USER MOD reduce.3.24.130724 H: found=0, std=0, add=1117, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1118 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 122 LYS NZ :NH3+ -175:sc= 0.193 (180deg=0) USER MOD Set 1.2: A 126 ASN : amide:sc= -3.35 K(o=-3.2,f=-4.9!) USER MOD Set 2.1: A 49 SER OG : rot 173:sc= -0.338! USER MOD Set 2.2: A 93 LYS NZ :NH3+ -156:sc= -3.91! (180deg=-6.11!) USER MOD Set 3.1: A 28 LYS NZ :NH3+ -118:sc= -1.82! (180deg=-5.37!) USER MOD Set 3.2: A 63 SER OG : rot -176:sc= -5.09! USER MOD Set 4.1: A 21 GLN : amide:sc= -0.18 K(o=-0.18,f=-3.8!) USER MOD Set 4.2: A 25 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 19 THR OG1 : rot 78:sc= -4.55! USER MOD Set 5.2: A 32 GLN : amide:sc= -12.8! C(o=-17!,f=-15!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -0.731 X(o=-0.73,f=-0.3) USER MOD Single : A 29 LYS NZ :NH3+ 160:sc= -0.0512 (180deg=-0.691) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 CYS SG : rot 62:sc= -0.435 USER MOD Single : A 45 SER OG : rot 84:sc= 0.58 USER MOD Single : A 50 SER OG : rot -108:sc= -0.554! USER MOD Single : A 53 LYS NZ :NH3+ -139:sc= -2.74! (180deg=-4.01!) USER MOD Single : A 54 GLN : amide:sc= -5.31! C(o=-5.3!,f=-8.9!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 MET CE :methyl 167:sc= -9.29! (180deg=-10.7!) USER MOD Single : A 62 SER OG : rot 180:sc= -1.09! USER MOD Single : A 67 LYS NZ :NH3+ -158:sc= -5.96! (180deg=-7.73!) USER MOD Single : A 71 THR OG1 : rot -110:sc= -2.51! USER MOD Single : A 79 ASN : amide:sc= -12.7! C(o=-13!,f=-23!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 72:sc= -0.403 USER MOD Single : A 96 THR OG1 : rot -108:sc= -1.25! USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 162:sc= -0.0363 (180deg=-0.699) USER MOD Single : A 99 TYR OH : rot -131:sc= -2.83 USER MOD Single : A 104 LYS NZ :NH3+ -139:sc= -7.99! (180deg=-10.7!) USER MOD Single : A 106 GLN : amide:sc= -1.9 K(o=-1.9,f=-0.81) USER MOD Single : A 111 GLN : amide:sc= -0.017 X(o=-0.017,f=0) USER MOD Single : A 123 SER OG : rot -51:sc= 0.482 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 87:sc= 0.849 USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 113.014 3.258 -14.274 1.00 0.00 N ATOM 106 CA VAL A 7 113.348 4.316 -13.287 1.00 0.00 C ATOM 107 C VAL A 7 114.830 4.659 -13.354 1.00 0.00 C ATOM 108 O VAL A 7 115.210 5.732 -13.781 1.00 0.00 O ATOM 109 CB VAL A 7 113.030 3.803 -11.887 1.00 0.00 C ATOM 110 CG1 VAL A 7 113.671 4.730 -10.853 1.00 0.00 C ATOM 111 CG2 VAL A 7 111.513 3.761 -11.688 1.00 0.00 C ATOM 0 HA VAL A 7 112.764 5.208 -13.514 1.00 0.00 H new ATOM 0 HB VAL A 7 113.430 2.796 -11.764 1.00 0.00 H new ATOM 0 HG11 VAL A 7 113.446 4.367 -9.850 1.00 0.00 H new ATOM 0 HG12 VAL A 7 114.751 4.747 -10.999 1.00 0.00 H new ATOM 0 HG13 VAL A 7 113.273 5.738 -10.972 1.00 0.00 H new ATOM 0 HG21 VAL A 7 111.287 3.394 -10.687 1.00 0.00 H new ATOM 0 HG22 VAL A 7 111.102 4.764 -11.808 1.00 0.00 H new ATOM 0 HG23 VAL A 7 111.067 3.095 -12.427 1.00 0.00 H new ATOM 121 N LYS A 8 115.671 3.772 -12.905 1.00 0.00 N ATOM 122 CA LYS A 8 117.124 4.072 -12.915 1.00 0.00 C ATOM 123 C LYS A 8 117.353 5.303 -12.033 1.00 0.00 C ATOM 124 O LYS A 8 118.467 5.742 -11.826 1.00 0.00 O ATOM 125 CB LYS A 8 117.581 4.345 -14.354 1.00 0.00 C ATOM 126 CG LYS A 8 118.609 5.474 -14.364 1.00 0.00 C ATOM 127 CD LYS A 8 119.165 5.648 -15.779 1.00 0.00 C ATOM 128 CE LYS A 8 