USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 943 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 111 THR OG1 : rot 171:sc= 0.88 USER MOD Set 1.2: A 134 THR OG1 : rot 130:sc= 0.986 USER MOD Set 2.1: A 103 LYS NZ :NH3+ 141:sc= 1.28 (180deg=0.833) USER MOD Set 2.2: A 104 THR OG1 : rot 180:sc= 0.394 USER MOD Single : A 12 THR OG1 : rot 44:sc= 0.0862 USER MOD Single : A 15 GLN : amide:sc= -0.0245 X(o=-0.024,f=-0.18) USER MOD Single : A 17 GLN : amide:sc= -0.0849 X(o=-0.085,f=0) USER MOD Single : A 20 SER OG : rot 39:sc= 0.0443 USER MOD Single : A 44 SER OG : rot -125:sc= 1.19 USER MOD Single : A 51 THR OG1 : rot 63:sc= 1.14 USER MOD Single : A 55 SER OG : rot 49:sc= 0.859 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot -141:sc= 1.22 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= 0.0336 K(o=0.034,f=-0.47) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot -92:sc= 1.18 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -160:sc= 0.304 USER MOD Single : A 105 ASN : amide:sc= -1.19 X(o=-1.2,f=-1.3) USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.0453 USER MOD Single : A 112 TYR OH : rot 30:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 164:sc= 1.23 (180deg=1.15) USER MOD Single : A 115 SER OG : rot 154:sc= 0.749 USER MOD Single : A 133 HIS : no HE2:sc= 0.157 K(o=0.16,f=-0.59) USER MOD Single : A 138 SER OG : rot 3:sc= 0.399 USER MOD Single : A 141 ASN : amide:sc= 0.402 K(o=0.4,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -19.692 4.009 -0.449 1.00 0.00 N ATOM 32 CA GLY A 4 -19.214 5.049 0.456 1.00 0.00 C ATOM 33 C GLY A 4 -19.447 6.423 -0.143 1.00 0.00 C ATOM 34 O GLY A 4 -19.354 6.612 -1.359 1.00 0.00 O ATOM 0 HA2 GLY A 4 -19.729 4.971 1.413 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -18.151 4.907 0.653 1.00 0.00 H new ATOM 38 N GLU A 5 -19.802 7.375 0.703 1.00 0.00 N ATOM 39 CA GLU A 5 -20.077 8.756 0.322 1.00 0.00 C ATOM 40 C GLU A 5 -18.756 9.461 0.000 1.00 0.00 C ATOM 41 O GLU A 5 -17.799 9.255 0.739 1.00 0.00 O ATOM 42 CB GLU A 5 -20.798 9.409 1.505 1.00 0.00 C ATOM 43 CG GLU A 5 -21.335 10.804 1.199 1.00 0.00 C ATOM 44 CD GLU A 5 -22.370 11.187 2.250 1.00 0.00 C ATOM 45 OE1 GLU A 5 -22.011 11.489 3.405 1.00 0.00 O ATOM 46 OE2 GLU A 5 -23.591 11.127 1.944 1.00 0.00 O ATOM 0 H GLU A 5 -19.911 7.207 1.703 1.00 0.00 H new ATOM 0 HA GLU A 5 -20.704 8.821 -0.567 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -21.625 8.770 1.813 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -20.111 9.470 2.349 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -20.520 11.527 1.195 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -21.784 10.824 0.206 1.00 0.00 H new ATOM 53 N PRO A 6 -18.627 10.238 -1.083 1.00 0.00 N ATOM 54 CA PRO A 6 -17.373 10.916 -1.374 1.00 0.00 C ATOM 55 C PRO A 6 -17.181 12.086 -0.405 1.00 0.00 C ATOM 56 O PRO A 6 -18.141 12.738 0.011 1.00 0.00 O ATOM 57 CB PRO A 6 -17.508 11.393 -2.819 1.00 0.00 C ATOM 58 CG PRO A 6 -19.010 11.638 -2.960 1.00 0.00 C ATOM 59 CD PRO A 6 -19.643 10.578 -2.061 1.00 0.00 C ATOM 0 HA PRO A 6 -16.502 10.272 -1.255 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -16.932 12.301 -3.000 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -17.153 10.644 -3.526 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -19.282 12.645 -2.643 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -19.337 11.531 -3.994 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -20.541 10.961 -1.576 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -19.941 9.702 -2.638 1.00 0.00 H new ATOM 67 N LEU A 7 -15.933 12.367 -0.051 1.00 0.00 N ATOM 68 CA LEU A 7 -15.482 13.419 0.817 1.00 0.00 C ATOM 69 C LEU A 7 -14.459 14.137 -0.054 1.00 0.00 C ATOM 70 O LEU A 7 -13.842 13.546 -0.948 1.00 0.00 O ATOM 71 CB LEU A 7 -14.900 12.839 2.124 1.00 0.00 C ATOM 72 CG LEU A 7 -15.304 13.574 3.413 1.00 0.00 C ATOM 73 CD1 LEU A 7 -14.922 15.058 3.399 1.00 0.00 C ATOM 74 CD2 LEU A 7 -16.804 13.397 3.694 1.00 0.00 C ATOM 0 H LEU A 7 -15.153 11.810 -0.400 1.00 0.00 H new ATOM 0 HA LEU A 7 -16.262 14.095 1.167 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -15.210 11.797 2.208 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -13.813 12.843 2.050 1.00 0.00 H new ATOM 0 HG LEU A 7 -14.737 13.116 4.224 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -15.233 15.523 4.335 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -13.842 15.155 3.287 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -15.419 15.554 2.565 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -17.067 13.925 4.610 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -17.380 13.803 2.863 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -17.030 12.337 3.809 1.00 0.00 H new ATOM 86 N VAL A 8 -14.335 15.426 0.183 1.00 0.00 N ATOM 87 CA VAL A 8 -13.443 16.326 -0.528 1.00 0.00 C ATOM 88 C VAL A 8 -12.697 17.179 0.491 1.00 0.00 C ATOM 89 O VAL A 8 -13.310 17.844 1.338 1.00 0.00 O ATOM 90 CB VAL A 8 -14.256 17.166 -1.536 1.00 0.00 C ATOM 91 CG1 VAL A 8 -13.378 18.122 -2.346 1.00 0.00 C ATOM 92 CG2 VAL A 8 -14.997 16.269 -2.541 1.00 0.00 C ATOM 0 H VAL A 8 -14.876 15.898 0.908 1.00 0.00 H new ATOM 0 HA VAL A 8 -12.701 15.773 -1.104 1.00 0.00 H new ATOM 0 HB VAL A 8 -14.960 17.738 -0.932 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -14.000 18.688 -3.039 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -12.869 18.810 -1.670 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.638 17.550 -2.906 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -15.560 16.891 -3.237 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -14.275 15.668 -3.094 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -15.682 15.612 -2.006 1.00 0.00 H new ATOM 102 N GLY A 9 -11.371 17.119 0.430 1.00 0.00 N ATOM 103 CA GLY A 9 -10.484 17.867 1.293 1.00 0.00 C ATOM 104 C GLY A 9 -10.392 19.324 0.837 1.00 0.00 C ATOM 105 O GLY A 9 -11.009 19.715 -0.159 1.00 0.00 O ATOM 0 H GLY A 9 -10.877 16.531 -0.241 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.846 17.824 2.320 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -9.492 17.414 1.285 1.00 0.00 H new ATOM 109 N GLY A 10 -9.668 20.147 1.586 1.00 0.00 N ATOM 110 CA GLY A 10 -9.475 21.563 1.312 1.00 0.00 C ATOM 111 C GLY A 10 -8.077 21.808 0.762 1.00 0.00 C ATOM 112 O GLY A 10 -7.475 20.934 0.135 1.00 0.00 O ATOM 0 H GLY A 10 -9.184 19.835 2.428 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.221 21.907 0.595 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -9.621 22.140 2.225 1.00 0.00 H new ATOM 116 N ASP A 11 -7.622 23.049 0.904 1.00 0.00 N ATOM 117 CA ASP A 11 -6.293 23.519 0.500 1.00 0.00 C ATOM 118 C ASP A 11 -5.386 23.584 1.741 1.00 0.00 C ATOM 119 O ASP A 11 -4.162 23.709 1.640 1.00 0.00 O ATOM 120 CB ASP A 11 -6.397 24.881 -0.172 1.00 0.00 C ATOM 121 CG ASP A 11 -6.689 26.026 0.797 1.00 0.00 C ATOM 122 OD1 ASP A 11 -7.716 25.960 1.519 1.00 0.00 O ATOM 123 OD2 ASP A 11 -5.969 27.044 0.788 1.00 0.00 O ATOM 0 H ASP A 11 -8.189 23.788 1.320 1.00 0.00 H new ATOM 0 HA ASP A 11 -5.860 22.826 -0.221 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -5.464 25.090 -0.696 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -7.184 24.845 -0.925 1.00 0.00 H new ATOM 128 N THR A 12 -6.022 23.541 2.909 1.00 0.00 N ATOM 129 CA THR A 12 -5.516 23.523 4.264 1.00 0.00 C ATOM 130 C THR A 12 -5.472 22.030 4.583 1.00 0.00 C ATOM 131 O THR A 12 -6.489 21.352 4.417 1.00 0.00 O ATOM 132 CB THR A 12 -6.475 24.229 5.225 1.00 0.00 C ATOM 133 OG1 THR A 12 -7.837 24.053 4.855 1.00 0.00 O ATOM 134 CG2 THR A 12 -6.227 25.733 5.305 1.00 0.00 C ATOM 0 H THR A 12 -7.042 23.515 2.918 1.00 0.00 H new ATOM 0 HA THR A 12 -4.558 24.032 4.365 1.00 0.00 H new ATOM 0 HB THR A 12 -6.280 23.766 6.192 1.00 0.00 H new ATOM 0 HG1 THR A 12 -7.990 23.117 4.607 1.00 0.00 H new ATOM 0 HG21 THR A 12 -6.936 26.182 6.001 1.00 0.00 H new ATOM 0 HG22 THR A 12 -5.211 25.916 5.653 1.00 0.00 H new ATOM 0 HG23 THR A 12 -6.358 26.176 4.318 1.00 0.00 H new ATOM 142 N ASP A 13 -4.312 21.547 5.015 1.00 0.00 N ATOM 143 CA ASP A 13 -4.084 20.148 5.334 1.00 0.00 C ATOM 144 C ASP A 13 -5.052 19.629 6.387 1.00 0.00 C ATOM 145 O ASP A 13 -5.453 20.367 7.292 1.00 0.00 O ATOM 146 CB ASP A 13 -2.638 19.893 5.750 1.00 0.00 C ATOM 147 CG ASP A 13 -2.331 20.359 7.168 1.00 0.00 C ATOM 148 OD1 ASP A 13 -2.060 21.566 7.357 1.00 0.00 O ATOM 149 OD2 ASP A 13 -2.297 19.493 8.090 1.00 0.00 O ATOM 0 H ASP A 13 -3.488 22.132 5.155 1.00 0.00 H new ATOM 0 HA ASP A 13 -4.274 19.589 4.418 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -2.427 18.827 5.671 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -1.971 20.403 5.054 1.00 0.00 H new ATOM 154 N ASP A 14 -5.342 18.333 6.332 1.00 0.00 N ATOM 155 CA ASP A 14 -6.276 17.678 7.228 1.00 0.00 C ATOM 156 C ASP A 14 -5.851 16.229 7.373 1.00 0.00 C ATOM 157 O ASP A 14 -4.837 15.799 6.810 1.00 0.00 O ATOM 158 CB ASP A 14 -7.655 17.792 6.565 1.00 0.00 C ATOM 159 CG ASP A 14 -8.897 17.415 7.364 1.00 0.00 C ATOM 160 OD1 ASP A 14 -8.820 17.106 8.565 1.00 0.00 O ATOM 161 OD2 ASP A 14 -9.996 17.527 6.757 1.00 0.00 O ATOM 0 H ASP A 14 -4.924 17.701 5.649 1.00 0.00 H new ATOM 0 HA ASP A 14 -6.302 18.125 8.222 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -7.777 18.824 6.236 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -7.641 17.172 5.669 1.00 0.00 H new ATOM 166 N GLN A 15 -6.539 15.531 8.260 1.00 0.00 N ATOM 167 CA GLN A 15 -6.326 14.124 8.541 1.00 0.00 C ATOM 168 C GLN A 15 -7.683 13.452 8.461 1.00 0.00 C ATOM 169 O GLN A 15 -8.512 13.626 9.358 1.00 0.00 O ATOM 170 CB GLN A 15 -5.535 13.898 9.830 1.00 0.00 C ATOM 171 CG GLN A 15 -5.026 12.445 9.904 1.00 0.00 C ATOM 172 CD GLN A 15 -5.907 11.565 10.786 1.00 0.00 C ATOM 173 OE1 GLN A 15 -6.498 10.583 10.345 1.00 0.00 O ATOM 174 NE2 GLN A 15 -5.999 11.876 12.067 1.00 0.00 N ATOM 0 H GLN A 15 -7.285 15.942 8.822 1.00 0.00 H new ATOM 0 HA GLN A 15 -5.676 13.655 7.802 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.692 14.587 9.872 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -6.165 14.113 10.693 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -4.987 12.025 8.899 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -4.007 12.439 10.291 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -5.507 12.692 12.430 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -6.562 11.300 12.693 1.00 0.00 H new ATOM 183 N LEU A 16 -7.920 12.714 7.380 1.00 0.00 N ATOM 184 CA LEU A 16 -9.184 12.046 7.132 1.00 0.00 C ATOM 185 C LEU A 16 -9.079 10.541 7.342 1.00 0.00 C ATOM 186 O LEU A 16 -8.503 9.822 6.528 1.00 0.00 O ATOM 187 CB LEU A 16 -9.739 12.439 5.759 1.00 0.00 C ATOM 188 CG LEU A 16 -9.920 13.956 5.499 1.00 0.00 C ATOM 189 CD1 LEU A 16 -8.665 14.650 4.952 1.00 0.00 C ATOM 190 CD2 LEU A 16 -10.995 14.104 4.421 1.00 0.00 C ATOM 0 H LEU A 16 -7.228 12.564 6.646 1.00 0.00 H new ATOM 0 HA LEU A 16 -9.910 12.387 7.870 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.074 12.038 4.994 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.705 11.952 5.629 1.00 0.00 H new ATOM 0 HG LEU A 16 -10.168 14.416 6.455 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.873 15.709 4.797 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.849 14.542 5.666 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.381 14.193 4.004 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -11.153 15.161 4.208 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -10.672 13.595 3.513 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.927 13.661 4.773 1.00 0.00 H new ATOM 202 N GLN A 17 -9.620 10.074 8.465 1.00 0.00 N ATOM 203 CA GLN A 17 -9.654 8.675 8.861 1.00 0.00 C ATOM 204 C GLN A 17 -10.935 8.059 8.297 1.00 0.00 C ATOM 205 O GLN A 17 -11.984 8.710 8.289 1.00 0.00 O ATOM 206 CB GLN A 17 -9.668 8.601 10.380 1.00 0.00 C ATOM 207 CG GLN A 17 -9.327 7.198 10.889 1.00 0.00 C ATOM 208 CD GLN A 17 -9.702 7.116 12.351 1.00 0.00 C ATOM 209 OE1 GLN A 17 -8.858 7.060 13.239 1.00 0.00 O ATOM 210 NE2 GLN A 17 -10.985 7.186 12.640 1.00 0.00 N ATOM 0 H GLN A 17 -10.063 10.687 9.149 1.00 0.00 H new ATOM 0 HA GLN A 17 -8.785 8.136 8.484 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -8.953 9.317 10.784 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -10.652 8.891 10.748 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -9.868 6.445 10.316 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -8.264 6.995 10.758 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -11.675 7.232 11.890 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -11.289 7.194 13.614 1.00 0.00 H new ATOM 219 N GLY A 18 -10.876 6.795 7.897 1.00 0.00 N ATOM 220 CA GLY A 18 -12.019 6.087 7.350 1.00 0.00 C ATOM 221 C GLY A 18 -12.805 5.458 8.494 1.00 0.00 C ATOM 222 O GLY A 18 -13.756 6.044 9.019 1.00 0.00 O ATOM 0 H GLY A 18 -10.027 6.232 7.945 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -12.654 6.773 6.789 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -11.687 5.317 6.653 1.00 0.00 H new ATOM 226 N GLY A 19 -12.333 4.300 8.948 1.00 0.00 N ATOM 227 CA GLY A 19 -12.907 3.483 10.013 1.00 0.00 C ATOM 228 C GLY A 19 -13.590 2.256 9.411 1.00 0.00 C ATOM 229 O GLY A 19 -13.418 1.971 8.221 1.00 0.00 O ATOM 0 H GLY A 19 -11.488 3.882 8.558 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -12.126 3.172 10.707 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -13.627 4.068 10.585 1.00 0.00 H new ATOM 233 N SER A 20 -14.295 1.461 10.215 1.00 0.00 N ATOM 234 CA SER A 20 -14.981 0.294 9.686 1.00 0.00 C ATOM 235 C SER A 20 -16.191 0.779 8.893 1.00 0.00 C ATOM 236 O SER A 20 -17.074 1.452 9.435 1.00 0.00 O ATOM 237 CB SER A 20 -15.392 -0.661 10.797 1.00 0.00 C ATOM 238 OG SER A 20 -15.988 0.020 11.891 1.00 0.00 O ATOM 0 H SER A 20 -14.403 1.604 11.219 1.00 0.00 H new ATOM 0 HA SER A 20 -14.310 -0.266 9.034 1.00 0.00 H new ATOM 0 HB2 SER A 20 -16.093 -1.396 10.402 1.00 0.00 H new ATOM 0 HB3 SER A 20 -14.517 -1.210 11.145 1.00 0.00 H new ATOM 0 HG SER A 20 -16.563 0.739 11.555 1.00 0.00 H new ATOM 244 N GLY A 21 -16.265 0.396 7.626 1.00 0.00 N ATOM 245 CA GLY A 21 -17.311 0.765 6.709 1.00 0.00 C ATOM 246 C GLY A 21 -16.730 0.883 5.311 1.00 0.00 C ATOM 247 O GLY A 21 -15.810 0.141 4.976 1.00 0.00 O ATOM 0 H GLY A 21 -15.562 -0.207 7.200 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -18.105 0.018 6.724 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -17.759 1.712 7.011 1.00 0.00 H new ATOM 251 N ALA A 22 -17.440 1.560 4.417 1.00 0.00 N ATOM 252 CA ALA A 22 -17.028 1.834 3.055 1.00 0.00 C ATOM 253 C ALA A 22 -17.089 3.348 3.000 1.00 0.00 C ATOM 254 O ALA A 22 -18.206 3.873 2.943 1.00 0.00 O ATOM 255 CB ALA A 22 -17.954 1.141 2.050 1.00 0.00 C ATOM 0 H ALA A 22 -18.358 1.948 4.636 1.00 0.00 H new ATOM 0 HA ALA A 22 -16.041 1.454 2.792 