.533 -6.931 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -15.154 -11.804 -6.980 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -13.235 -13.458 -8.610 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -14.280 -12.152 -9.133 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -11.627 -11.753 -8.664 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -12.806 -10.488 -8.381 1.00 0.00 H new ATOM 1308 N SER A 91 -13.309 -14.132 -4.293 1.00 0.00 N ATOM 1309 CA SER A 91 -12.902 -15.400 -3.700 1.00 0.00 C ATOM 1310 C SER A 91 -13.464 -16.576 -4.493 1.00 0.00 C ATOM 1311 O SER A 91 -14.666 -16.839 -4.466 1.00 0.00 O ATOM 1312 CB SER A 91 -13.370 -15.481 -2.245 1.00 0.00 C ATOM 1313 OG SER A 91 -12.621 -14.607 -1.419 1.00 0.00 O ATOM 0 H SER A 91 -13.999 -13.614 -3.748 1.00 0.00 H new ATOM 0 HA SER A 91 -11.814 -15.453 -3.727 1.00 0.00 H new ATOM 0 HB2 SER A 91 -14.428 -15.225 -2.185 1.00 0.00 H new ATOM 0 HB3 SER A 91 -13.268 -16.504 -1.883 1.00 0.00 H new ATOM 0 HG SER A 91 -12.940 -14.676 -0.495 1.00 0.00 H new ATOM 1319 N SER A 92 -12.584 -17.280 -5.198 1.00 0.00 N ATOM 1320 CA SER A 92 -12.992 -18.426 -6.003 1.00 0.00 C ATOM 1321 C SER A 92 -13.695 -19.471 -5.142 1.00 0.00 C ATOM 1322 O SER A 92 -14.860 -19.796 -5.368 1.00 0.00 O ATOM 1323 CB SER A 92 -11.777 -19.050 -6.692 1.00 0.00 C ATOM 1324 OG SER A 92 -11.252 -18.184 -7.683 1.00 0.00 O ATOM 0 H SER A 92 -11.585 -17.077 -5.228 1.00 0.00 H new ATOM 0 HA SER A 92 -13.691 -18.076 -6.762 1.00 0.00 H new ATOM 0 HB2 SER A 92 -11.008 -19.269 -5.951 1.00 0.00 H new ATOM 0 HB3 SER A 92 -12.061 -19.999 -7.147 1.00 0.00 H new ATOM 0 HG SER A 92 -10.475 -18.605 -8.107 1.00 0.00 H new ATOM 1330 N GLY A 93 -12.977 -19.995 -4.154 1.00 0.00 N ATOM 1331 CA GLY A 93 -13.547 -20.998 -3.274 1.00 0.00 C ATOM 1332 C GLY A 93 -12.492 -21.890 -2.650 1.00 0.00 C ATOM 1333 O GLY A 93 -11.910 -21.548 -1.621 1.00 0.00 O ATOM 0 H GLY A 93 -12.011 -19.743 -3.947 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -14.114 -20.504 -2.485 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -14.251 -21.612 -3.836 1.00 0.00 H new TER 1337 GLY A 93