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -17.622 1.363 1.036 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -17.926 0.064 2.213 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -18.973 1.502 2.185 1.00 0.00 H new ATOM 261 N ASP A 23 -15.959 4.034 3.103 1.00 0.00 N ATOM 262 CA ASP A 23 -15.899 5.491 3.043 1.00 0.00 C ATOM 263 C ASP A 23 -15.051 5.834 1.817 1.00 0.00 C ATOM 264 O ASP A 23 -14.279 5.010 1.317 1.00 0.00 O ATOM 265 CB ASP A 23 -15.354 6.127 4.342 1.00 0.00 C ATOM 266 CG ASP A 23 -16.438 6.414 5.398 1.00 0.00 C ATOM 267 OD1 ASP A 23 -17.204 5.494 5.757 1.00 0.00 O ATOM 268 OD2 ASP A 23 -16.527 7.580 5.875 1.00 0.00 O ATOM 0 H ASP A 23 -15.049 3.592 3.232 1.00 0.00 H new ATOM 0 HA ASP A 23 -16.901 5.910 2.950 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -14.606 5.462 4.774 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.847 7.059 4.094 1.00 0.00 H new ATOM 273 N ARG A 24 -15.221 7.034 1.269 1.00 0.00 N ATOM 274 CA ARG A 24 -14.494 7.507 0.093 1.00 0.00 C ATOM 275 C ARG A 24 -14.074 8.924 0.396 1.00 0.00 C ATOM 276 O ARG A 24 -14.914 9.742 0.747 1.00 0.00 O ATOM 277 CB ARG A 24 -15.354 7.395 -1.158 1.00 0.00 C ATOM 278 CG ARG A 24 -15.509 5.906 -1.479 1.00 0.00 C ATOM 279 CD ARG A 24 -15.879 5.713 -2.933 1.00 0.00 C ATOM 280 NE ARG A 24 -17.314 5.906 -3.168 1.00 0.00 N ATOM 281 CZ ARG A 24 -18.037 5.244 -4.070 1.00 0.00 C ATOM 282 NH1 ARG A 24 -17.452 4.440 -4.950 1.00 0.00 N ATOM 283 NH2 ARG A 24 -19.355 5.381 -4.107 1.00 0.00 N ATOM 0 H ARG A 24 -15.881 7.719 1.637 1.00 0.00 H new ATOM 0 HA ARG A 24 -13.614 6.898 -0.113 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -16.329 7.856 -0.996 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -14.888 7.920 -1.992 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -14.578 5.382 -1.262 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -16.277 5.468 -0.841 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -15.314 6.415 -3.547 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -15.592 4.710 -3.250 1.00 0.00 H new ATOM 0 HE ARG A 24 -17.795 6.601 -2.597 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -16.439 4.324 -4.940 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -18.016 3.938 -5.636 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -19.823 5.997 -3.442 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -19.902 4.871 -4.801 1.00 0.00 H new ATOM 297 N LEU A 25 -12.789 9.216 0.272 1.00 0.00 N ATOM 298 CA LEU A 25 -12.239 10.526 0.562 1.00 0.00 C ATOM 299 C LEU A 25 -11.206 10.896 -0.494 1.00 0.00 C ATOM 300 O LEU A 25 -10.702 10.031 -1.216 1.00 0.00 O ATOM 301 CB LEU A 25 -11.726 10.566 2.020 1.00 0.00 C ATOM 302 CG LEU A 25 -11.131 9.266 2.622 1.00 0.00 C ATOM 303 CD1 LEU A 25 -9.949 8.687 1.831 1.00 0.00 C ATOM 304 CD2 LEU A 25 -10.729 9.494 4.085 1.00 0.00 C ATOM 0 H LEU A 25 -12.091 8.539 -0.037 1.00 0.00 H new ATOM 0 HA LEU A 25 -13.006 11.298 0.502 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.963 11.342 2.084 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -12.554 10.879 2.656 1.00 0.00 H new ATOM 0 HG LEU A 25 -11.924 8.520 2.560 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -9.593 7.780 2.320 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -10.271 8.450 0.817 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -9.142 9.419 1.794 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -10.313 8.574 4.496 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -9.982 10.286 4.138 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -11.607 9.785 4.662 1.00 0.00 H new ATOM 316 N ASP A 26 -10.908 12.190 -0.583 1.00 0.00 N ATOM 317 CA ASP A 26 -9.971 12.768 -1.540 1.00 0.00 C ATOM 318 C ASP A 26 -9.225 13.908 -0.856 1.00 0.00 C ATOM 319 O ASP A 26 -9.863 14.844 -0.366 1.00 0.00 O ATOM 320 CB ASP A 26 -10.828 13.219 -2.746 1.00 0.00 C ATOM 321 CG ASP A 26 -10.132 13.628 -4.047 1.00 0.00 C ATOM 322 OD1 ASP A 26 -9.365 14.621 -4.065 1.00 0.00 O ATOM 323 OD2 ASP A 26 -10.544 13.099 -5.111 1.00 0.00 O ATOM 0 H ASP A 26 -11.327 12.888 0.031 1.00 0.00 H new ATOM 0 HA ASP A 26 -9.208 12.074 -1.891 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -11.514 12.406 -2.983 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.435 14.063 -2.419 1.00 0.00 H new ATOM 328 N GLY A 27 -7.901 13.783 -0.744 1.00 0.00 N ATOM 329 CA GLY A 27 -7.008 14.738 -0.089 1.00 0.00 C ATOM 330 C GLY A 27 -7.199 16.187 -0.506 1.00 0.00 C ATOM 331 O GLY A 27 -7.396 17.045 0.358 1.00 0.00 O ATOM 0 H GLY A 27 -7.402 12.979 -1.124 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -7.150 14.664 0.989 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.977 14.449 -0.295 1.00 0.00 H new ATOM 335 N GLY A 28 -7.249 16.456 -1.809 1.00 0.00 N ATOM 336 CA GLY A 28 -7.413 17.814 -2.310 1.00 0.00 C ATOM 337 C GLY A 28 -6.090 18.232 -2.918 1.00 0.00 C ATOM 338 O GLY A 28 -5.770 17.724 -3.998 1.00 0.00 O ATOM 0 H GLY A 28 -7.178 15.746 -2.538 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.208 17.856 -3.054 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.696 18.490 -1.503 1.00 0.00 H new ATOM 342 N ALA A 29 -5.356 19.135 -2.258 1.00 0.00 N ATOM 343 CA ALA A 29 -4.061 19.605 -2.717 1.00 0.00 C ATOM 344 C ALA A 29 -3.301 20.184 -1.523 1.00 0.00 C ATOM 345 O ALA A 29 -3.373 21.391 -1.269 1.00 0.00 O ATOM 346 CB ALA A 29 -4.237 20.648 -3.827 1.00 0.00 C ATOM 0 H ALA A 29 -5.656 19.560 -1.380 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.488 18.778 -3.136 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -3.258 20.992 -4.162 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -4.771 20.201 -4.665 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -4.807 21.494 -3.444 1.00 0.00 H new ATOM 352 N GLY A 30 -2.542 19.351 -0.810 1.00 0.00 N ATOM 353 CA GLY A 30 -1.796 19.799 0.359 1.00 0.00 C ATOM 354 C GLY A 30 -0.685 18.852 0.801 1.00 0.00 C ATOM 355 O GLY A 30 0.005 18.222 -0.007 1.00 0.00 O ATOM 0 H GLY A 30 -2.430 18.360 -1.025 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -1.360 20.775 0.144 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -2.491 19.935 1.188 1.00 0.00 H new ATOM 359 N ASP A 31 -0.484 18.864 2.114 1.00 0.00 N ATOM 360 CA ASP A 31 0.434 18.159 2.986 1.00 0.00 C ATOM 361 C ASP A 31 -0.484 17.424 3.963 1.00 0.00 C ATOM 362 O ASP A 31 -0.417 17.608 5.179 1.00 0.00 O ATOM 363 CB ASP A 31 1.294 19.255 3.635 1.00 0.00 C ATOM 364 CG ASP A 31 2.318 18.791 4.662 1.00 0.00 C ATOM 365 OD1 ASP A 31 3.125 17.874 4.398 1.00 0.00 O ATOM 366 OD2 ASP A 31 2.382 19.490 5.713 1.00 0.00 O ATOM 0 H ASP A 31 -1.068 19.479 2.680 1.00 0.00 H new ATOM 0 HA ASP A 31 1.110 17.438 2.525 1.00 0.00 H new ATOM 0 HB2 ASP A 31 1.821 19.789 2.844 1.00 0.00 H new ATOM 0 HB3 ASP A 31 0.628 19.972 4.116 1.00 0.00 H new ATOM 371 N ASP A 32 -1.384 16.617 3.395 1.00 0.00 N ATOM 372 CA ASP A 32 -2.446 15.852 4.040 1.00 0.00 C ATOM 373 C ASP A 32 -2.137 14.386 4.296 1.00 0.00 C ATOM 374 O ASP A 32 -1.115 13.835 3.876 1.00 0.00 O ATOM 375 CB ASP A 32 -3.760 15.934 3.250 1.00 0.00 C ATOM 376 CG ASP A 32 -4.319 17.345 3.087 1.00 0.00 C ATOM 377 OD1 ASP A 32 -3.640 18.218 2.503 1.00 0.00 O ATOM 378 OD2 ASP A 32 -5.421 17.570 3.638 1.00 0.00 O ATOM 0 H ASP A 32 -1.385 16.472 2.385 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.539 16.331 5.015 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.601 15.504 2.261 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -4.507 15.317 3.749 1.00 0.00 H new ATOM 383 N ILE A 33 -2.993 13.797 5.123 1.00 0.00 N ATOM 384 CA ILE A 33 -2.951 12.386 5.539 1.00 0.00 C ATOM 385 C ILE A 33 -4.365 11.792 5.428 1.00 0.00 C ATOM 386 O ILE A 33 -5.316 12.385 5.935 1.00 0.00 O ATOM 387 CB ILE A 33 -2.303 12.227 6.945 1.00 0.00 C ATOM 388 CG1 ILE A 33 -2.598 10.836 7.553 1.00 0.00 C ATOM 389 CG2 ILE A 33 -2.556 13.432 7.868 1.00 0.00 C ATOM 390 CD1 ILE A 33 -1.758 10.501 8.793 1.00 0.00 C ATOM 0 H ILE A 33 -3.771 14.305 5.544 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.305 11.815 4.873 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.220 12.247 6.819 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.654 10.784 7.818 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -2.423 10.075 6.793 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.078 13.258 8.832 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -2.141 14.332 7.414 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -3.629 13.561 8.013 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -2.026 9.509 9.157 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -0.700 10.518 8.531 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.950 11.238 9.573 1.00 0.00 H new ATOM 402 N LEU A 34 -4.541 10.657 4.736 1.00 0.00 N ATOM 403 CA LEU A 34 -5.844 10.004 4.572 1.00 0.00 C ATOM 404 C LEU A 34 -5.693 8.497 4.825 1.00 0.00 C ATOM 405 O LEU A 34 -4.623 7.923 4.611 1.00 0.00 O ATOM 406 CB LEU A 34 -6.515 10.349 3.212 1.00 0.00 C ATOM 407 CG LEU A 34 -6.892 11.841 3.079 1.00 0.00 C ATOM 408 CD1 LEU A 34 -5.799 12.734 2.491 1.00 0.00 C ATOM 409 CD2 LEU A 34 -8.112 11.998 2.169 1.00 0.00 C ATOM 0 H LEU A 34 -3.777 10.165 4.272 1.00 0.00 H new ATOM 0 HA LEU A 34 -6.536 10.396 5.317 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.838 10.079 2.402 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -7.413 9.742 3.093 1.00 0.00 H new ATOM 0 HG LEU A 34 -7.077 12.162 4.104 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -6.158 13.762 2.438 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.914 12.691 3.126 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.545 12.386 1.490 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.368 13.054 2.083 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.883 11.599 1.181 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.955 11.454 2.594 1.00 0.00 H new ATOM 421 N ASP A 35 -6.756 7.846 5.298 1.00 0.00 N ATOM 422 CA ASP A 35 -6.812 6.416 5.612 1.00 0.00 C ATOM 423 C ASP A 35 -8.176 5.854 5.229 1.00 0.00 C ATOM 424 O ASP A 35 -9.206 6.491 5.447 1.00 0.00 O ATOM 425 CB ASP A 35 -6.521 6.187 7.106 1.00 0.00 C ATOM 426 CG ASP A 35 -7.306 5.027 7.745 1.00 0.00 C ATOM 427 OD1 ASP A 35 -6.844 3.863 7.721 1.00 0.00 O ATOM 428 OD2 ASP A 35 -8.361 5.280 8.381 1.00 0.00 O ATOM 0 H ASP A 35 -7.640 8.320 5.481 1.00 0.00 H new ATOM 0 HA ASP A 35 -6.050 5.892 5.035 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -5.455 5.997 7.229 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -6.747 7.104 7.651 1.00 0.00 H new ATOM 433 N GLY A 36 -8.184 4.624 4.719 1.00 0.00 N ATOM 434 CA GLY A 36 -9.383 3.931 4.283 1.00 0.00 C ATOM 435 C GLY A 36 -10.071 3.122 5.374 1.00 0.00 C ATOM 436 O GLY A 36 -11.203 2.672 5.162 1.00 0.00 O ATOM 0 H GLY A 36 -7.334 4.073 4.597 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -10.089 4.663 3.890 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.124 3.264 3.461 1.00 0.00 H new ATOM 440 N GLY A 37 -9.462 2.951 6.552 1.00 0.00 N ATOM 441 CA GLY A 37 -10.068 2.180 7.622 1.00 0.00 C ATOM 442 C GLY A 37 -10.059 0.706 7.267 1.00 0.00 C ATOM 443 O GLY A 37 -9.023 0.175 6.866 1.00 0.00 O ATOM 0 H GLY A 37 -8.548 3.341 6.781 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -9.523 2.342 8.552 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -11.091 2.516 7.789 1.00 0.00 H new ATOM 447 N ALA A 38 -11.175 0.043 7.552 1.00 0.00 N ATOM 448 CA ALA A 38 -11.392 -1.366 7.271 1.00 0.00 C ATOM 449 C ALA A 38 -12.601 -1.498 6.349 1.00 0.00 C ATOM 450 O ALA A 38 -13.738 -1.393 6.819 1.00 0.00 O ATOM 451 CB ALA A 38 -11.548 -2.141 8.585 1.00 0.00 C ATOM 0 H ALA A 38 -11.977 0.488 7.999 1.00 0.00 H new ATOM 0 HA ALA A 38 -10.535 -1.801 6.757 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.710 -3.197 8.368 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -10.644 -2.029 9.183 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -12.401 -1.749 9.139 1.00 0.00 H new ATOM 457 N GLY A 39 -12.374 -1.839 5.080 1.00 0.00 N ATOM 458 CA GLY A 39 -13.387 -2.005 4.068 1.00 0.00 C ATOM 459 C GLY A 39 -12.910 -1.474 2.717 1.00 0.00 C ATOM 460 O GLY A 39 -11.758 -1.075 2.573 1.00 0.00 O ATOM 0 H GLY A 39 -11.433 -2.012 4.726 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.644 -3.060 3.977 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.294 -1.481 4.368 1.00 0.00 H new ATOM 464 N ARG A 40 -13.779 -1.512 1.702 1.00 0.00 N ATOM 465 CA ARG A 40 -13.456 -1.029 0.363 1.00 0.00 C ATOM 466 C ARG A 40 -13.486 0.492 0.345 1.00 0.00 C ATOM 467 O ARG A 40 -14.564 1.084 0.456 1.00 0.00 O ATOM 468 CB ARG A 40 -14.367 -1.649 -0.709 1.00 0.00 C ATOM 469 CG ARG A 40 -15.881 -1.543 -0.467 1.00 0.00 C ATOM 470 CD ARG A 40 -16.478 -2.777 0.225 1.00 0.00 C ATOM 471 NE ARG A 40 -17.759 -2.486 0.899 1.00 0.00 N ATOM 472 CZ ARG A 40 -18.849 -1.920 0.361 1.00 0.00 C ATOM 473 NH1 ARG A 40 -18.941 -1.629 -0.932 1.00 0.00 N ATOM 474 NH2 ARG A 40 -19.893 -1.635 1.124 1.00 0.00 N ATOM 0 H ARG A 40 -14.726 -1.880 1.790 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.446 -1.351 0.111 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -14.140 -1.176 -1.664 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -14.110 -2.704 -0.807 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -16.083 -0.662 0.142 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -16.384 -1.393 -1.422 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -16.631 -3.564 -0.513 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -15.766 -3.159 0.956 1.00 0.00 H new ATOM 0 HE ARG A 40 -17.822 -2.744 1.884 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -18.163 -1.836 -1.558 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -19.790 -1.198 -1.299 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -19.868 -1.846 2.122 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -20.722 -1.204 0.714 1.00 0.00 H new ATOM 488 N ASP A 41 -12.333 1.117 0.159 1.00 0.00 N ATOM 489 CA ASP A 41 -12.198 2.557 0.116 1.00 0.00 C ATOM 490 C ASP A 41 -11.732 2.913 -1.286 1.00 0.00 C ATOM 491 O ASP A 41 -11.324 2.056 -2.081 1.00 0.00 O ATOM 492 CB ASP A 41 -11.195 3.088 1.161 1.00 0.00 C ATOM 493 CG ASP A 41 -9.765 2.559 1.000 1.00 0.00 C ATOM 494 OD1 ASP A 41 -9.589 1.321 1.058 1.00 0.00 O ATOM 495 OD2 ASP A 41 -8.825 3.383 0.940 1.00 0.00 O ATOM 0 H ASP A 41 -11.450 0.623 0.032 1.00 0.00 H new ATOM 0 HA ASP A 41 -13.156 3.019 0.355 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -11.174 4.176 1.105 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -11.555 2.827 2.156 1.00 0.00 H new ATOM 500 N ARG A 42 -11.916 4.170 -1.663 1.00 0.00 N ATOM 501 CA ARG A 42 -11.485 4.685 -2.941 1.00 0.00 C ATOM 502 C ARG A 42 -10.827 5.992 -2.572 1.00 0.00 C ATOM 503 O ARG A 42 -11.524 6.978 -2.314 1.00 0.00 O ATOM 504 CB ARG A 42 -12.680 4.855 -3.864 1.00 0.00 C ATOM 505 CG ARG A 42 -12.230 4.944 -5.329 1.00 0.00 C ATOM 506 CD ARG A 42 -13.399 5.386 -6.213 1.00 0.00 C ATOM 507 NE ARG A 42 -13.051 5.337 -7.643 1.00 0.00 N ATOM 508 CZ ARG A 42 -13.194 6.306 -8.553 1.00 0.00 C ATOM 509 NH1 ARG A 42 -13.689 7.491 -8.215 1.00 0.00 N ATOM 510 NH2 ARG A 42 -12.849 6.075 -9.818 1.00 0.00 N ATOM 0 H ARG A 42 -12.376 4.866 -1.076 1.00 0.00 H new ATOM 0 HA ARG A 42 -10.804 4.033 -3.489 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.364 4.015 -3.739 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -13.229 5.756 -3.592 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -11.406 5.651 -5.422 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.858 3.975 -5.663 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -14.260 4.744 -6.026 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.694 6.400 -5.945 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.654 4.460 -7.979 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.966 7.672 -7.250 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.792 8.221 -8.920 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -12.478 5.164 -10.087 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -12.955 6.809 -10.518 1.00 0.00 H new ATOM 524 N LEU A 43 -9.508 5.981 -2.518 1.00 0.00 N ATOM 525 CA LEU A 43 -8.719 7.133 -2.176 1.00 0.00 C ATOM 526 C LEU A 43 -8.308 7.830 -3.464 1.00 0.00 C ATOM 527 O LEU A 43 -8.190 7.196 -4.515 1.00 0.00 O ATOM 528 CB LEU A 43 -7.573 6.637 -1.296 1.00 0.00 C ATOM 529 CG LEU A 43 -6.466 5.828 -1.995 1.00 0.00 C ATOM 530 CD1 LEU A 43 -5.430 6.770 -2.627 1.00 0.00 C ATOM 531 CD2 LEU A 43 -5.759 4.949 -0.967 1.00 0.00 C ATOM 0 H LEU A 43 -8.951 5.150 -2.716 1.00 0.00 H new ATOM 0 HA LEU A 43 -9.253 7.889 -1.600 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -7.112 7.501 -0.818 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.995 6.021 -0.502 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.921 5.216 -2.774 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.654 6.182 -3.117 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.920 7.409 -3.362 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.980 7.389 -1.851 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.974 4.374 -1.458 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.318 5.577 -0.193 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.479 4.267 -0.515 1.00 0.00 H new ATOM 543 N SER A 44 -8.140 9.143 -3.401 1.00 0.00 N ATOM 544 CA SER A 44 -7.760 9.986 -4.518 1.00 0.00 C ATOM 545 C SER A 44 -6.987 11.130 -3.877 1.00 0.00 C ATOM 546 O SER A 44 -7.605 12.037 -3.329 1.00 0.00 O ATOM 547 CB SER A 44 -9.062 10.385 -5.221 1.00 0.00 C ATOM 548 OG SER A 44 -8.924 11.291 -6.296 1.00 0.00 O ATOM 0 H SER A 44 -8.270 9.667 -2.536 1.00 0.00 H new ATOM 0 HA SER A 44 -7.129 9.536 -5.284 1.00 0.00 H new ATOM 0 HB2 SER A 44 -9.545 9.481 -5.591 1.00 0.00 H new ATOM 0 HB3 SER A 44 -9.732 10.825 -4.483 1.00 0.00 H new ATOM 0 HG SER A 44 -9.500 12.069 -6.144 1.00 0.00 H new ATOM 554 N GLY A 45 -5.656 11.067 -3.862 1.00 0.00 N ATOM 555 CA GLY A 45 -4.872 12.128 -3.240 1.00 0.00 C ATOM 556 C GLY A 45 -5.083 13.470 -3.919 1.00 0.00 C ATOM 557 O GLY A 45 -5.615 14.413 -3.326 1.00 0.00 O ATOM 0 H GLY A 45 -5.108 10.307 -4.266 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -5.143 12.209 -2.187 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.815 11.866 -3.277 1.00 0.00 H new ATOM 561 N GLY A 46 -4.810 13.496 -5.219 1.00 0.00 N ATOM 562 CA GLY A 46 -4.903 14.700 -6.020 1.00 0.00 C ATOM 563 C GLY A 46 -3.482 15.259 -6.105 1.00 0.00 C ATOM 564 O GLY A 46 -2.531 14.594 -5.683 1.00 0.00 O ATOM 0 H GLY A 46 -4.516 12.673 -5.746 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -5.296 14.479 -7.013 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -5.580 15.422 -5.563 1.00 0.00 H new ATOM 568 N ALA A 47 -3.299 16.443 -6.693 1.00 0.00 N ATOM 569 CA ALA A 47 -1.950 16.987 -6.770 1.00 0.00 C ATOM 570 C ALA A 47 -1.591 17.502 -5.373 1.00 0.00 C ATOM 571 O ALA A 47 -1.942 18.630 -5.023 1.00 0.00 O ATOM 572 CB ALA A 47 -1.895 18.083 -7.842 1.00 0.00 C ATOM 0 H ALA A 47 -4.034 17.019 -7.105 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.220 16.233 -7.066 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -0.884 18.488 -7.897 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.170 17.661 -8.809 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -2.592 18.880 -7.583 1.00 0.00 H new ATOM 578 N GLY A 48 -0.783 16.749 -4.634 1.00 0.00 N ATOM 579 CA GLY A 48 -0.345 17.065 -3.287 1.00 0.00 C ATOM 580 C GLY A 48 0.602 15.978 -2.792 1.00 0.00 C ATOM 581 O GLY A 48 0.868 15.004 -3.498 1.00 0.00 O ATOM 0 H GLY A 48 -0.402 15.866 -4.975 1.00 0.00 H new ATOM 0 HA2 GLY A 48 0.157 18.033 -3.274 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -1.205 17.143 -2.622 1.00 0.00 H new ATOM 585 N ALA A 49 1.189 16.187 -1.615 1.00 0.00 N ATOM 586 CA ALA A 49 2.110 15.264 -0.977 1.00 0.00 C ATOM 587 C ALA A 49 1.338 14.638 0.172 1.00 0.00 C ATOM 588 O ALA A 49 1.563 14.953 1.346 1.00 0.00 O ATOM 589 CB ALA A 49 3.395 15.973 -0.538 1.00 0.00 C ATOM 0 H ALA A 49 1.028 17.032 -1.066 1.00 0.00 H new ATOM 0 HA ALA A 49 2.454 14.487 -1.660 1.00 0.00 H new ATOM 0 HB1 ALA A 49 4.063 15.254 -0.064 1.00 0.00 H new ATOM 0 HB2 ALA A 49 3.887 16.407 -1.409 1.00 0.00 H new ATOM 0 HB3 ALA A 49 3.150 16.763 0.171 1.00 0.00 H new ATOM 595 N ASP A 50 0.423 13.768 -0.213 1.00 0.00 N ATOM 596 CA ASP A 50 -0.491 12.997 0.612 1.00 0.00 C ATOM 597 C ASP A 50 0.253 11.853 1.295 1.00 0.00 C ATOM 598 O ASP A 50 1.464 11.650 1.137 1.00 0.00 O ATOM 599 CB ASP A 50 -1.641 12.414 -0.202 1.00 0.00 C ATOM 600 CG ASP A 50 -3.001 13.086 -0.126 1.00 0.00 C ATOM 601 OD1 ASP A 50 -3.073 14.318 0.042 1.00 0.00 O ATOM 602 OD2 ASP A 50 -3.978 12.296 -0.160 1.00 0.00 O ATOM 0 H ASP A 50 0.288 13.564 -1.203 1.00 0.00 H new ATOM 0 HA ASP A 50 -0.903 13.680 1.355 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -1.335 12.405 -1.248 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -1.768 11.375 0.102 1.00 0.00 H new ATOM 607 N THR A 51 -0.440 11.250 2.248 1.00 0.00 N ATOM 608 CA THR A 51 0.045 10.132 3.043 1.00 0.00 C ATOM 609 C THR A 51 -1.076 9.100 3.215 1.00 0.00 C ATOM 610 O THR A 51 -1.992 9.336 4.004 1.00 0.00 O ATOM 611 CB THR A 51 0.582 10.629 4.406 1.00 0.00 C ATOM 612 OG1 THR A 51 0.869 12.012 4.453 1.00 0.00 O ATOM 613 CG2 THR A 51 1.890 9.930 4.759 1.00 0.00 C ATOM 0 H THR A 51 -1.387 11.535 2.498 1.00 0.00 H new ATOM 0 HA THR A 51 0.875 9.650 2.526 1.00 0.00 H new ATOM 0 HB THR A 51 -0.225 10.404 5.103 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.043 12.522 4.317 1.00 0.00 H new ATOM 0 HG21 THR A 51 2.249 10.295 5.721 1.00 0.00 H new ATOM 0 HG22 THR A 51 1.723 8.854 4.818 1.00 0.00 H new ATOM 0 HG23 THR A 51 2.634 10.140 3.990 1.00 0.00 H new ATOM 621 N PHE A 52 -1.043 7.976 2.483 1.00 0.00 N ATOM 622 CA PHE A 52 -2.069 6.945 2.571 1.00 0.00 C ATOM 623 C PHE A 52 -1.616 6.036 3.695 1.00 0.00 C ATOM 624 O PHE A 52 -0.560 5.400 3.590 1.00 0.00 O ATOM 625 CB PHE A 52 -2.238 6.190 1.242 1.00 0.00 C ATOM 626 CG PHE A 52 -2.413 7.055 0.008 1.00 0.00 C ATOM 627 CD1 PHE A 52 -3.200 8.220 0.047 1.00 0.00 C ATOM 628 CD2 PHE A 52 -1.724 6.724 -1.174 1.00 0.00 C ATOM 629 CE1 PHE A 52 -3.229 9.085 -1.060 1.00 0.00 C ATOM 630 CE2 PHE A 52 -1.772 7.585 -2.281 1.00 0.00 C ATOM 631 CZ PHE A 52 -2.513 8.775 -2.221 1.00 0.00 C ATOM 0 H PHE A 52 -0.301 7.763 1.816 1.00 0.00 H new ATOM 0 HA PHE A 52 -3.053 7.368 2.772 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.366 5.552 1.095 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -3.103 5.532 1.327 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -3.782 8.450 0.927 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -1.158 5.806 -1.229 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -3.808 9.995 -1.014 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -1.236 7.331 -3.183 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.530 9.447 -3.066 1.00 0.00 H new ATOM 641 N VAL A 53 -2.366 5.990 4.788 1.00 0.00 N ATOM 642 CA VAL A 53 -2.015 5.177 5.940 1.00 0.00 C ATOM 643 C VAL A 53 -2.951 3.979 6.041 1.00 0.00 C ATOM 644 O VAL A 53 -4.170 4.104 5.914 1.00 0.00 O ATOM 645 CB VAL A 53 -2.027 6.060 7.206 1.00 0.00 C ATOM 646 CG1 VAL A 53 -1.539 5.291 8.446 1.00 0.00 C ATOM 647 CG2 VAL A 53 -1.093 7.273 7.033 1.00 0.00 C ATOM 0 H VAL A 53 -3.233 6.515 4.899 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.008 4.774 5.831 1.00 0.00 H new ATOM 0 HB VAL A 53 -3.061 6.376 7.346 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.563 5.949 9.315 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.189 4.434 8.622 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.519 4.945 8.281 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -1.116 7.882 7.937 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.075 6.926 6.856 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -1.426 7.870 6.184 1.00 0.00 H new ATOM 657 N PHE A 54 -2.368 2.796 6.223 1.00 0.00 N ATOM 658 CA PHE A 54 -3.139 1.567 6.391 1.00 0.00 C ATOM 659 C PHE A 54 -3.389 1.371 7.882 1.00 0.00 C ATOM 660 O PHE A 54 -2.484 1.612 8.686 1.00 0.00 O ATOM 661 CB PHE A 54 -2.387 0.377 5.831 1.00 0.00 C ATOM 662 CG PHE A 54 -2.241 0.421 4.338 1.00 0.00 C ATOM 663 CD1 PHE A 54 -3.395 0.344 3.544 1.00 0.00 C ATOM 664 CD2 PHE A 54 -0.977 0.564 3.744 1.00 0.00 C ATOM 665 CE1 PHE A 54 -3.283 0.463 2.157 1.00 0.00 C ATOM 666 CE2 PHE A 54 -0.867 0.665 2.351 1.00 0.00 C ATOM 667 CZ PHE A 54 -2.022 0.639 1.559 1.00 0.00 C ATOM 0 H PHE A 54 -1.357 2.663 6.258 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.082 1.647 5.850 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -1.397 0.334 6.286 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -2.907 -0.539 6.112 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -4.362 0.194 4.001 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -0.091 0.596 4.360 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -4.169 0.420 1.541 1.00 0.00 H new ATOM 0 HE2 PHE A 54 0.105 0.763 1.890 1.00 0.00 H new ATOM 0 HZ PHE A 54 -1.944 0.754 0.488 1.00 0.00 H new ATOM 677 N SER A 55 -4.583 0.908 8.249 1.00 0.00 N ATOM 678 CA SER A 55 -4.968 0.676 9.630 1.00 0.00 C ATOM 679 C SER A 55 -4.259 -0.563 10.192 1.00 0.00 C ATOM 680 O SER A 55 -3.278 -0.422 10.927 1.00 0.00 O ATOM 681 CB SER A 55 -6.497 0.580 9.715 1.00 0.00 C ATOM 682 OG SER A 55 -7.135 1.846 9.579 1.00 0.00 O ATOM 0 H SER A 55 -5.319 0.681 7.580 1.00 0.00 H new ATOM 0 HA SER A 55 -4.651 1.512 10.253 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.859 -0.090 8.935 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.777 0.137 10.671 1.00 0.00 H new ATOM 0 HG SER A 55 -6.767 2.316 8.801 1.00 0.00 H new ATOM 688 N ALA A 56 -4.743 -1.773 9.892 1.00 0.00 N ATOM 689 CA ALA A 56 -4.164 -3.032 10.360 1.00 0.00 C ATOM 690 C ALA A 56 -4.620 -4.184 9.460 1.00 0.00 C ATOM 691 O ALA A 56 -5.390 -3.989 8.523 1.00 0.00 O ATOM 692 CB ALA A 56 -4.596 -3.319 11.807 1.00 0.00 C ATOM 0 H ALA A 56 -5.566 -1.905 9.304 1.00 0.00 H new ATOM 0 HA ALA A 56 -3.078 -2.945 10.322 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.156 -4.260 12.138 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -4.256 -2.511 12.455 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.683 -3.390 11.855 1.00 0.00 H new ATOM 698 N ARG A 57 -4.187 -5.409 9.783 1.00 0.00 N ATOM 699 CA ARG A 57 -4.502 -6.660 9.073 1.00 0.00 C ATOM 700 C ARG A 57 -6.002 -6.939 8.907 1.00 0.00 C ATOM 701 O ARG A 57 -6.357 -7.960 8.323 1.00 0.00 O ATOM 702 CB ARG A 57 -3.823 -7.850 9.780 1.00 0.00 C ATOM 703 CG ARG A 57 -4.279 -7.972 11.243 1.00 0.00 C ATOM 704 CD ARG A 57 -3.932 -9.319 11.869 1.00 0.00 C ATOM 705 NE ARG A 57 -4.138 -9.270 13.321 1.00 0.00 N ATOM 706 CZ ARG A 57 -3.544 -10.042 14.234 1.00 0.00 C ATOM 707 NH1 ARG A 57 -2.709 -11.010 13.870 1.00 0.00 N ATOM 708 NH2 ARG A 57 -3.780 -9.846 15.526 1.00 0.00 N ATOM 0 H ARG A 57 -3.577 -5.565 10.586 1.00 0.00 H new ATOM 0 HA ARG A 57 -4.110 -6.534 8.064 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -4.056 -8.772 9.247 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -2.741 -7.726 9.744 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -3.818 -7.177 11.828 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -5.357 -7.821 11.295 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -4.552 -10.102 11.432 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -2.895 -9.574 11.650 1.00 0.00 H new ATOM 0 HE ARG A 57 -4.801 -8.577 13.667 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -2.515 -11.171 12.882 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -2.263 -11.592 14.579 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.416 -9.105 15.822 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.326 -10.436 16.223 1.00 0.00 H new ATOM 722 N GLU A 58 -6.880 -6.153 9.524 1.00 0.00 N ATOM 723 CA GLU A 58 -8.324 -6.289 9.418 1.00 0.00 C ATOM 724 C GLU A 58 -8.788 -5.790 8.039 1.00 0.00 C ATOM 725 O GLU A 58 -9.898 -6.122 7.612 1.00 0.00 O ATOM 726 CB GLU A 58 -8.956 -5.485 10.565 1.00 0.00 C ATOM 727 CG GLU A 58 -10.491 -5.561 10.591 1.00 0.00 C ATOM 728 CD GLU A 58 -11.064 -5.327 11.993 1.00 0.00 C ATOM 729 OE1 GLU A 58 -10.719 -4.335 12.670 1.00 0.00 O ATOM 730 OE2 GLU A 58 -11.849 -6.194 12.452 1.00 0.00 O ATOM 0 H GLU A 58 -6.595 -5.382 10.128 1.00 0.00 H new ATOM 0 HA GLU A 58 -8.634 -7.331 9.503 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -8.565 -5.852 11.514 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.653 -4.442 10.478 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -10.900 -4.819 9.906 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -10.810 -6.539 10.230 1.00 0.00 H new ATOM 737 N ASP A 59 -7.920 -5.088 7.305 1.00 0.00 N ATOM 738 CA ASP A 59 -8.137 -4.493 5.991 1.00 0.00 C ATOM 739 C ASP A 59 -7.082 -4.963 4.965 1.00 0.00 C ATOM 740 O ASP A 59 -6.231 -5.787 5.305 1.00 0.00 O ATOM 741 CB ASP A 59 -8.045 -2.977 6.205 1.00 0.00 C ATOM 742 CG ASP A 59 -8.514 -2.227 4.968 1.00 0.00 C ATOM 743 OD1 ASP A 59 -9.664 -2.492 4.541 1.00 0.00 O ATOM 744 OD2 ASP A 59 -7.697 -1.516 4.355 1.00 0.00 O ATOM 0 H ASP A 59 -6.975 -4.909 7.644 1.00 0.00 H new ATOM 0 HA ASP A 59 -9.103 -4.792 5.584 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -8.653 -2.689 7.063 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -7.016 -2.700 6.436 1.00 0.00 H new ATOM 749 N SER A 60 -7.171 -4.482 3.715 1.00 0.00 N ATOM 750 CA SER A 60 -6.363 -4.658 2.523 1.00 0.00 C ATOM 751 C SER A 60 -6.607 -5.962 1.747 1.00 0.00 C ATOM 752 O SER A 60 -5.710 -6.484 1.079 1.00 0.00 O ATOM 753 CB SER A 60 -4.936 -4.463 2.965 1.00 0.00 C ATOM 754 OG SER A 60 -4.105 -3.970 1.926 1.00 0.00 O ATOM 0 H SER A 60 -7.948 -3.857 3.498 1.00 0.00 H new ATOM 0 HA SER A 60 -6.648 -3.922 1.771 1.00 0.00 H new ATOM 0 HB2 SER A 60 -4.911 -3.769 3.805 1.00 0.00 H new ATOM 0 HB3 SER A 60 -4.538 -5.412 3.324 1.00 0.00 H new ATOM 0 HG SER A 60 -3.191 -3.859 2.263 1.00 0.00 H new ATOM 760 N TYR A 61 -7.809 -6.537 1.809 1.00 0.00 N ATOM 761 CA TYR A 61 -8.073 -7.798 1.124 1.00 0.00 C ATOM 762 C TYR A 61 -9.523 -7.991 0.720 1.00 0.00 C ATOM 763 O TYR A 61 -10.386 -7.130 0.852 1.00 0.00 O ATOM 764 CB TYR A 61 -7.637 -8.948 2.050 1.00 0.00 C ATOM 765 CG TYR A 61 -8.354 -8.950 3.383 1.00 0.00 C ATOM 766 CD1 TYR A 61 -9.628 -9.532 3.531 1.00 0.00 C ATOM 767 CD2 TYR A 61 -7.726 -8.366 4.489 1.00 0.00 C ATOM 768 CE1 TYR A 61 -10.279 -9.512 4.778 1.00 0.00 C ATOM 769 CE2 TYR A 61 -8.389 -8.300 5.719 1.00 0.00 C ATOM 770 CZ TYR A 61 -9.672 -8.864 5.873 1.00 0.00 C ATOM 771 OH TYR A 61 -10.332 -8.745 7.056 1.00 0.00 O ATOM 0 H TYR A 61 -8.604 -6.154 2.320 1.00 0.00 H new ATOM 0 HA TYR A 61 -7.505 -7.786 0.194 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -7.818 -9.898 1.547 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -6.563 -8.878 2.223 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -10.108 -9.996 2.682 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -6.728 -7.966 4.393 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -11.240 -9.991 4.896 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -7.914 -7.813 6.558 1.00 0.00 H new ATOM 0 HH TYR A 61 -10.152 -7.863 7.444 1.00 0.00 H new ATOM 781 N ARG A 62 -9.764 -9.148 0.126 1.00 0.00 N ATOM 782 CA ARG A 62 -11.046 -9.630 -0.322 1.00 0.00 C ATOM 783 C ARG A 62 -11.192 -11.039 0.225 1.00 0.00 C ATOM 784 O ARG A 62 -10.187 -11.715 0.485 1.00 0.00 O ATOM 785 CB ARG A 62 -11.167 -9.530 -1.839 1.00 0.00 C ATOM 786 CG ARG A 62 -9.932 -9.982 -2.636 1.00 0.00 C ATOM 787 CD ARG A 62 -10.173 -9.873 -4.142 1.00 0.00 C ATOM 788 NE ARG A 62 -11.114 -10.903 -4.595 1.00 0.00 N ATOM 789 CZ ARG A 62 -10.864 -11.913 -5.430 1.00 0.00 C ATOM 790 NH1 ARG A 62 -9.693 -12.054 -6.051 1.00 0.00 N ATOM 791 NH2 ARG A 62 -11.835 -12.786 -5.621 1.00 0.00 N ATOM 0 H ARG A 62 -9.015 -9.814 -0.065 1.00 0.00 H new ATOM 0 HA ARG A 62 -11.870 -9.021 0.051 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -12.021 -10.128 -2.157 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -11.387 -8.495 -2.100 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.073 -9.371 -2.358 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.687 -11.012 -2.378 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -10.566 -8.885 -4.381 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -9.228 -9.978 -4.675 1.00 0.00 H new ATOM 0 HE ARG A 62 -12.065 -10.840 -4.231 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -8.948 -11.375 -5.895 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -9.542 -12.841 -6.682 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -12.727 -12.670 -5.140 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.694 -13.576 -6.250 1.00 0.00 H new ATOM 805 N THR A 63 -12.427 -11.469 0.408 1.00 0.00 N ATOM 806 CA THR A 63 -12.753 -12.780 0.932 1.00 0.00 C ATOM 807 C THR A 63 -13.716 -13.458 -0.051 1.00 0.00 C ATOM 808 O THR A 63 -14.012 -12.920 -1.123 1.00 0.00 O ATOM 809 CB THR A 63 -13.291 -12.672 2.375 1.00 0.00 C ATOM 810 OG1 THR A 63 -14.295 -11.676 2.519 1.00 0.00 O ATOM 811 CG2 THR A 63 -12.156 -12.337 3.342 1.00 0.00 C ATOM 0 H THR A 63 -13.248 -10.904 0.191 1.00 0.00 H new ATOM 0 HA THR A 63 -11.866 -13.409 1.012 1.00 0.00 H new ATOM 0 HB THR A 63 -13.731 -13.643 2.604 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.601 -11.652 3.450 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.551 -12.264 4.355 1.00 0.00 H new ATOM 0 HG22 THR A 63 -11.401 -13.122 3.302 1.00 0.00 H new ATOM 0 HG23 THR A 63 -11.706 -11.386 3.059 1.00 0.00 H new ATOM 819 N ASP A 64 -14.175 -14.673 0.231 1.00 0.00 N ATOM 820 CA ASP A 64 -15.108 -15.355 -0.655 1.00 0.00 C ATOM 821 C ASP A 64 -16.479 -14.656 -0.619 1.00 0.00 C ATOM 822 O ASP A 64 -17.021 -14.347 -1.681 1.00 0.00 O ATOM 823 CB ASP A 64 -15.208 -16.853 -0.331 1.00 0.00 C ATOM 824 CG ASP A 64 -16.079 -17.133 0.885 1.00 0.00 C ATOM 825 OD1 ASP A 64 -15.685 -16.735 2.003 1.00 0.00 O ATOM 826 OD2 ASP A 64 -17.201 -17.655 0.716 1.00 0.00 O ATOM 0 H ASP A 64 -13.917 -15.203 1.063 1.00 0.00 H new ATOM 0 HA ASP A 64 -14.727 -15.291 -1.674 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -15.615 -17.381 -1.194 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -14.208 -17.250 -0.156 1.00 0.00 H new ATOM 831 N THR A 65 -17.012 -14.308 0.559 1.00 0.00 N ATOM 832 CA THR A 65 -18.325 -13.666 0.665 1.00 0.00 C ATOM 833 C THR A 65 -18.311 -12.145 0.467 1.00 0.00 C ATOM 834 O THR A 65 -19.352 -11.574 0.130 1.00 0.00 O ATOM 835 CB THR A 65 -18.975 -13.982 2.027 1.00 0.00 C ATOM 836 OG1 THR A 65 -18.253 -13.390 3.096 1.00 0.00 O ATOM 837 CG2 THR A 65 -19.118 -15.470 2.350 1.00 0.00 C ATOM 0 H THR A 65 -16.550 -14.462 1.455 1.00 0.00 H new ATOM 0 HA THR A 65 -18.907 -14.085 -0.156 1.00 0.00 H new ATOM 0 HB THR A 65 -19.976 -13.562 1.930 1.00 0.00 H new ATOM 0 HG1 THR A 65 -18.690 -13.607 3.946 1.00 0.00 H new ATOM 0 HG21 THR A 65 -19.585 -15.587 3.328 1.00 0.00 H new ATOM 0 HG22 THR A 65 -19.738 -15.949 1.592 1.00 0.00 H new ATOM 0 HG23 THR A 65 -18.133 -15.936 2.361 1.00 0.00 H new ATOM 845 N ALA A 66 -17.172 -11.469 0.675 1.00 0.00 N ATOM 846 CA ALA A 66 -17.066 -10.028 0.552 1.00 0.00 C ATOM 847 C ALA A 66 -15.795 -9.623 -0.167 1.00 0.00 C ATOM 848 O ALA A 66 -14.975 -10.451 -0.550 1.00 0.00 O ATOM 849 CB ALA A 66 -17.117 -9.421 1.961 1.00 0.00 C ATOM 0 H ALA A 66 -16.296 -11.922 0.935 1.00 0.00 H new ATOM 0 HA ALA A 66 -17.896 -9.653 -0.047 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -17.039 -8.336 1.893 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.060 -9.688 2.438 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -16.288 -9.808 2.554 1.00 0.00 H new ATOM 855 N VAL A 67 -15.676 -8.330 -0.419 1.00 0.00 N ATOM 856 CA VAL A 67 -14.536 -7.720 -1.070 1.00 0.00 C ATOM 857 C VAL A 67 -14.340 -6.389 -0.361 1.00 0.00 C ATOM 858 O VAL A 67 -15.314 -5.645 -0.210 1.00 0.00 O ATOM 859 CB VAL A 67 -14.780 -7.495 -2.580 1.00 0.00 C ATOM 860 CG1 VAL A 67 -13.463 -7.205 -3.306 1.00 0.00 C ATOM 861 CG2 VAL A 67 -15.444 -8.676 -3.300 1.00 0.00 C ATOM 0 H VAL A 67 -16.398 -7.655 -0.166 1.00 0.00 H new ATOM 0 HA VAL A 67 -13.659 -8.364 -1.005 1.00 0.00 H new ATOM 0 HB VAL A 67 -15.463 -6.647 -2.619 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -13.659 -7.050 -4.367 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -13.006 -6.309 -2.887 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -12.785 -8.050 -3.182 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -15.577 -8.431 -4.354 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -14.812 -9.559 -3.210 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -16.416 -8.877 -2.849 1.00 0.00 H new ATOM 871 N PHE A 68 -13.114 -6.090 0.061 1.00 0.00 N ATOM 872 CA PHE A 68 -12.765 -4.836 0.712 1.00 0.00 C ATOM 873 C PHE A 68 -11.656 -4.153 -0.104 1.00 0.00 C ATOM 874 O PHE A 68 -11.084 -3.180 0.361 1.00 0.00 O ATOM 875 CB PHE A 68 -12.351 -5.050 2.183 1.00 0.00 C ATOM 876 CG PHE A 68 -13.228 -5.954 3.040 1.00 0.00 C ATOM 877 CD1 PHE A 68 -14.634 -5.866 2.997 1.00 0.00 C ATOM 878 CD2 PHE A 68 -12.623 -6.881 3.913 1.00 0.00 C ATOM 879 CE1 PHE A 68 -15.422 -6.722 3.787 1.00 0.00 C ATOM 880 CE2 PHE A 68 -13.412 -7.727 4.714 1.00 0.00 C ATOM 881 CZ PHE A 68 -14.813 -7.656 4.642 1.00 0.00 C ATOM 0 H PHE A 68 -12.323 -6.726 -0.043 1.00 0.00 H new ATOM 0 HA PHE A 68 -13.640 -4.187 0.741 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -11.340 -5.457 2.191 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -12.305 -4.073 2.664 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -15.108 -5.138 2.355 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.546 -6.942 3.967 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.499 -6.661 3.736 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -12.941 -8.431 5.384 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.420 -8.317 5.242 1.00 0.00 H new ATOM 891 N ASN A 69 -11.362 -4.635 -1.321 1.00 0.00 N ATOM 892 CA ASN A 69 -10.305 -4.093 -2.174 1.00 0.00 C ATOM 893 C ASN A 69 -10.403 -2.582 -2.380 1.00 0.00 C ATOM 894 O ASN A 69 -11.469 -2.048 -2.716 1.00 0.00 O ATOM 895 CB ASN A 69 -10.159 -4.845 -3.517 1.00 0.00 C ATOM 896 CG ASN A 69 -10.850 -4.201 -4.718 1.00 0.00 C ATOM 897 OD1 ASN A 69 -11.918 -4.643 -5.139 1.00 0.00 O ATOM 898 ND2 ASN A 69 -10.265 -3.186 -5.332 1.00 0.00 N ATOM 0 H ASN A 69 -11.859 -5.420 -1.741 1.00 0.00 H new ATOM 0 HA ASN A 69 -9.385 -4.268 -1.616 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -9.097 -4.944 -3.743 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -10.554 -5.853 -3.392 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.699 -2.769 -6.155 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -9.379 -2.820 -4.982 1.00 0.00 H new ATOM 905 N ASP A 70 -9.254 -1.936 -2.243 1.00 0.00 N ATOM 906 CA ASP A 70 -9.007 -0.510 -2.396 1.00 0.00 C ATOM 907 C ASP A 70 -8.741 -0.234 -3.876 1.00 0.00 C ATOM 908 O ASP A 70 -8.402 -1.152 -4.646 1.00 0.00 O ATOM 909 CB ASP A 70 -7.780 -0.126 -1.553 1.00 0.00 C ATOM 910 CG ASP A 70 -7.164 1.220 -1.950 1.00 0.00 C ATOM 911 OD1 ASP A 70 -7.898 2.216 -2.129 1.00 0.00 O ATOM 912 OD2 ASP A 70 -5.929 1.202 -2.177 1.00 0.00 O ATOM 0 H ASP A 70 -8.400 -2.438 -2.002 1.00 0.00 H new ATOM 0 HA ASP A 70 -9.863 0.076 -2.061 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.068 -0.089 -0.502 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -7.024 -0.905 -1.650 1.00 0.00 H new ATOM 917 N LEU A 71 -8.998 1.001 -4.300 1.00 0.00 N ATOM 918 CA LEU A 71 -8.801 1.485 -5.652 1.00 0.00 C ATOM 919 C LEU A 71 -8.266 2.918 -5.547 1.00 0.00 C ATOM 920 O LEU A 71 -9.037 3.828 -5.238 1.00 0.00 O ATOM 921 CB LEU A 71 -10.128 1.396 -6.417 1.00 0.00 C ATOM 922 CG LEU A 71 -10.280 0.069 -7.195 1.00 0.00 C ATOM 923 CD1 LEU A 71 -11.649 -0.592 -6.992 1.00 0.00 C ATOM 924 CD2 LEU A 71 -10.044 0.281 -8.694 1.00 0.00 C ATOM 0 H LEU A 71 -9.366 1.720 -3.677 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.080 0.885 -6.208 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.955 1.497 -5.714 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.198 2.231 -7.114 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.522 -0.601 -6.789 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -11.694 -1.519 -7.564 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.794 -0.811 -5.934 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -12.433 0.083 -7.334 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -10.157 -0.668 -9.218 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -10.770 0.997 -9.079 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -9.037 0.665 -8.853 1.00 0.00 H new ATOM 936 N ILE A 72 -6.969 3.110 -5.812 1.00 0.00 N ATOM 937 CA ILE A 72 -6.280 4.396 -5.743 1.00 0.00 C ATOM 938 C ILE A 72 -6.435 5.145 -7.063 1.00 0.00 C ATOM 939 O ILE A 72 -6.182 4.571 -8.130 1.00 0.00 O ATOM 940 CB ILE A 72 -4.776 4.155 -5.469 1.00 0.00 C ATOM 941 CG1 ILE A 72 -4.506 3.502 -4.098 1.00 0.00 C ATOM 942 CG2 ILE A 72 -3.914 5.414 -5.651 1.00 0.00 C ATOM 943 CD1 ILE A 72 -3.697 2.211 -4.238 1.00 0.00 C ATOM 0 H ILE A 72 -6.353 2.346 -6.089 1.00 0.00 H new ATOM 0 HA ILE A 72 -6.715 4.991 -4.940 1.00 0.00 H new ATOM 0 HB ILE A 72 -4.471 3.442 -6.236 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -3.967 4.203 -3.461 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.454 3.286 -3.604 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.871 5.174 -5.443 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.007 5.773 -6.676 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.252 6.189 -4.963 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.526 1.780 -3.252 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.249 1.501 -4.854 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.739 2.431 -4.708 1.00 0.00 H new ATOM 955 N LEU A 73 -6.897 6.390 -6.976 1.00 0.00 N ATOM 956 CA LEU A 73 -7.093 7.332 -8.073 1.00 0.00 C ATOM 957 C LEU A 73 -6.048 8.452 -7.992 1.00 0.00 C ATOM 958 O LEU A 73 -5.479 8.685 -6.927 1.00 0.00 O ATOM 959 CB LEU A 73 -8.520 7.910 -8.012 1.00 0.00 C ATOM 960 CG LEU A 73 -9.531 7.215 -8.935 1.00 0.00 C ATOM 961 CD1 LEU A 73 -9.250 7.536 -10.408 1.00 0.00 C ATOM 962 CD2 LEU A 73 -9.586 5.695 -8.708 1.00 0.00 C ATOM 0 H LEU A 73 -7.162 6.793 -6.077 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.968 6.814 -9.024 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -8.881 7.845 -6.985 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -8.481 8.968 -8.270 1.00 0.00 H new ATOM 0 HG LEU A 73 -10.513 7.613 -8.677 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -9.982 7.030 -11.037 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -9.319 8.612 -10.565 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -8.249 7.194 -10.670 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -10.316 5.252 -9.385 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -8.604 5.263 -8.900 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -9.877 5.491 -7.678 1.00 0.00 H new ATOM 974 N ASP A 74 -5.873 9.155 -9.116 1.00 0.00 N ATOM 975 CA ASP A 74 -4.994 10.306 -9.391 1.00 0.00 C ATOM 976 C ASP A 74 -3.632 10.264 -8.679 1.00 0.00 C ATOM 977 O ASP A 74 -3.115 11.280 -8.224 1.00 0.00 O ATOM 978 CB ASP A 74 -5.774 11.622 -9.209 1.00 0.00 C ATOM 979 CG ASP A 74 -6.789 11.926 -10.322 1.00 0.00 C ATOM 980 OD1 ASP A 74 -6.993 11.101 -11.249 1.00 0.00 O ATOM 981 OD2 ASP A 74 -7.403 13.017 -10.293 1.00 0.00 O ATOM 0 H ASP A 74 -6.402 8.906 -9.952 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.698 10.243 -10.438 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -6.301 11.587 -8.255 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -5.062 12.445 -9.150 1.00 0.00 H new ATOM 986 N PHE A 75 -3.035 9.073 -8.627 1.00 0.00 N ATOM 987 CA PHE A 75 -1.753 8.820 -7.975 1.00 0.00 C ATOM 988 C PHE A 75 -0.568 9.442 -8.707 1.00 0.00 C ATOM 989 O PHE A 75 -0.409 9.208 -9.910 1.00 0.00 O ATOM 990 CB PHE A 75 -1.518 7.308 -7.907 1.00 0.00 C ATOM 991 CG PHE A 75 -0.253 6.914 -7.170 1.00 0.00 C ATOM 992 CD1 PHE A 75 -0.243 6.917 -5.767 1.00 0.00 C ATOM 993 CD2 PHE A 75 0.917 6.580 -7.875 1.00 0.00 C ATOM 994 CE1 PHE A 75 0.923 6.568 -5.061 1.00 0.00 C ATOM 995 CE2 PHE A 75 2.077 6.212 -7.170 1.00 0.00 C ATOM 996 CZ PHE A 75 2.085 6.212 -5.765 1.00 0.00 C ATOM 0 H PHE A 75 -3.441 8.237 -9.048 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.812 9.275 -6.986 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -2.372 6.839 -7.418 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -1.474 6.911 -8.921 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -1.137 7.189 -5.225 1.00 0.00 H new ATOM 0 HD2 PHE A 75 0.925 6.606 -8.955 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.924 6.574 -3.981 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.967 5.928 -7.712 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.982 5.939 -5.228 1.00 0.00 H new ATOM 1006 N GLU A 76 0.317 10.134 -7.990 1.00 0.00 N ATOM 1007 CA GLU A 76 1.509 10.764 -8.538 1.00 0.00 C ATOM 1008 C GLU A 76 2.670 10.595 -7.539 1.00 0.00 C ATOM 1009 O GLU A 76 2.857 11.415 -6.638 1.00 0.00 O ATOM 1010 CB GLU A 76 1.185 12.226 -8.899 1.00 0.00 C ATOM 1011 CG GLU A 76 2.266 12.918 -9.747 1.00 0.00 C ATOM 1012 CD GLU A 76 2.442 12.351 -11.163 1.00 0.00 C ATOM 1013 OE1 GLU A 76 1.444 12.049 -11.868 1.00 0.00 O ATOM 1014 OE2 GLU A 76 3.596 12.239 -11.633 1.00 0.00 O ATOM 0 H GLU A 76 0.218 10.273 -6.984 1.00 0.00 H new ATOM 0 HA GLU A 76 1.832 10.288 -9.464 1.00 0.00 H new ATOM 0 HB2 GLU A 76 0.240 12.254 -9.441 1.00 0.00 H new ATOM 0 HB3 GLU A 76 1.042 12.793 -7.979 1.00 0.00 H new ATOM 0 HG2 GLU A 76 2.023 13.978 -9.824 1.00 0.00 H new ATOM 0 HG3 GLU A 76 3.219 12.847 -9.222 1.00 0.00 H new ATOM 1021 N ALA A 77 3.495 9.552 -7.728 1.00 0.00 N ATOM 1022 CA ALA A 77 4.657 9.209 -6.886 1.00 0.00 C ATOM 1023 C ALA A 77 5.619 10.380 -6.618 1.00 0.00 C ATOM 1024 O ALA A 77 6.359 10.354 -5.630 1.00 0.00 O ATOM 1025 CB ALA A 77 5.429 8.050 -7.522 1.00 0.00 C ATOM 0 H ALA A 77 3.367 8.898 -8.501 1.00 0.00 H new ATOM 0 HA ALA A 77 4.249 8.927 -5.916 1.00 0.00 H new ATOM 0 HB1 ALA A 77 6.287 7.799 -6.898 1.00 0.00 H new ATOM 0 HB2 ALA A 77 4.776 7.182 -7.608 1.00 0.00 H new ATOM 0 HB3 ALA A 77 5.775 8.344 -8.513 1.00 0.00 H new ATOM 1031 N SER A 78 5.607 11.405 -7.475 1.00 0.00 N ATOM 1032 CA SER A 78 6.418 12.608 -7.356 1.00 0.00 C ATOM 1033 C SER A 78 6.168 13.292 -6.001 1.00 0.00 C ATOM 1034 O SER A 78 7.029 14.048 -5.539 1.00 0.00 O ATOM 1035 CB SER A 78 6.067 13.545 -8.524 1.00 0.00 C ATOM 1036 OG SER A 78 7.067 14.511 -8.778 1.00 0.00 O ATOM 0 H SER A 78 5.007 11.415 -8.300 1.00 0.00 H new ATOM 0 HA SER A 78 7.477 12.354 -7.400 1.00 0.00 H new ATOM 0 HB2 SER A 78 5.907 12.951 -9.424 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.127 14.052 -8.306 1.00 0.00 H new ATOM 0 HG SER A 78 6.792 15.077 -9.530 1.00 0.00 H new ATOM 1042 N GLU A 79 5.010 13.058 -5.371 1.00 0.00 N ATOM 1043 CA GLU A 79 4.674 13.627 -4.080 1.00 0.00 C ATOM 1044 C GLU A 79 3.862 12.681 -3.184 1.00 0.00 C ATOM 1045 O GLU A 79 4.051 12.778 -1.968 1.00 0.00 O ATOM 1046 CB GLU A 79 4.086 15.047 -4.201 1.00 0.00 C ATOM 1047 CG GLU A 79 3.352 15.486 -5.479 1.00 0.00 C ATOM 1048 CD GLU A 79 3.296 17.018 -5.520 1.00 0.00 C ATOM 1049 OE1 GLU A 79 2.659 17.678 -4.669 1.00 0.00 O ATOM 1050 OE2 GLU A 79 4.026 17.606 -6.362 1.00 0.00 O ATOM 0 H GLU A 79 4.279 12.460 -5.756 1.00 0.00 H new ATOM 0 HA GLU A 79 5.616 13.748 -3.545 1.00 0.00 H new ATOM 0 HB2 GLU A 79 3.392 15.179 -3.371 1.00 0.00 H new ATOM 0 HB3 GLU A 79 4.906 15.748 -4.045 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.868 15.104 -6.360 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.344 15.072 -5.496 1.00 0.00 H new ATOM 1057 N ASP A 80 3.065 11.745 -3.721 1.00 0.00 N ATOM 1058 CA ASP A 80 2.261 10.821 -2.901 1.00 0.00 C ATOM 1059 C ASP A 80 3.143 9.908 -2.044 1.00 0.00 C ATOM 1060 O ASP A 80 4.220 9.476 -2.479 1.00 0.00 O ATOM 1061 CB ASP A 80 1.352 9.900 -3.750 1.00 0.00 C ATOM 1062 CG ASP A 80 -0.012 10.464 -4.090 1.00 0.00 C ATOM 1063 OD1 ASP A 80 -0.633 11.030 -3.165 1.00 0.00 O ATOM 1064 OD2 ASP A 80 -0.466 10.182 -5.219 1.00 0.00 O ATOM 0 H ASP A 80 2.959 11.606 -4.726 1.00 0.00 H new ATOM 0 HA ASP A 80 1.648 11.469 -2.275 1.00 0.00 H new ATOM 0 HB2 ASP A 80 1.870 9.664 -4.679 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.214 8.961 -3.214 1.00 0.00 H new ATOM 1069 N ARG A 81 2.674 9.534 -0.843 1.00 0.00 N ATOM 1070 CA ARG A 81 3.406 8.679 0.093 1.00 0.00 C ATOM 1071 C ARG A 81 2.490 7.603 0.675 1.00 0.00 C ATOM 1072 O ARG A 81 1.291 7.809 0.830 1.00 0.00 O ATOM 1073 CB ARG A 81 4.045 9.546 1.186 1.00 0.00 C ATOM 1074 CG ARG A 81 4.698 10.828 0.632 1.00 0.00 C ATOM 1075 CD ARG A 81 5.838 11.312 1.503 1.00 0.00 C ATOM 1076 NE ARG A 81 5.440 11.647 2.871 1.00 0.00 N ATOM 1077 CZ ARG A 81 6.227 11.534 3.941 1.00 0.00 C ATOM 1078 NH1 ARG A 81 7.425 10.954 3.857 1.00 0.00 N ATOM 1079 NH2 ARG A 81 5.792 12.000 5.096 1.00 0.00 N ATOM 0 H ARG A 81 1.761 9.824 -0.494 1.00 0.00 H new ATOM 0 HA ARG A 81 4.204 8.159 -0.437 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.284 9.819 1.917 1.00 0.00 H new ATOM 0 HB3 ARG A 81 4.798 8.960 1.713 1.00 0.00 H new ATOM 0 HG2 ARG A 81 5.068 10.639 -0.376 1.00 0.00 H new ATOM 0 HG3 ARG A 81 3.945 11.612 0.553 1.00 0.00 H new ATOM 0 HD2 ARG A 81 6.608 10.541 1.538 1.00 0.00 H new ATOM 0 HD3 ARG A 81 6.287 12.191 1.041 1.00 0.00 H new ATOM 0 HE ARG A 81 4.491 11.992 3.016 1.00 0.00 H new ATOM 0 HH11 ARG A 81 7.753 10.588 2.963 1.00 0.00 H new ATOM 0 HH12 ARG A 81 8.013 10.877 4.687 1.00 0.00 H new ATOM 0 HH21 ARG A 81 4.871 12.435 5.156 1.00 0.00 H new ATOM 0 HH22 ARG A 81 6.376 11.925 5.929 1.00 0.00 H new ATOM 1093 N ILE A 82 3.034 6.458 1.106 1.00 0.00 N ATOM 1094 CA ILE A 82 2.230 5.358 1.644 1.00 0.00 C ATOM 1095 C ILE A 82 2.884 4.755 2.894 1.00 0.00 C ATOM 1096 O ILE A 82 4.080 4.442 2.880 1.00 0.00 O ATOM 1097 CB ILE A 82 2.022 4.275 0.549 1.00 0.00 C ATOM 1098 CG1 ILE A 82 1.792 4.756 -0.898 1.00 0.00 C ATOM 1099 CG2 ILE A 82 0.837 3.369 0.934 1.00 0.00 C ATOM 1100 CD1 ILE A 82 3.071 5.010 -1.711 1.00 0.00 C ATOM 0 H ILE A 82 4.036 6.270 1.091 1.00 0.00 H new ATOM 0 HA ILE A 82 1.257 5.750 1.941 1.00 0.00 H new ATOM 0 HB ILE A 82 2.982 3.760 0.529 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.190 4.013 -1.420 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.209 5.676 -0.870 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.694 2.611 0.164 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.045 2.883 1.887 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.067 3.971 1.023 1.00 0.00 H new ATOM 0 HD11 ILE A 82 2.804 5.344 -2.714 1.00 0.00 H new ATOM 0 HD12 ILE A 82 3.668 5.778 -1.219 1.00 0.00 H new ATOM 0 HD13 ILE A 82 3.649 4.088 -1.778 1.00 0.00 H new ATOM 1112 N ASP A 83 2.132 4.593 3.989 1.00 0.00 N ATOM 1113 CA ASP A 83 2.667 3.999 5.231 1.00 0.00 C ATOM 1114 C ASP A 83 2.260 2.523 5.312 1.00 0.00 C ATOM 1115 O ASP A 83 1.143 2.201 5.715 1.00 0.00 O ATOM 1116 CB ASP A 83 2.213 4.765 6.484 1.00 0.00 C ATOM 1117 CG ASP A 83 2.865 4.257 7.786 1.00 0.00 C ATOM 1118 OD1 ASP A 83 3.498 3.173 7.812 1.00 0.00 O ATOM 1119 OD2 ASP A 83 2.784 4.989 8.803 1.00 0.00 O ATOM 0 H ASP A 83 1.150 4.863 4.045 1.00 0.00 H new ATOM 0 HA ASP A 83 3.754 4.072 5.199 1.00 0.00 H new ATOM 0 HB2 ASP A 83 2.447 5.822 6.358 1.00 0.00 H new ATOM 0 HB3 ASP A 83 1.130 4.687 6.575 1.00 0.00 H new ATOM 1124 N LEU A 84 3.153 1.622 4.880 1.00 0.00 N ATOM 1125 CA LEU A 84 2.946 0.170 4.874 1.00 0.00 C ATOM 1126 C LEU A 84 3.409 -0.501 6.173 1.00 0.00 C ATOM 1127 O LEU A 84 3.350 -1.729 6.252 1.00 0.00 O ATOM 1128 CB LEU A 84 3.648 -0.487 3.658 1.00 0.00 C ATOM 1129 CG LEU A 84 2.792 -0.512 2.376 1.00 0.00 C ATOM 1130 CD1 LEU A 84 2.946 0.774 1.568 1.00 0.00 C ATOM 1131 CD2 LEU A 84 3.207 -1.670 1.464 1.00 0.00 C ATOM 0 H LEU A 84 4.066 1.893 4.515 1.00 0.00 H new ATOM 0 HA LEU A 84 1.870 0.015 4.794 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.574 0.050 3.453 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.923 -1.509 3.919 1.00 0.00 H new ATOM 0 HG LEU A 84 1.758 -0.626 2.703 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.327 0.717 0.672 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.631 1.624 2.173 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.990 0.900 1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.588 -1.666 0.567 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.254 -1.555 1.184 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.074 -2.614 1.992 1.00 0.00 H new ATOM 1143 N SER A 85 3.837 0.234 7.205 1.00 0.00 N ATOM 1144 CA SER A 85 4.305 -0.395 8.442 1.00 0.00 C ATOM 1145 C SER A 85 3.260 -1.321 9.081 1.00 0.00 C ATOM 1146 O SER A 85 3.612 -2.361 9.643 1.00 0.00 O ATOM 1147 CB SER A 85 4.831 0.669 9.410 1.00 0.00 C ATOM 1148 OG SER A 85 3.823 1.594 9.784 1.00 0.00 O ATOM 0 H SER A 85 3.869 1.254 7.208 1.00 0.00 H new ATOM 0 HA SER A 85 5.135 -1.053 8.185 1.00 0.00 H new ATOM 0 HB2 SER A 85 5.226 0.183 10.302 1.00 0.00 H new ATOM 0 HB3 SER A 85 5.659 1.204 8.945 1.00 0.00 H new ATOM 0 HG SER A 85 3.843 2.363 9.176 1.00 0.00 H new ATOM 1154 N ALA A 86 1.972 -0.973 8.975 1.00 0.00 N ATOM 1155 CA ALA A 86 0.884 -1.768 9.527 1.00 0.00 C ATOM 1156 C ALA A 86 0.443 -2.897 8.585 1.00 0.00 C ATOM 1157 O ALA A 86 0.010 -3.949 9.062 1.00 0.00 O ATOM 1158 CB ALA A 86 -0.311 -0.855 9.827 1.00 0.00 C ATOM 0 H ALA A 86 1.660 -0.126 8.500 1.00 0.00 H new ATOM 0 HA ALA A 86 1.251 -2.234 10.442 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -1.127 -1.448 10.240 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -0.015 -0.093 10.548 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -0.642 -0.374 8.906 1.00 0.00 H new ATOM 1164 N LEU A 87 0.575 -2.729 7.264 1.00 0.00 N ATOM 1165 CA LEU A 87 0.169 -3.697 6.237 1.00 0.00 C ATOM 1166 C LEU A 87 1.372 -4.080 5.371 1.00 0.00 C ATOM 1167 O LEU A 87 1.388 -3.862 4.159 1.00 0.00 O ATOM 1168 CB LEU A 87 -0.978 -3.112 5.383 1.00 0.00 C ATOM 1169 CG LEU A 87 -2.412 -3.168 5.939 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -3.003 -4.573 5.904 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -2.568 -2.643 7.367 1.00 0.00 C ATOM 0 H LEU A 87 0.983 -1.883 6.865 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.199 -4.603 6.719 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.741 -2.067 5.182 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.974 -3.630 4.424 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.954 -2.504 5.266 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.015 -4.552 6.308 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.030 -4.931 4.875 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.386 -5.242 6.504 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.611 -2.722 7.672 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.947 -3.233 8.041 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.257 -1.599 7.407 1.00 0.00 H new ATOM 1183 N GLY A 88 2.396 -4.702 5.952 1.00 0.00 N ATOM 1184 CA GLY A 88 3.562 -5.085 5.205 1.00 0.00 C ATOM 1185 C GLY A 88 4.198 -6.296 5.839 1.00 0.00 C ATOM 1186 O GLY A 88 3.587 -7.363 5.941 1.00 0.00 O ATOM 0 H GLY A 88 2.429 -4.946 6.942 1.00 0.00 H new ATOM 0 HA2 GLY A 88 3.288 -5.305 4.173 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.275 -4.261 5.177 1.00 0.00 H new ATOM 1190 N PHE A 89 5.428 -6.081 6.266 1.00 0.00 N ATOM 1191 CA PHE A 89 6.422 -6.943 6.895 1.00 0.00 C ATOM 1192 C PHE A 89 7.730 -6.133 6.793 1.00 0.00 C ATOM 1193 O PHE A 89 7.694 -4.917 6.574 1.00 0.00 O ATOM 1194 CB PHE A 89 6.480 -8.325 6.186 1.00 0.00 C ATOM 1195 CG PHE A 89 5.756 -9.461 6.894 1.00 0.00 C ATOM 1196 CD1 PHE A 89 6.174 -9.873 8.176 1.00 0.00 C ATOM 1197 CD2 PHE A 89 4.753 -10.195 6.231 1.00 0.00 C ATOM 1198 CE1 PHE A 89 5.603 -11.006 8.785 1.00 0.00 C ATOM 1199 CE2 PHE A 89 4.175 -11.323 6.844 1.00 0.00 C ATOM 1200 CZ PHE A 89 4.606 -11.736 8.116 1.00 0.00 C ATOM 0 H PHE A 89 5.817 -5.144 6.163 1.00 0.00 H new ATOM 0 HA PHE A 89 6.200 -7.190 7.933 1.00 0.00 H new ATOM 0 HB2 PHE A 89 6.059 -8.218 5.186 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.526 -8.606 6.063 1.00 0.00 H new ATOM 0 HD1 PHE A 89 6.939 -9.314 8.695 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.426 -9.891 5.248 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.931 -11.314 9.767 1.00 0.00 H new ATOM 0 HE2 PHE A 89 3.397 -11.873 6.335 1.00 0.00 H new ATOM 0 HZ PHE A 89 4.173 -12.611 8.578 1.00 0.00 H new ATOM 1210 N SER A 90 8.874 -6.772 7.022 1.00 0.00 N ATOM 1211 CA SER A 90 10.210 -6.182 6.951 1.00 0.00 C ATOM 1212 C SER A 90 11.150 -7.010 6.042 1.00 0.00 C ATOM 1213 O SER A 90 12.340 -6.698 5.936 1.00 0.00 O ATOM 1214 CB SER A 90 10.751 -6.029 8.369 1.00 0.00 C ATOM 1215 OG SER A 90 9.967 -5.127 9.147 1.00 0.00 O ATOM 0 H SER A 90 8.897 -7.760 7.274 1.00 0.00 H new ATOM 0 HA SER A 90 10.153 -5.195 6.491 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.772 -7.004 8.856 1.00 0.00 H new ATOM 0 HB3 SER A 90 11.780 -5.672 8.328 1.00 0.00 H new ATOM 0 HG SER A 90 10.346 -5.058 10.048 1.00 0.00 H new ATOM 1221 N GLY A 91 10.640 -8.056 5.386 1.00 0.00 N ATOM 1222 CA GLY A 91 11.361 -8.946 4.474 1.00 0.00 C ATOM 1223 C GLY A 91 10.831 -8.806 3.048 1.00 0.00 C ATOM 1224 O GLY A 91 9.749 -8.253 2.840 1.00 0.00 O ATOM 0 H GLY A 91 9.659 -8.318 5.483 1.00 0.00 H new ATOM 0 HA2 GLY A 91 12.425 -8.712 4.496 1.00 0.00 H new ATOM 0 HA3 GLY A 91 11.255 -9.979 4.807 1.00 0.00 H new ATOM 1228 N LEU A 92 11.553 -9.326 2.054 1.00 0.00 N ATOM 1229 CA LEU A 92 11.177 -9.241 0.640 1.00 0.00 C ATOM 1230 C LEU A 92 10.820 -10.610 0.067 1.00 0.00 C ATOM 1231 O LEU A 92 11.098 -11.646 0.678 1.00 0.00 O ATOM 1232 CB LEU A 92 12.341 -8.648 -0.169 1.00 0.00 C ATOM 1233 CG LEU A 92 12.889 -7.295 0.316 1.00 0.00 C ATOM 1234 CD1 LEU A 92 14.112 -6.918 -0.522 1.00 0.00 C ATOM 1235 CD2 LEU A 92 11.825 -6.198 0.216 1.00 0.00 C ATOM 0 H LEU A 92 12.428 -9.826 2.210 1.00 0.00 H new ATOM 0 HA LEU A 92 10.298 -8.600 0.569 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.159 -9.368 -0.169 1.00 0.00 H new ATOM 0 HB3 LEU A 92 12.016 -8.535 -1.203 1.00 0.00 H new ATOM 0 HG LEU A 92 13.173 -7.389 1.364 1.00 0.00 H new ATOM 0 HD11 LEU A 92 14.504 -5.960 -0.182 1.00 0.00 H new ATOM 0 HD12 LEU A 92 14.879 -7.684 -0.411 1.00 0.00 H new ATOM 0 HD13 LEU A 92 13.825 -6.841 -1.571 1.00 0.00 H new ATOM 0 HD21 LEU A 92 12.242 -5.254 0.566 1.00 0.00 H new ATOM 0 HD22 LEU A 92 11.508 -6.092 -0.821 1.00 0.00 H new ATOM 0 HD23 LEU A 92 10.967 -6.466 0.832 1.00 0.00 H new ATOM 1247 N GLY A 93 10.176 -10.627 -1.104 1.00 0.00 N ATOM 1248 CA GLY A 93 9.778 -11.842 -1.796 1.00 0.00 C ATOM 1249 C GLY A 93 8.696 -11.549 -2.819 1.00 0.00 C ATOM 1250 O GLY A 93 9.018 -11.079 -3.911 1.00 0.00 O ATOM 0 H GLY A 93 9.915 -9.776 -1.602 1.00 0.00 H new ATOM 0 HA2 GLY A 93 10.643 -12.284 -2.291 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.415 -12.574 -1.075 1.00 0.00 H new ATOM 1254 N ASP A 94 7.430 -11.777 -2.450 1.00 0.00 N ATOM 1255 CA ASP A 94 6.259 -11.583 -3.312 1.00 0.00 C ATOM 1256 C ASP A 94 4.940 -11.500 -2.507 1.00 0.00 C ATOM 1257 O ASP A 94 3.926 -12.056 -2.923 1.00 0.00 O ATOM 1258 CB ASP A 94 6.230 -12.685 -4.396 1.00 0.00 C ATOM 1259 CG ASP A 94 5.547 -12.204 -5.681 1.00 0.00 C ATOM 1260 OD1 ASP A 94 4.337 -11.912 -5.693 1.00 0.00 O ATOM 1261 OD2 ASP A 94 6.259 -12.063 -6.709 1.00 0.00 O ATOM 0 H ASP A 94 7.186 -12.111 -1.518 1.00 0.00 H new ATOM 0 HA ASP A 94 6.348 -10.617 -3.809 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.249 -12.999 -4.622 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.705 -13.559 -4.011 1.00 0.00 H new ATOM 1266 N GLY A 95 4.905 -10.822 -1.348 1.00 0.00 N ATOM 1267 CA GLY A 95 3.674 -10.698 -0.535 1.00 0.00 C ATOM 1268 C GLY A 95 3.227 -12.035 0.036 1.00 0.00 C ATOM 1269 O GLY A 95 2.168 -12.552 -0.319 1.00 0.00 O ATOM 0 H GLY A 95 5.715 -10.349 -0.948 1.00 0.00 H new ATOM 0 HA2 GLY A 95 3.848 -9.996 0.281 1.00 0.00 H new ATOM 0 HA3 GLY A 95 2.875 -10.281 -1.149 1.00 0.00 H new ATOM 1273 N TYR A 96 3.994 -12.538 0.994 1.00 0.00 N ATOM 1274 CA TYR A 96 3.813 -13.810 1.668 1.00 0.00 C ATOM 1275 C TYR A 96 4.203 -13.704 3.146 1.00 0.00 C ATOM 1276 O TYR A 96 4.183 -12.620 3.729 1.00 0.00 O ATOM 1277 CB TYR A 96 4.704 -14.807 0.915 1.00 0.00 C ATOM 1278 CG TYR A 96 4.289 -16.251 0.975 1.00 0.00 C ATOM 1279 CD1 TYR A 96 3.161 -16.673 0.252 1.00 0.00 C ATOM 1280 CD2 TYR A 96 5.097 -17.183 1.645 1.00 0.00 C ATOM 1281 CE1 TYR A 96 2.851 -18.039 0.175 1.00 0.00 C ATOM 1282 CE2 TYR A 96 4.783 -18.546 1.585 1.00 0.00 C ATOM 1283 CZ TYR A 96 3.670 -18.981 0.833 1.00 0.00 C ATOM 1284 OH TYR A 96 3.390 -20.303 0.739 1.00 0.00 O ATOM 0 H TYR A 96 4.810 -12.034 1.341 1.00 0.00 H new ATOM 0 HA TYR A 96 2.772 -14.131 1.658 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.744 -14.506 -0.132 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.717 -14.726 1.309 1.00 0.00 H new ATOM 0 HD1 TYR A 96 2.534 -15.947 -0.244 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.958 -16.850 2.205 1.00 0.00 H new ATOM 0 HE1 TYR A 96 1.989 -18.368 -0.386 1.00 0.00 H new ATOM 0 HE2 TYR A 96 5.392 -19.264 2.114 1.00 0.00 H new ATOM 0 HH TYR A 96 4.052 -20.815 1.249 1.00 0.00 H new ATOM 1294 N GLY A 97 4.493 -14.853 3.759 1.00 0.00 N ATOM 1295 CA GLY A 97 4.894 -15.099 5.133 1.00 0.00 C ATOM 1296 C GLY A 97 6.259 -14.489 5.414 1.00 0.00 C ATOM 1297 O GLY A 97 7.255 -15.182 5.611 1.00 0.00 O ATOM 0 H GLY A 97 4.445 -15.729 3.239 1.00 0.00 H new ATOM 0 HA2 GLY A 97 4.155 -14.677 5.814 1.00 0.00 H new ATOM 0 HA3 GLY A 97 4.924 -16.172 5.321 1.00 0.00 H new ATOM 1301 N GLY A 98 6.269 -13.171 5.467 1.00 0.00 N ATOM 1302 CA GLY A 98 7.438 -12.353 5.726 1.00 0.00 C ATOM 1303 C GLY A 98 7.938 -11.675 4.461 1.00 0.00 C ATOM 1304 O GLY A 98 9.122 -11.343 4.405 1.00 0.00 O ATOM 0 H GLY A 98 5.425 -12.617 5.324 1.00 0.00 H new ATOM 0 HA2 GLY A 98 7.196 -11.597 6.473 1.00 0.00 H new ATOM 0 HA3 GLY A 98 8.231 -12.973 6.145 1.00 0.00 H new ATOM 1308 N THR A 99 7.091 -11.493 3.443 1.00 0.00 N ATOM 1309 CA THR A 99 7.495 -10.868 2.194 1.00 0.00 C ATOM 1310 C THR A 99 6.452 -9.822 1.783 1.00 0.00 C ATOM 1311 O THR A 99 5.303 -9.871 2.232 1.00 0.00 O ATOM 1312 CB THR A 99 7.801 -11.951 1.142 1.00 0.00 C ATOM 1313 OG1 THR A 99 6.670 -12.372 0.447 1.00 0.00 O ATOM 1314 CG2 THR A 99 8.489 -13.211 1.674 1.00 0.00 C ATOM 0 H THR A 99 6.111 -11.776 3.468 1.00 0.00 H new ATOM 0 HA THR A 99 8.427 -10.315 2.307 1.00 0.00 H new ATOM 0 HB THR A 99 8.496 -11.428 0.484 1.00 0.00 H new ATOM 0 HG1 THR A 99 6.843 -13.246 0.039 1.00 0.00 H new ATOM 0 HG21 THR A 99 8.658 -13.907 0.853 1.00 0.00 H new ATOM 0 HG22 THR A 99 9.444 -12.941 2.124 1.00 0.00 H new ATOM 0 HG23 THR A 99 7.855 -13.683 2.425 1.00 0.00 H new ATOM 1322 N LEU A 100 6.832 -8.880 0.916 1.00 0.00 N ATOM 1323 CA LEU A 100 5.996 -7.790 0.417 1.00 0.00 C ATOM 1324 C LEU A 100 6.678 -7.313 -0.862 1.00 0.00 C ATOM 1325 O LEU A 100 7.878 -7.048 -0.812 1.00 0.00 O ATOM 1326 CB LEU A 100 6.015 -6.681 1.480 1.00 0.00 C ATOM 1327 CG LEU A 100 4.958 -5.570 1.391 1.00 0.00 C ATOM 1328 CD1 LEU A 100 5.395 -4.511 2.411 1.00 0.00 C ATOM 1329 CD2 LEU A 100 4.815 -4.919 0.015 1.00 0.00 C ATOM 0 H LEU A 100 7.774 -8.857 0.526 1.00 0.00 H new ATOM 0 HA LEU A 100 4.963 -8.079 0.222 1.00 0.00 H new ATOM 0 HB2 LEU A 100 5.918 -7.155 2.457 1.00 0.00 H new ATOM 0 HB3 LEU A 100 6.997 -6.209 1.451 1.00 0.00 H new ATOM 0 HG LEU A 100 3.979 -6.007 1.588 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.685 -3.684 2.404 1.00 0.00 H new ATOM 0 HD12 LEU A 100 5.425 -4.955 3.406 1.00 0.00 H new ATOM 0 HD13 LEU A 100 6.386 -4.141 2.149 1.00 0.00 H new ATOM 0 HD21 LEU A 100 4.045 -4.148 0.055 1.00 0.00 H new ATOM 0 HD22 LEU A 100 5.764 -4.469 -0.275 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.533 -5.675 -0.718 1.00 0.00 H new ATOM 1341 N LEU A 101 5.987 -7.310 -2.002 1.00 0.00 N ATOM 1342 CA LEU A 101 6.506 -6.876 -3.290 1.00 0.00 C ATOM 1343 C LEU A 101 5.393 -6.221 -4.115 1.00 0.00 C ATOM 1344 O LEU A 101 4.212 -6.509 -3.900 1.00 0.00 O ATOM 1345 CB LEU A 101 7.086 -8.078 -4.000 1.00 0.00 C ATOM 1346 CG LEU A 101 8.473 -7.800 -4.569 1.00 0.00 C ATOM 1347 CD1 LEU A 101 8.551 -6.794 -5.718 1.00 0.00 C ATOM 1348 CD2 LEU A 101 9.569 -7.558 -3.524 1.00 0.00 C ATOM 0 H LEU A 101 5.017 -7.621 -2.051 1.00 0.00 H new ATOM 0 HA LEU A 101 7.289 -6.130 -3.153 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.142 -8.916 -3.305 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.418 -8.378 -4.807 1.00 0.00 H new ATOM 0 HG LEU A 101 8.692 -8.763 -5.030 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.588 -6.683 -6.034 1.00 0.00 H new ATOM 0 HD12 LEU A 101 7.952 -7.151 -6.556 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.168 -5.830 -5.384 1.00 0.00 H new ATOM 0 HD21 LEU A 101 10.517 -7.370 -4.028 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.305 -6.695 -2.913 1.00 0.00 H new ATOM 0 HD23 LEU A 101 9.665 -8.437 -2.887 1.00 0.00 H new ATOM 1360 N LEU A 102 5.747 -5.342 -5.053 1.00 0.00 N ATOM 1361 CA LEU A 102 4.827 -4.676 -5.950 1.00 0.00 C ATOM 1362 C LEU A 102 5.196 -4.986 -7.387 1.00 0.00 C ATOM 1363 O LEU A 102 6.364 -5.236 -7.699 1.00 0.00 O ATOM 1364 CB LEU A 102 4.743 -3.171 -5.695 1.00 0.00 C ATOM 1365 CG LEU A 102 5.745 -2.222 -6.367 1.00 0.00 C ATOM 1366 CD1 LEU A 102 5.275 -0.812 -6.004 1.00 0.00 C ATOM 1367 CD2 LEU A 102 7.187 -2.409 -5.913 1.00 0.00 C ATOM 0 H LEU A 102 6.718 -5.071 -5.207 1.00 0.00 H new ATOM 0 HA LEU A 102 3.827 -5.064 -5.754 1.00 0.00 H new ATOM 0 HB2 LEU A 102 3.744 -2.848 -5.988 1.00 0.00 H new ATOM 0 HB3 LEU A 102 4.825 -3.019 -4.619 1.00 0.00 H new ATOM 0 HG LEU A 102 5.760 -2.421 -7.439 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.946 -0.078 -6.451 1.00 0.00 H new ATOM 0 HD12 LEU A 102 4.264 -0.657 -6.381 1.00 0.00 H new ATOM 0 HD13 LEU A 102 5.280 -0.695 -4.920 1.00 0.00 H new ATOM 0 HD21 LEU A 102 7.828 -1.700 -6.436 1.00 0.00 H new ATOM 0 HD22 LEU A 102 7.256 -2.236 -4.839 1.00 0.00 H new ATOM 0 HD23 LEU A 102 7.511 -3.425 -6.138 1.00 0.00 H new ATOM 1379 N LYS A 103 4.204 -4.953 -8.274 1.00 0.00 N ATOM 1380 CA LYS A 103 4.395 -5.207 -9.686 1.00 0.00 C ATOM 1381 C LYS A 103 3.552 -4.234 -10.480 1.00 0.00 C ATOM 1382 O LYS A 103 2.566 -3.662 -10.012 1.00 0.00 O ATOM 1383 CB LYS A 103 4.111 -6.684 -10.039 1.00 0.00 C ATOM 1384 CG LYS A 103 5.392 -7.473 -10.351 1.00 0.00 C ATOM 1385 CD LYS A 103 5.953 -7.143 -11.744 1.00 0.00 C ATOM 1386 CE LYS A 103 5.130 -7.790 -12.870 1.00 0.00 C ATOM 1387 NZ LYS A 103 4.596 -6.815 -13.845 1.00 0.00 N ATOM 0 H LYS A 103 3.237 -4.746 -8.022 1.00 0.00 H new ATOM 0 HA LYS A 103 5.439 -5.043 -9.952 1.00 0.00 H new ATOM 0 HB2 LYS A 103 3.590 -7.159 -9.208 1.00 0.00 H new ATOM 0 HB3 LYS A 103 3.444 -6.726 -10.900 1.00 0.00 H new ATOM 0 HG2 LYS A 103 6.146 -7.251 -9.596 1.00 0.00 H new ATOM 0 HG3 LYS A 103 5.183 -8.541 -10.289 1.00 0.00 H new ATOM 0 HD2 LYS A 103 5.967 -6.062 -11.881 1.00 0.00 H new ATOM 0 HD3 LYS A 103 6.986 -7.486 -11.808 1.00 0.00 H new ATOM 0 HE2 LYS A 103 5.754 -8.513 -13.396 1.00 0.00 H new ATOM 0 HE3 LYS A 103 4.301 -8.344 -12.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 4.657 -7.214 -14.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 3.602 -6.607 -13.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 5.152 -5.938 -13.799 1.00 0.00 H new ATOM 1401 N THR A 104 3.917 -4.098 -11.733 1.00 0.00 N ATOM 1402 CA THR A 104 3.261 -3.234 -12.676 1.00 0.00 C ATOM 1403 C THR A 104 2.208 -4.087 -13.397 1.00 0.00 C ATOM 1404 O THR A 104 2.262 -5.325 -13.351 1.00 0.00 O ATOM 1405 CB THR A 104 4.374 -2.760 -13.632 1.00 0.00 C ATOM 1406 OG1 THR A 104 5.059 -3.895 -14.136 1.00 0.00 O ATOM 1407 CG2 THR A 104 5.426 -1.893 -12.923 1.00 0.00 C ATOM 0 H THR A 104 4.706 -4.605 -12.134 1.00 0.00 H new ATOM 0 HA THR A 104 2.761 -2.371 -12.236 1.00 0.00 H new ATOM 0 HB THR A 104 3.893 -2.174 -14.415 1.00 0.00 H new ATOM 0 HG1 THR A 104 5.768 -3.605 -14.747 1.00 0.00 H new ATOM 0 HG21 THR A 104 6.187 -1.585 -13.640 1.00 0.00 H new ATOM 0 HG22 THR A 104 4.946 -1.010 -12.502 1.00 0.00 H new ATOM 0 HG23 THR A 104 5.892 -2.468 -12.123 1.00 0.00 H new ATOM 1415 N ASN A 105 1.207 -3.454 -14.007 1.00 0.00 N ATOM 1416 CA ASN A 105 0.161 -4.137 -14.773 1.00 0.00 C ATOM 1417 C ASN A 105 0.795 -4.625 -16.101 1.00 0.00 C ATOM 1418 O ASN A 105 2.009 -4.517 -16.261 1.00 0.00 O ATOM 1419 CB ASN A 105 -1.037 -3.249 -14.926 1.00 0.00 C ATOM 1420 CG ASN A 105 -2.256 -3.883 -15.575 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -2.693 -4.962 -15.159 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -2.825 -3.265 -16.574 1.00 0.00 N ATOM 0 H ASN A 105 1.097 -2.440 -13.984 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.222 -5.017 -14.257 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -1.323 -2.885 -13.939 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -0.747 -2.379 -15.515 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -3.644 -3.672 -17.025 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -2.450 -2.375 -16.903 1.00 0.00 H new ATOM 1429 N ALA A 106 0.036 -5.145 -17.069 1.00 0.00 N ATOM 1430 CA ALA A 106 0.596 -5.594 -18.346 1.00 0.00 C ATOM 1431 C ALA A 106 1.473 -4.514 -18.990 1.00 0.00 C ATOM 1432 O ALA A 106 2.646 -4.709 -19.228 1.00 0.00 O ATOM 1433 CB ALA A 106 -0.514 -6.020 -19.307 1.00 0.00 C ATOM 0 H ALA A 106 -0.974 -5.266 -16.991 1.00 0.00 H new ATOM 0 HA ALA A 106 1.228 -6.457 -18.137 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -0.074 -6.349 -20.248 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -1.083 -6.839 -18.866 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -1.178 -5.176 -19.493 1.00 0.00 H new ATOM 1439 N GLU A 107 0.869 -3.321 -19.176 1.00 0.00 N ATOM 1440 CA GLU A 107 1.486 -2.163 -19.791 1.00 0.00 C ATOM 1441 C GLU A 107 2.082 -1.166 -18.764 1.00 0.00 C ATOM 1442 O GLU A 107 2.643 -0.141 -19.141 1.00 0.00 O ATOM 1443 CB GLU A 107 0.425 -1.552 -20.724 1.00 0.00 C ATOM 1444 CG GLU A 107 1.021 -0.693 -21.844 1.00 0.00 C ATOM 1445 CD GLU A 107 0.210 -0.884 -23.122 1.00 0.00 C ATOM 1446 OE1 GLU A 107 0.266 -2.006 -23.689 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -0.498 0.035 -23.579 1.00 0.00 O ATOM 0 H GLU A 107 -0.094 -3.149 -18.887 1.00 0.00 H new ATOM 0 HA GLU A 107 2.364 -2.452 -20.369 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -0.164 -2.355 -21.167 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.259 -0.942 -20.134 1.00 0.00 H new ATOM 0 HG2 GLU A 107 1.017 0.357 -21.552 1.00 0.00 H new ATOM 0 HG3 GLU A 107 2.061 -0.972 -22.016 1.00 0.00 H new ATOM 1454 N GLY A 108 1.889 -1.432 -17.478 1.00 0.00 N ATOM 1455 CA GLY A 108 2.415 -0.616 -16.373 1.00 0.00 C ATOM 1456 C GLY A 108 1.624 0.673 -16.116 1.00 0.00 C ATOM 1457 O GLY A 108 1.923 1.394 -15.176 1.00 0.00 O ATOM 0 H GLY A 108 1.351 -2.238 -17.159 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.419 -1.215 -15.463 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.452 -0.357 -16.588 1.00 0.00 H new ATOM 1461 N THR A 109 0.581 0.908 -16.900 1.00 0.00 N ATOM 1462 CA THR A 109 -0.313 2.062 -16.856 1.00 0.00 C ATOM 1463 C THR A 109 -1.133 2.061 -15.552 1.00 0.00 C ATOM 1464 O THR A 109 -1.827 3.027 -15.238 1.00 0.00 O ATOM 1465 CB THR A 109 -1.192 2.042 -18.123 1.00 0.00 C ATOM 1466 OG1 THR A 109 -0.585 1.293 -19.168 1.00 0.00 O ATOM 1467 CG2 THR A 109 -1.508 3.433 -18.655 1.00 0.00 C ATOM 0 H THR A 109 0.317 0.253 -17.636 1.00 0.00 H new ATOM 0 HA THR A 109 0.254 2.993 -16.850 1.00 0.00 H new ATOM 0 HB THR A 109 -2.124 1.570 -17.813 1.00 0.00 H new ATOM 0 HG1 THR A 109 -1.168 1.299 -19.956 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.129 3.349 -19.547 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.042 4.001 -17.893 1.00 0.00 H new ATOM 0 HG23 THR A 109 -0.580 3.946 -18.907 1.00 0.00 H new ATOM 1475 N ARG A 110 -1.077 0.945 -14.824 1.00 0.00 N ATOM 1476 CA ARG A 110 -1.685 0.652 -13.539 1.00 0.00 C ATOM 1477 C ARG A 110 -0.675 -0.191 -12.785 1.00 0.00 C ATOM 1478 O ARG A 110 0.128 -0.891 -13.412 1.00 0.00 O ATOM 1479 CB ARG A 110 -2.986 -0.149 -13.696 1.00 0.00 C ATOM 1480 CG ARG A 110 -4.234 0.729 -13.848 1.00 0.00 C ATOM 1481 CD ARG A 110 -5.482 0.111 -13.216 1.00 0.00 C ATOM 1482 NE ARG A 110 -5.829 -1.205 -13.789 1.00 0.00 N ATOM 1483 CZ ARG A 110 -6.815 -1.989 -13.337 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -7.595 -1.593 -12.337 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -7.039 -3.180 -13.891 1.00 0.00 N ATOM 0 H ARG A 110 -0.546 0.143 -15.163 1.00 0.00 H new ATOM 0 HA ARG A 110 -1.936 1.577 -13.021 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -2.900 -0.798 -14.568 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -3.111 -0.796 -12.828 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -4.046 1.700 -13.391 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -4.420 0.906 -14.907 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -5.323 0.003 -12.143 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -6.324 0.791 -13.347 1.00 0.00 H new ATOM 0 HE ARG A 110 -5.281 -1.539 -14.582 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -7.446 -0.682 -11.904 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -8.343 -2.200 -12.002 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -6.457 -3.500 -14.665 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -7.792 -3.772 -13.541 1.00 0.00 H new ATOM 1499 N THR A 111 -0.777 -0.209 -11.464 1.00 0.00 N ATOM 1500 CA THR A 111 0.104 -0.977 -10.598 1.00 0.00 C ATOM 1501 C THR A 111 -0.759 -1.909 -9.739 1.00 0.00 C ATOM 1502 O THR A 111 -1.905 -1.593 -9.413 1.00 0.00 O ATOM 1503 CB THR A 111 0.939 0.012 -9.773 1.00 0.00 C ATOM 1504 OG1 THR A 111 1.601 0.936 -10.603 1.00 0.00 O ATOM 1505 CG2 THR A 111 2.002 -0.615 -8.866 1.00 0.00 C ATOM 0 H THR A 111 -1.487 0.319 -10.956 1.00 0.00 H new ATOM 0 HA THR A 111 0.798 -1.605 -11.157 1.00 0.00 H new ATOM 0 HB THR A 111 0.196 0.488 -9.132 1.00 0.00 H new ATOM 0 HG1 THR A 111 2.010 1.636 -10.052 1.00 0.00 H new ATOM 0 HG21 THR A 111 2.533 0.172 -8.330 1.00 0.00 H new ATOM 0 HG22 THR A 111 1.522 -1.282 -8.150 1.00 0.00 H new ATOM 0 HG23 THR A 111 2.709 -1.182 -9.472 1.00 0.00 H new ATOM 1513 N TYR A 112 -0.212 -3.078 -9.404 1.00 0.00 N ATOM 1514 CA TYR A 112 -0.834 -4.107 -8.582 1.00 0.00 C ATOM 1515 C TYR A 112 0.280 -4.629 -7.672 1.00 0.00 C ATOM 1516 O TYR A 112 1.261 -5.212 -8.138 1.00 0.00 O ATOM 1517 CB TYR A 112 -1.380 -5.224 -9.488 1.00 0.00 C ATOM 1518 CG TYR A 112 -2.804 -5.031 -9.965 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -3.861 -5.369 -9.104 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -3.084 -4.550 -11.258 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -5.194 -5.179 -9.495 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -4.419 -4.374 -11.669 1.00 0.00 C ATOM 1523 CZ TYR A 112 -5.479 -4.668 -10.777 1.00 0.00 C ATOM 1524 OH TYR A 112 -6.772 -4.464 -11.149 1.00 0.00 O ATOM 0 H TYR A 112 0.723 -3.342 -9.716 1.00 0.00 H new ATOM 0 HA TYR A 112 -1.672 -3.729 -7.997 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -0.731 -5.312 -10.359 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -1.320 -6.169 -8.948 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -3.644 -5.780 -8.129 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -2.275 -4.316 -11.934 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -5.998 -5.423 -8.817 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -4.635 -4.015 -12.664 1.00 0.00 H new ATOM 0 HH TYR A 112 -7.310 -4.251 -10.358 1.00 0.00 H new ATOM 1534 N LEU A 113 0.123 -4.454 -6.366 1.00 0.00 N ATOM 1535 CA LEU A 113 1.067 -4.869 -5.329 1.00 0.00 C ATOM 1536 C LEU A 113 0.391 -5.851 -4.393 1.00 0.00 C ATOM 1537 O LEU A 113 -0.844 -5.912 -4.370 1.00 0.00 O ATOM 1538 CB LEU A 113 1.607 -3.665 -4.543 1.00 0.00 C ATOM 1539 CG LEU A 113 0.658 -2.945 -3.567 1.00 0.00 C ATOM 1540 CD1 LEU A 113 1.475 -1.868 -2.843 1.00 0.00 C ATOM 1541 CD2 LEU A 113 -0.556 -2.332 -4.277 1.00 0.00 C ATOM 0 H LEU A 113 -0.704 -3.998 -5.980 1.00 0.00 H new ATOM 0 HA LEU A 113 1.917 -5.351 -5.812 1.00 0.00 H new ATOM 0 HB2 LEU A 113 2.475 -4.001 -3.976 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.963 -2.929 -5.264 1.00 0.00 H new ATOM 0 HG LEU A 113 0.252 -3.666 -2.857 1.00 0.00 H new ATOM 0 HD11 LEU A 113 0.834 -1.335 -2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.296 -2.337 -2.301 1.00 0.00 H new ATOM 0 HD13 LEU A 113 1.877 -1.165 -3.572 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -1.194 -1.836 -3.545 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.217 -1.605 -5.015 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.121 -3.119 -4.776 1.00 0.00 H new ATOM 1553 N LYS A 114 1.172 -6.607 -3.619 1.00 0.00 N ATOM 1554 CA LYS A 114 0.613 -7.561 -2.678 1.00 0.00 C ATOM 1555 C LYS A 114 1.462 -7.663 -1.428 1.00 0.00 C ATOM 1556 O LYS A 114 2.687 -7.807 -1.477 1.00 0.00 O ATOM 1557 CB LYS A 114 0.472 -8.964 -3.285 1.00 0.00 C ATOM 1558 CG LYS A 114 -0.689 -9.100 -4.279 1.00 0.00 C ATOM 1559 CD LYS A 114 -0.882 -10.580 -4.609 1.00 0.00 C ATOM 1560 CE LYS A 114 -2.060 -10.798 -5.556 1.00 0.00 C ATOM 1561 NZ LYS A 114 -2.193 -12.225 -5.896 1.00 0.00 N ATOM 0 H LYS A 114 2.191 -6.572 -3.630 1.00 0.00 H new ATOM 0 HA LYS A 114 -0.378 -7.185 -2.425 1.00 0.00 H new ATOM 0 HB2 LYS A 114 1.402 -9.225 -3.790 1.00 0.00 H new ATOM 0 HB3 LYS A 114 0.333 -9.685 -2.479 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -1.602 -8.686 -3.852 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -0.477 -8.535 -5.187 1.00 0.00 H new ATOM 0 HD2 LYS A 114 0.028 -10.973 -5.063 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.047 -11.140 -3.688 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -2.979 -10.442 -5.090 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -1.916 -10.214 -6.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -3.133 -12.398 -6.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -1.460 -12.487 -6.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -2.080 -12.799 -5.036 1.00 0.00 H new ATOM 1575 N SER A 115 0.759 -7.597 -0.311 1.00 0.00 N ATOM 1576 CA SER A 115 1.254 -7.724 1.036 1.00 0.00 C ATOM 1577 C SER A 115 0.703 -9.093 1.448 1.00 0.00 C ATOM 1578 O SER A 115 -0.349 -9.497 0.952 1.00 0.00 O ATOM 1579 CB SER A 115 0.707 -6.561 1.874 1.00 0.00 C ATOM 1580 OG SER A 115 1.335 -6.444 3.131 1.00 0.00 O ATOM 0 H SER A 115 -0.249 -7.441 -0.331 1.00 0.00 H new ATOM 0 HA SER A 115 2.336 -7.676 1.158 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.836 -5.630 1.322 1.00 0.00 H new ATOM 0 HB3 SER A 115 -0.364 -6.699 2.021 1.00 0.00 H new ATOM 0 HG SER A 115 1.286 -5.514 3.436 1.00 0.00 H new ATOM 1586 N PHE A 116 1.446 -9.813 2.291 1.00 0.00 N ATOM 1587 CA PHE A 116 1.178 -11.138 2.854 1.00 0.00 C ATOM 1588 C PHE A 116 -0.175 -11.774 2.453 1.00 0.00 C ATOM 1589 O PHE A 116 -1.119 -11.780 3.252 1.00 0.00 O ATOM 1590 CB PHE A 116 1.302 -10.986 4.383 1.00 0.00 C ATOM 1591 CG PHE A 116 1.022 -12.202 5.258 1.00 0.00 C ATOM 1592 CD1 PHE A 116 1.227 -13.522 4.806 1.00 0.00 C ATOM 1593 CD2 PHE A 116 0.546 -11.993 6.566 1.00 0.00 C ATOM 1594 CE1 PHE A 116 0.992 -14.609 5.665 1.00 0.00 C ATOM 1595 CE2 PHE A 116 0.314 -13.080 7.427 1.00 0.00 C ATOM 1596 CZ PHE A 116 0.545 -14.390 6.979 1.00 0.00 C ATOM 0 H PHE A 116 2.336 -9.448 2.629 1.00 0.00 H new ATOM 0 HA PHE A 116 1.902 -11.840 2.441 1.00 0.00 H new ATOM 0 HB2 PHE A 116 2.314 -10.646 4.602 1.00 0.00 H new ATOM 0 HB3 PHE A 116 0.624 -10.191 4.693 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.566 -13.698 3.796 1.00 0.00 H new ATOM 0 HD2 PHE A 116 0.357 -10.987 6.912 1.00 0.00 H new ATOM 0 HE1 PHE A 116 1.156 -15.617 5.314 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -0.042 -12.907 8.432 1.00 0.00 H new ATOM 0 HZ PHE A 116 0.380 -15.227 7.642 1.00 0.00 H new ATOM 1606 N GLU A 117 -0.287 -12.349 1.248 1.00 0.00 N ATOM 1607 CA GLU A 117 -1.554 -12.940 0.826 1.00 0.00 C ATOM 1608 C GLU A 117 -1.817 -14.287 1.504 1.00 0.00 C ATOM 1609 O GLU A 117 -0.899 -14.949 2.005 1.00 0.00 O ATOM 1610 CB GLU A 117 -1.705 -12.987 -0.706 1.00 0.00 C ATOM 1611 CG GLU A 117 -1.032 -14.175 -1.415 1.00 0.00 C ATOM 1612 CD GLU A 117 -1.367 -14.255 -2.913 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -2.219 -13.483 -3.420 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -0.813 -15.160 -3.586 1.00 0.00 O ATOM 0 H GLU A 117 0.468 -12.415 0.565 1.00 0.00 H new ATOM 0 HA GLU A 117 -2.343 -12.273 1.173 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -2.768 -13.001 -0.946 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -1.297 -12.065 -1.120 1.00 0.00 H new ATOM 0 HG2 GLU A 117 0.049 -14.097 -1.295 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -1.341 -15.101 -0.930 1.00 0.00 H new ATOM 1621 N ALA A 118 -3.085 -14.703 1.486 1.00 0.00 N ATOM 1622 CA ALA A 118 -3.557 -15.943 2.069 1.00 0.00 C ATOM 1623 C ALA A 118 -4.477 -16.663 1.084 1.00 0.00 C ATOM 1624 O ALA A 118 -4.062 -16.984 -0.029 1.00 0.00 O ATOM 1625 CB ALA A 118 -4.187 -15.636 3.440 1.00 0.00 C ATOM 0 H ALA A 118 -3.830 -14.161 1.048 1.00 0.00 H new ATOM 0 HA ALA A 118 -2.739 -16.639 2.256 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -4.547 -16.561 3.890 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -3.439 -15.182 4.091 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -5.022 -14.947 3.311 1.00 0.00 H new ATOM 1631 N ASP A 119 -5.669 -17.020 1.540 1.00 0.00 N ATOM 1632 CA ASP A 119 -6.749 -17.693 0.841 1.00 0.00 C ATOM 1633 C ASP A 119 -7.975 -16.787 0.932 1.00 0.00 C ATOM 1634 O ASP A 119 -8.030 -15.972 1.855 1.00 0.00 O ATOM 1635 CB ASP A 119 -7.019 -19.029 1.522 1.00 0.00 C ATOM 1636 CG ASP A 119 -7.938 -19.854 0.646 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -9.165 -19.683 0.766 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -7.424 -20.567 -0.244 1.00 0.00 O ATOM 0 H ASP A 119 -5.927 -16.824 2.507 1.00 0.00 H new ATOM 0 HA ASP A 119 -6.500 -17.883 -0.203 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -6.083 -19.561 1.691 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -7.475 -18.868 2.499 1.00 0.00 H new ATOM 1643 N ALA A 120 -8.941 -16.875 0.017 1.00 0.00 N ATOM 1644 CA ALA A 120 -10.141 -16.039 0.066 1.00 0.00 C ATOM 1645 C ALA A 120 -11.003 -16.373 1.293 1.00 0.00 C ATOM 1646 O ALA A 120 -11.890 -15.606 1.651 1.00 0.00 O ATOM 1647 CB ALA A 120 -10.947 -16.210 -1.223 1.00 0.00 C ATOM 0 H ALA A 120 -8.915 -17.521 -0.772 1.00 0.00 H new ATOM 0 HA ALA A 120 -9.831 -14.998 0.155 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -11.839 -15.585 -1.180 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -10.337 -15.913 -2.076 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -11.240 -17.254 -1.333 1.00 0.00 H new ATOM 1653 N GLU A 121 -10.754 -17.498 1.959 1.00 0.00 N ATOM 1654 CA GLU A 121 -11.504 -17.903 3.139 1.00 0.00 C ATOM 1655 C GLU A 121 -11.147 -16.984 4.312 1.00 0.00 C ATOM 1656 O GLU A 121 -11.946 -16.818 5.236 1.00 0.00 O ATOM 1657 CB GLU A 121 -11.154 -19.364 3.465 1.00 0.00 C ATOM 1658 CG GLU A 121 -12.120 -20.020 4.461 1.00 0.00 C ATOM 1659 CD GLU A 121 -13.489 -20.287 3.839 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -13.591 -21.221 3.008 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -14.469 -19.606 4.220 1.00 0.00 O ATOM 0 H GLU A 121 -10.022 -18.156 1.692 1.00 0.00 H new ATOM 0 HA GLU A 121 -12.576 -17.824 2.956 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -11.150 -19.943 2.541 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -10.143 -19.405 3.871 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.693 -20.958 4.815 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -12.237 -19.374 5.331 1.00 0.00 H new ATOM 1668 N GLY A 122 -9.955 -16.377 4.276 1.00 0.00 N ATOM 1669 CA GLY A 122 -9.446 -15.493 5.303 1.00 0.00 C ATOM 1670 C GLY A 122 -9.106 -14.096 4.809 1.00 0.00 C ATOM 1671 O GLY A 122 -9.499 -13.136 5.465 1.00 0.00 O ATOM 0 H GLY A 122 -9.305 -16.499 3.500 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -10.186 -15.415 6.099 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -8.553 -15.939 5.741 1.00 0.00 H new ATOM 1675 N ARG A 123 -8.327 -13.970 3.723 1.00 0.00 N ATOM 1676 CA ARG A 123 -7.907 -12.673 3.162 1.00 0.00 C ATOM 1677 C ARG A 123 -6.979 -12.788 1.949 1.00 0.00 C ATOM 1678 O ARG A 123 -5.761 -12.923 2.102 1.00 0.00 O ATOM 1679 CB ARG A 123 -7.183 -11.774 4.225 1.00 0.00 C ATOM 1680 CG ARG A 123 -6.183 -12.525 5.126 1.00 0.00 C ATOM 1681 CD ARG A 123 -5.528 -11.629 6.174 1.00 0.00 C ATOM 1682 NE ARG A 123 -4.575 -12.439 6.950 1.00 0.00 N ATOM 1683 CZ ARG A 123 -4.809 -13.034 8.124 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -5.786 -12.645 8.933 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -4.048 -14.048 8.510 1.00 0.00 N ATOM 0 H ARG A 123 -7.967 -14.771 3.204 1.00 0.00 H new ATOM 0 HA ARG A 123 -8.844 -12.216 2.844 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -6.655 -10.974 3.706 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -7.936 -11.302 4.856 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -6.700 -13.343 5.628 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -5.408 -12.972 4.504 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -5.014 -10.797 5.693 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -6.284 -11.200 6.832 1.00 0.00 H new ATOM 0 HE ARG A 123 -3.643 -12.558 6.552 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -6.389 -11.867 8.667 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -5.934 -13.124 9.821 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -3.287 -14.371 7.912 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -4.223 -14.505 9.405 1.00 0.00 H new ATOM 1699 N ARG A 124 -7.501 -12.837 0.724 1.00 0.00 N ATOM 1700 CA ARG A 124 -6.618 -12.855 -0.448 1.00 0.00 C ATOM 1701 C ARG A 124 -6.462 -11.357 -0.706 1.00 0.00 C ATOM 1702 O ARG A 124 -7.463 -10.647 -0.796 1.00 0.00 O ATOM 1703 CB ARG A 124 -7.143 -13.727 -1.596 1.00 0.00 C ATOM 1704 CG ARG A 124 -6.185 -14.935 -1.702 1.00 0.00 C ATOM 1705 CD ARG A 124 -6.713 -16.099 -2.535 1.00 0.00 C ATOM 1706 NE ARG A 124 -7.095 -15.702 -3.900 1.00 0.00 N ATOM 1707 CZ ARG A 124 -7.951 -16.342 -4.708 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -8.465 -17.525 -4.397 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -8.297 -15.771 -5.851 1.00 0.00 N ATOM 0 H ARG A 124 -8.499 -12.864 0.517 1.00 0.00 H new ATOM 0 HA ARG A 124 -5.652 -13.342 -0.312 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -8.163 -14.057 -1.398 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -7.165 -13.166 -2.530 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -5.242 -14.597 -2.132 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -5.965 -15.296 -0.697 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -5.950 -16.876 -2.588 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -7.577 -16.535 -2.034 1.00 0.00 H new ATOM 0 HE ARG A 124 -6.664 -14.854 -4.268 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -8.211 -17.976 -3.518 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -9.114 -17.983 -5.037 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -7.913 -14.860 -6.103 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -8.947 -16.242 -6.480 1.00 0.00 H new ATOM 1723 N PHE A 125 -5.236 -10.850 -0.799 1.00 0.00 N ATOM 1724 CA PHE A 125 -4.965 -9.448 -0.965 1.00 0.00 C ATOM 1725 C PHE A 125 -5.154 -9.030 -2.417 1.00 0.00 C ATOM 1726 O PHE A 125 -4.841 -9.783 -3.347 1.00 0.00 O ATOM 1727 CB PHE A 125 -3.519 -9.285 -0.495 1.00 0.00 C ATOM 1728 CG PHE A 125 -3.374 -8.938 0.977 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -3.619 -9.910 1.967 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -2.971 -7.646 1.365 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -3.430 -9.603 3.325 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -2.803 -7.336 2.725 1.00 0.00 C ATOM 1733 CZ PHE A 125 -3.024 -8.315 3.708 1.00 0.00 C ATOM 0 H PHE A 125 -4.394 -11.424 -0.759 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.643 -8.812 -0.396 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -2.979 -10.211 -0.693 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.042 -8.505 -1.089 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -3.954 -10.896 1.681 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.790 -6.891 0.615 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -3.598 -10.360 4.077 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.503 -6.340 3.016 1.00 0.00 H new ATOM 0 HZ PHE A 125 -2.882 -8.078 4.752 1.00 0.00 H new ATOM 1743 N GLU A 126 -5.730 -7.841 -2.592 1.00 0.00 N ATOM 1744 CA GLU A 126 -6.023 -7.229 -3.872 1.00 0.00 C ATOM 1745 C GLU A 126 -6.126 -5.721 -3.702 1.00 0.00 C ATOM 1746 O GLU A 126 -6.857 -5.276 -2.825 1.00 0.00 O ATOM 1747 CB GLU A 126 -7.344 -7.753 -4.408 1.00 0.00 C ATOM 1748 CG GLU A 126 -7.501 -7.331 -5.868 1.00 0.00 C ATOM 1749 CD GLU A 126 -6.465 -7.961 -6.796 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -5.362 -7.404 -6.939 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -6.773 -9.049 -7.346 1.00 0.00 O ATOM 0 H GLU A 126 -6.015 -7.258 -1.805 1.00 0.00 H new ATOM 0 HA GLU A 126 -5.223 -7.473 -4.571 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -7.377 -8.839 -4.326 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -8.171 -7.363 -3.814 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -8.499 -7.603 -6.212 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -7.426 -6.246 -5.935 1.00 0.00 H new ATOM 1758 N VAL A 127 -5.364 -4.954 -4.477 1.00 0.00 N ATOM 1759 CA VAL A 127 -5.370 -3.495 -4.469 1.00 0.00 C ATOM 1760 C VAL A 127 -5.115 -3.107 -5.918 1.00 0.00 C ATOM 1761 O VAL A 127 -4.335 -3.776 -6.598 1.00 0.00 O ATOM 1762 CB VAL A 127 -4.285 -2.913 -3.546 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -4.121 -1.398 -3.740 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -4.572 -3.196 -2.066 1.00 0.00 C ATOM 0 H VAL A 127 -4.704 -5.344 -5.150 1.00 0.00 H new ATOM 0 HA VAL A 127 -6.311 -3.101 -4.085 1.00 0.00 H new ATOM 0 HB VAL A 127 -3.358 -3.413 -3.828 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -3.346 -1.027 -3.070 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -3.838 -1.192 -4.772 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -5.063 -0.898 -3.516 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -3.780 -2.766 -1.453 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -5.527 -2.750 -1.789 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -4.613 -4.273 -1.903 1.00 0.00 H new ATOM 1774 N ALA A 128 -5.766 -2.048 -6.385 1.00 0.00 N ATOM 1775 CA ALA A 128 -5.615 -1.548 -7.747 1.00 0.00 C ATOM 1776 C ALA A 128 -5.186 -0.087 -7.677 1.00 0.00 C ATOM 1777 O ALA A 128 -5.822 0.695 -6.973 1.00 0.00 O ATOM 1778 CB ALA A 128 -6.939 -1.699 -8.500 1.00 0.00 C ATOM 0 H ALA A 128 -6.421 -1.506 -5.822 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.857 -2.118 -8.285 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -6.824 -1.325 -9.517 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -7.222 -2.751 -8.530 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -7.715 -1.129 -7.989 1.00 0.00 H new ATOM 1784 N LEU A 129 -4.133 0.290 -8.405 1.00 0.00 N ATOM 1785 CA LEU A 129 -3.624 1.658 -8.428 1.00 0.00 C ATOM 1786 C LEU A 129 -3.674 2.172 -9.854 1.00 0.00 C ATOM 1787 O LEU A 129 -3.095 1.555 -10.748 1.00 0.00 O ATOM 1788 CB LEU A 129 -2.209 1.690 -7.826 1.00 0.00 C ATOM 1789 CG LEU A 129 -1.513 3.073 -7.805 1.00 0.00 C ATOM 1790 CD1 LEU A 129 -0.331 3.019 -6.830 1.00 0.00 C ATOM 1791 CD2 LEU A 129 -0.963 3.535 -9.162 1.00 0.00 C ATOM 0 H LEU A 129 -3.607 -0.352 -8.999 1.00 0.00 H new ATOM 0 HA LEU A 129 -4.240 2.319 -7.818 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.262 1.316 -6.804 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.581 0.998 -8.387 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.284 3.785 -7.509 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.167 3.989 -6.807 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.694 2.774 -5.832 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.376 2.256 -7.157 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.494 4.512 -9.051 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.225 2.817 -9.519 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.779 3.604 -9.881 1.00 0.00 H new ATOM 1803 N ASP A 130 -4.383 3.289 -10.043 1.00 0.00 N ATOM 1804 CA ASP A 130 -4.552 3.956 -11.326 1.00 0.00 C ATOM 1805 C ASP A 130 -3.732 5.251 -11.358 1.00 0.00 C ATOM 1806 O ASP A 130 -4.102 6.230 -10.706 1.00 0.00 O ATOM 1807 CB ASP A 130 -6.049 4.201 -11.578 1.00 0.00 C ATOM 1808 CG ASP A 130 -6.335 4.411 -13.061 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -6.191 3.430 -13.819 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -6.763 5.526 -13.444 1.00 0.00 O ATOM 0 H ASP A 130 -4.867 3.764 -9.281 1.00 0.00 H new ATOM 0 HA ASP A 130 -4.179 3.324 -12.132 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -6.625 3.352 -11.211 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -6.376 5.075 -11.015 1.00 0.00 H new ATOM 1815 N GLY A 131 -2.625 5.281 -12.106 1.00 0.00 N ATOM 1816 CA GLY A 131 -1.742 6.447 -12.235 1.00 0.00 C ATOM 1817 C GLY A 131 -0.461 6.080 -12.983 1.00 0.00 C ATOM 1818 O GLY A 131 -0.323 4.938 -13.423 1.00 0.00 O ATOM 0 H GLY A 131 -2.310 4.479 -12.651 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -2.262 7.245 -12.765 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -1.493 6.831 -11.246 1.00 0.00 H new ATOM 1822 N ASP A 132 0.449 7.036 -13.195 1.00 0.00 N ATOM 1823 CA ASP A 132 1.731 6.826 -13.886 1.00 0.00 C ATOM 1824 C ASP A 132 2.891 7.159 -12.944 1.00 0.00 C ATOM 1825 O ASP A 132 2.649 7.578 -11.810 1.00 0.00 O ATOM 1826 CB ASP A 132 1.797 7.619 -15.205 1.00 0.00 C ATOM 1827 CG ASP A 132 2.807 7.021 -16.195 1.00 0.00 C ATOM 1828 OD1 ASP A 132 3.371 5.934 -15.958 1.00 0.00 O ATOM 1829 OD2 ASP A 132 2.983 7.596 -17.298 1.00 0.00 O ATOM 0 H ASP A 132 0.315 7.999 -12.886 1.00 0.00 H new ATOM 0 HA ASP A 132 1.816 5.775 -14.161 1.00 0.00 H new ATOM 0 HB2 ASP A 132 0.809 7.638 -15.665 1.00 0.00 H new ATOM 0 HB3 ASP A 132 2.069 8.653 -14.992 1.00 0.00 H new ATOM 1834 N HIS A 133 4.149 6.941 -13.363 1.00 0.00 N ATOM 1835 CA HIS A 133 5.374 7.183 -12.583 1.00 0.00 C ATOM 1836 C HIS A 133 5.431 6.381 -11.270 1.00 0.00 C ATOM 1837 O HIS A 133 6.291 6.598 -10.412 1.00 0.00 O ATOM 1838 CB HIS A 133 5.537 8.685 -12.352 1.00 0.00 C ATOM 1839 CG HIS A 133 5.627 9.485 -13.622 1.00 0.00 C ATOM 1840 ND1 HIS A 133 4.849 10.571 -13.942 1.00 0.00 N ATOM 1841 CD2 HIS A 133 6.451 9.229 -14.685 1.00 0.00 C ATOM 1842 CE1 HIS A 133 5.194 10.960 -15.181 1.00 0.00 C ATOM 1843 NE2 HIS A 133 6.192 10.197 -15.662 1.00 0.00 N ATOM 0 H HIS A 133 4.348 6.576 -14.294 1.00 0.00 H new ATOM 0 HA HIS A 133 6.220 6.818 -13.166 1.00 0.00 H new ATOM 0 HB2 HIS A 133 4.694 9.047 -11.764 1.00 0.00 H new ATOM 0 HB3 HIS A 133 6.436 8.857 -11.760 1.00 0.00 H new ATOM 0 HD1 HIS A 133 4.140 11.002 -13.349 1.00 0.00 H new ATOM 0 HD2 HIS A 133 7.170 8.426 -14.757 1.00 0.00 H new ATOM 0 HE1 HIS A 133 4.732 11.775 -15.718 1.00 0.00 H new ATOM 1851 N THR A 134 4.483 5.466 -11.119 1.00 0.00 N ATOM 1852 CA THR A 134 4.256 4.565 -10.021 1.00 0.00 C ATOM 1853 C THR A 134 5.261 3.414 -10.097 1.00 0.00 C ATOM 1854 O THR A 134 5.880 3.162 -11.135 1.00 0.00 O ATOM 1855 CB THR A 134 2.766 4.146 -10.085 1.00 0.00 C ATOM 1856 OG1 THR A 134 2.479 3.121 -9.159 1.00 0.00 O ATOM 1857 CG2 THR A 134 2.272 3.722 -11.478 1.00 0.00 C ATOM 0 H THR A 134 3.783 5.331 -11.849 1.00 0.00 H new ATOM 0 HA THR A 134 4.424 5.018 -9.044 1.00 0.00 H new ATOM 0 HB THR A 134 2.223 5.055 -9.826 1.00 0.00 H new ATOM 0 HG1 THR A 134 1.689 3.367 -8.633 1.00 0.00 H new ATOM 0 HG21 THR A 134 1.219 3.447 -11.422 1.00 0.00 H new ATOM 0 HG22 THR A 134 2.394 4.551 -12.175 1.00 0.00 H new ATOM 0 HG23 THR A 134 2.852 2.867 -11.825 1.00 0.00 H new ATOM 1865 N GLY A 135 5.414 2.694 -8.986 1.00 0.00 N ATOM 1866 CA GLY A 135 6.319 1.568 -8.852 1.00 0.00 C ATOM 1867 C GLY A 135 7.596 1.969 -8.120 1.00 0.00 C ATOM 1868 O GLY A 135 8.149 1.153 -7.374 1.00 0.00 O ATOM 0 H GLY A 135 4.892 2.890 -8.132 1.00 0.00 H new ATOM 0 HA2 GLY A 135 5.824 0.763 -8.309 1.00 0.00 H new ATOM 0 HA3 GLY A 135 6.569 1.180 -9.839 1.00 0.00 H new ATOM 1872 N ASP A 136 8.035 3.221 -8.256 1.00 0.00 N ATOM 1873 CA ASP A 136 9.247 3.715 -7.616 1.00 0.00 C ATOM 1874 C ASP A 136 9.013 4.091 -6.153 1.00 0.00 C ATOM 1875 O ASP A 136 8.269 5.019 -5.834 1.00 0.00 O ATOM 1876 CB ASP A 136 9.833 4.893 -8.392 1.00 0.00 C ATOM 1877 CG ASP A 136 11.310 5.041 -8.041 1.00 0.00 C ATOM 1878 OD1 ASP A 136 12.109 4.174 -8.470 1.00 0.00 O ATOM 1879 OD2 ASP A 136 11.674 5.984 -7.308 1.00 0.00 O ATOM 0 H ASP A 136 7.554 3.923 -8.818 1.00 0.00 H new ATOM 0 HA ASP A 136 9.970 2.900 -7.628 1.00 0.00 H new ATOM 0 HB2 ASP A 136 9.716 4.732 -9.464 1.00 0.00 H new ATOM 0 HB3 ASP A 136 9.295 5.809 -8.147 1.00 0.00 H new ATOM 1884 N LEU A 137 9.634 3.350 -5.238 1.00 0.00 N ATOM 1885 CA LEU A 137 9.551 3.524 -3.804 1.00 0.00 C ATOM 1886 C LEU A 137 10.936 3.544 -3.148 1.00 0.00 C ATOM 1887 O LEU A 137 11.873 2.941 -3.674 1.00 0.00 O ATOM 1888 CB LEU A 137 8.661 2.376 -3.311 1.00 0.00 C ATOM 1889 CG LEU A 137 9.319 1.029 -2.947 1.00 0.00 C ATOM 1890 CD1 LEU A 137 8.247 0.101 -2.367 1.00 0.00 C ATOM 1891 CD2 LEU A 137 9.914 0.304 -4.163 1.00 0.00 C ATOM 0 H LEU A 137 10.239 2.572 -5.500 1.00 0.00 H new ATOM 0 HA LEU A 137 9.122 4.488 -3.532 1.00 0.00 H new ATOM 0 HB2 LEU A 137 8.124 2.729 -2.431 1.00 0.00 H new ATOM 0 HB3 LEU A 137 7.916 2.181 -4.082 1.00 0.00 H new ATOM 0 HG LEU A 137 10.121 1.251 -2.243 1.00 0.00 H new ATOM 0 HD11 LEU A 137 8.698 -0.856 -2.105 1.00 0.00 H new ATOM 0 HD12 LEU A 137 7.816 0.556 -1.475 1.00 0.00 H new ATOM 0 HD13 LEU A 137 7.464 -0.058 -3.108 1.00 0.00 H new ATOM 0 HD21 LEU A 137 10.362 -0.636 -3.842 1.00 0.00 H new ATOM 0 HD22 LEU A 137 9.125 0.102 -4.888 1.00 0.00 H new ATOM 0 HD23 LEU A 137 10.677 0.931 -4.623 1.00 0.00 H new ATOM 1903 N SER A 138 11.056 4.218 -2.000 1.00 0.00 N ATOM 1904 CA SER A 138 12.214 4.373 -1.141 1.00 0.00 C ATOM 1905 C SER A 138 11.651 4.895 0.180 1.00 0.00 C ATOM 1906 O SER A 138 10.497 5.320 0.232 1.00 0.00 O ATOM 1907 CB SER A 138 13.257 5.359 -1.689 1.00 0.00 C ATOM 1908 OG SER A 138 13.731 4.979 -2.961 1.00 0.00 O ATOM 0 H SER A 138 10.254 4.718 -1.617 1.00 0.00 H new ATOM 0 HA SER A 138 12.742 3.424 -1.050 1.00 0.00 H new ATOM 0 HB2 SER A 138 12.817 6.354 -1.749 1.00 0.00 H new ATOM 0 HB3 SER A 138 14.095 5.422 -0.995 1.00 0.00 H new ATOM 0 HG SER A 138 13.258 4.174 -3.260 1.00 0.00 H new ATOM 1914 N ALA A 139 12.488 4.935 1.207 1.00 0.00 N ATOM 1915 CA ALA A 139 12.220 5.368 2.590 1.00 0.00 C ATOM 1916 C ALA A 139 11.571 6.762 2.754 1.00 0.00 C ATOM 1917 O ALA A 139 11.282 7.174 3.883 1.00 0.00 O ATOM 1918 CB ALA A 139 13.508 5.247 3.416 1.00 0.00 C ATOM 0 H ALA A 139 13.458 4.642 1.094 1.00 0.00 H new ATOM 0 HA ALA A 139 11.452 4.692 2.966 1.00 0.00 H new ATOM 0 HB1 ALA A 139 13.315 5.566 4.440 1.00 0.00 H new ATOM 0 HB2 ALA A 139 13.844 4.210 3.416 1.00 0.00 H new ATOM 0 HB3 ALA A 139 14.281 5.879 2.979 1.00 0.00 H new ATOM 1924 N ALA A 140 11.409 7.516 1.667 1.00 0.00 N ATOM 1925 CA ALA A 140 10.788 8.820 1.603 1.00 0.00 C ATOM 1926 C ALA A 140 9.343 8.616 1.140 1.00 0.00 C ATOM 1927 O ALA A 140 8.416 9.086 1.800 1.00 0.00 O ATOM 1928 CB ALA A 140 11.552 9.735 0.634 1.00 0.00 C ATOM 0 H ALA A 140 11.733 7.203 0.752 1.00 0.00 H new ATOM 0 HA ALA A 140 10.807 9.303 2.580 1.00 0.00 H new ATOM 0 HB1 ALA A 140 11.070 10.712 0.599 1.00 0.00 H new ATOM 0 HB2 ALA A 140 12.580 9.850 0.977 1.00 0.00 H new ATOM 0 HB3 ALA A 140 11.549 9.293 -0.362 1.00 0.00 H new ATOM 1934 N ASN A 141 9.165 7.884 0.028 1.00 0.00 N ATOM 1935 CA ASN A 141 7.874 7.586 -0.589 1.00 0.00 C ATOM 1936 C ASN A 141 7.059 6.607 0.242 1.00 0.00 C ATOM 1937 O ASN A 141 5.846 6.730 0.379 1.00 0.00 O ATOM 1938 CB ASN A 141 8.042 6.975 -2.004 1.00 0.00 C ATOM 1939 CG ASN A 141 8.760 7.836 -3.044 1.00 0.00 C ATOM 1940 OD1 ASN A 141 9.406 8.830 -2.722 1.00 0.00 O ATOM 1941 ND2 ASN A 141 8.709 7.443 -4.304 1.00 0.00 N ATOM 0 H ASN A 141 9.948 7.472 -0.480 1.00 0.00 H new ATOM 0 HA ASN A 141 7.352 8.541 -0.653 1.00 0.00 H new ATOM 0 HB2 ASN A 141 8.586 6.035 -1.906 1.00 0.00 H new ATOM 0 HB3 ASN A 141 7.052 6.732 -2.389 1.00 0.00 H new ATOM 0 HD21 ASN A 141 9.210 7.967 -5.022 1.00 0.00 H new ATOM 0 HD22 ASN A 141 8.169 6.616 -4.559 1.00 0.00 H new ATOM 1948 N VAL A 142 7.735 5.625 0.815 1.00 0.00 N ATOM 1949 CA VAL A 142 7.138 4.576 1.616 1.00 0.00 C ATOM 1950 C VAL A 142 7.734 4.467 3.012 1.00 0.00 C ATOM 1951 O VAL A 142 8.908 4.768 3.239 1.00 0.00 O ATOM 1952 CB VAL A 142 7.246 3.261 0.813 1.00 0.00 C ATOM 1953 CG1 VAL A 142 8.606 2.544 0.871 1.00 0.00 C ATOM 1954 CG2 VAL A 142 6.158 2.260 1.206 1.00 0.00 C ATOM 0 H VAL A 142 8.748 5.536 0.731 1.00 0.00 H new ATOM 0 HA VAL A 142 6.091 4.814 1.802 1.00 0.00 H new ATOM 0 HB VAL A 142 7.116 3.600 -0.215 1.00 0.00 H new ATOM 0 HG11 VAL A 142 8.564 1.635 0.271 1.00 0.00 H new ATOM 0 HG12 VAL A 142 9.381 3.202 0.478 1.00 0.00 H new ATOM 0 HG13 VAL A 142 8.838 2.287 1.904 1.00 0.00 H new ATOM 0 HG21 VAL A 142 6.271 1.350 0.617 1.00 0.00 H new ATOM 0 HG22 VAL A 142 6.249 2.021 2.265 1.00 0.00 H new ATOM 0 HG23 VAL A 142 5.177 2.696 1.016 1.00 0.00 H new ATOM 1964 N VAL A 143 6.909 3.972 3.933 1.00 0.00 N ATOM 1965 CA VAL A 143 7.271 3.734 5.319 1.00 0.00 C ATOM 1966 C VAL A 143 7.207 2.222 5.464 1.00 0.00 C ATOM 1967 O VAL A 143 6.132 1.638 5.594 1.00 0.00 O ATOM 1968 CB VAL A 143 6.408 4.480 6.344 1.00 0.00 C ATOM 1969 CG1 VAL A 143 6.948 4.296 7.771 1.00 0.00 C ATOM 1970 CG2 VAL A 143 6.301 5.974 6.019 1.00 0.00 C ATOM 0 H VAL A 143 5.943 3.720 3.724 1.00 0.00 H new ATOM 0 HA VAL A 143 8.261 4.133 5.540 1.00 0.00 H new ATOM 0 HB VAL A 143 5.410 4.044 6.287 1.00 0.00 H new ATOM 0 HG11 VAL A 143 6.314 4.837 8.473 1.00 0.00 H new ATOM 0 HG12 VAL A 143 6.949 3.236 8.026 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.965 4.684 7.828 1.00 0.00 H new ATOM 0 HG21 VAL A 143 5.681 6.466 6.769 1.00 0.00 H new ATOM 0 HG22 VAL A 143 7.296 6.419 6.022 1.00 0.00 H new ATOM 0 HG23 VAL A 143 5.849 6.101 5.035 1.00 0.00 H new ATOM 1980 N PHE A 144 8.366 1.583 5.336 1.00 0.00 N ATOM 1981 CA PHE A 144 8.492 0.135 5.463 1.00 0.00 C ATOM 1982 C PHE A 144 8.251 -0.231 6.929 1.00 0.00 C ATOM 1983 O PHE A 144 7.397 -1.051 7.243 1.00 0.00 O ATOM 1984 CB PHE A 144 9.878 -0.340 4.986 1.00 0.00 C ATOM 1985 CG PHE A 144 9.852 -1.287 3.804 1.00 0.00 C ATOM 1986 CD1 PHE A 144 9.546 -2.647 4.006 1.00 0.00 C ATOM 1987 CD2 PHE A 144 10.176 -0.828 2.513 1.00 0.00 C ATOM 1988 CE1 PHE A 144 9.574 -3.539 2.921 1.00 0.00 C ATOM 1989 CE2 PHE A 144 10.198 -1.724 1.429 1.00 0.00 C ATOM 1990 CZ PHE A 144 9.898 -3.082 1.632 1.00 0.00 C ATOM 0 H PHE A 144 9.248 2.057 5.140 1.00 0.00 H new ATOM 0 HA PHE A 144 7.756 -0.364 4.833 1.00 0.00 H new ATOM 0 HB2 PHE A 144 10.475 0.533 4.721 1.00 0.00 H new ATOM 0 HB3 PHE A 144 10.384 -0.832 5.817 1.00 0.00 H new ATOM 0 HD1 PHE A 144 9.290 -3.003 4.993 1.00 0.00 H new ATOM 0 HD2 PHE A 144 10.408 0.215 2.355 1.00 0.00 H new ATOM 0 HE1 PHE A 144 9.345 -4.583 3.078 1.00 0.00 H new ATOM 0 HE2 PHE A 144 10.446 -1.368 0.440 1.00 0.00 H new ATOM 0 HZ PHE A 144 9.916 -3.771 0.801 1.00 0.00 H new