118.223 6.537 -16.592 1.00 0.00 C ATOM 129 NZ LYS A 8 118.818 6.793 -17.934 1.00 0.00 N ATOM 0 H LYS A 8 115.415 2.857 -12.534 1.00 0.00 H new ATOM 0 HA LYS A 8 117.699 3.229 -12.531 1.00 0.00 H new ATOM 0 HB2 LYS A 8 118.014 3.442 -14.785 1.00 0.00 H new ATOM 0 HB3 LYS A 8 116.725 4.615 -14.972 1.00 0.00 H new ATOM 0 HG2 LYS A 8 118.148 6.402 -14.027 1.00 0.00 H new ATOM 0 HG3 LYS A 8 119.418 5.249 -13.669 1.00 0.00 H new ATOM 0 HD2 LYS A 8 120.159 6.094 -15.738 1.00 0.00 H new ATOM 0 HD3 LYS A 8 119.272 4.676 -16.261 1.00 0.00 H new ATOM 0 HE2 LYS A 8 117.252 6.054 -16.699 1.00 0.00 H new ATOM 0 HE3 LYS A 8 118.055 7.479 -16.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 118.178 7.398 -18.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 119.735 7.271 -17.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 118.957 5.890 -18.430 1.00 0.00 H new ATOM 143 N GLY A 9 116.293 5.855 -11.504 1.00 0.00 N ATOM 144 CA GLY A 9 116.424 7.052 -10.626 1.00 0.00 C ATOM 145 C GLY A 9 115.412 8.116 -11.051 1.00 0.00 C ATOM 146 O GLY A 9 115.735 9.026 -11.789 1.00 0.00 O ATOM 0 H GLY A 9 115.338 5.526 -11.644 1.00 0.00 H new ATOM 0 HA2 GLY A 9 116.257 6.772 -9.586 1.00 0.00 H new ATOM 0 HA3 GLY A 9 117.436 7.453 -10.690 1.00 0.00 H new ATOM 150 N ALA A 10 114.192 8.012 -10.587 1.00 0.00 N ATOM 151 CA ALA A 10 113.156 9.022 -10.963 1.00 0.00 C ATOM 152 C ALA A 10 111.776 8.367 -10.912 1.00 0.00 C ATOM 153 O ALA A 10 110.909 8.657 -11.713 1.00 0.00 O ATOM 154 CB ALA A 10 113.416 9.534 -12.382 1.00 0.00 C ATOM 0 H ALA A 10 113.869 7.272 -9.964 1.00 0.00 H new ATOM 0 HA ALA A 10 113.200 9.858 -10.265 1.00 0.00 H new ATOM 0 HB1 ALA A 10 112.657 10.269 -12.648 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.402 9.997 -12.427 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.375 8.700 -13.083 1.00 0.00 H new ATOM 160 N LEU A 11 111.569 7.480 -9.981 1.00 0.00 N ATOM 161 CA LEU A 11 110.250 6.800 -9.882 1.00 0.00 C ATOM 162 C LEU A 11 109.153 7.828 -9.604 1.00 0.00 C ATOM 163 O LEU A 11 109.399 9.018 -9.563 1.00 0.00 O ATOM 164 CB LEU A 11 110.300 5.758 -8.759 1.00 0.00 C ATOM 165 CG LEU A 11 110.041 6.408 -7.394 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.447 5.425 -6.299 1.00 0.00 C ATOM 167 CD2 LEU A 11 110.871 7.684 -7.235 1.00 0.00 C ATOM 0 H LEU A 11 112.257 7.196 -9.284 1.00 0.00 H new ATOM 0 HA LEU A 11 110.026 6.300 -10.824 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.556 4.983 -8.944 1.00 0.00 H new ATOM 0 HB3 LEU A 11 111.275 5.270 -8.754 1.00 0.00 H new ATOM 0 HG LEU A 11 108.983 6.661 -7.320 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.268 5.874 -5.322 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.858 4.513 -6.392 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.505 5.185 -6.400 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.672 8.129 -6.260 1.00 0.00 H new ATOM 0 HD22 LEU A 11 111.931 7.441 -7.313 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.603 8.393 -8.018 1.00 0.00 H new ATOM 179 N THR A 12 107.943 7.381 -9.424 1.00 0.00 N ATOM 180 CA THR A 12 106.829 8.336 -9.158 1.00 0.00 C ATOM 181 C THR A 12 107.252 9.340 -8.081 1.00 0.00 C ATOM 182 O THR A 12 108.208 9.131 -7.361 1.00 0.00 O ATOM 183 CB THR A 12 105.600 7.561 -8.676 1.00 0.00 C ATOM 184 OG1 THR A 12 105.105 6.756 -9.737 1.00 0.00 O ATOM 185 CG2 THR A 12 104.517 8.545 -8.231 1.00 0.00 C ATOM 0 H THR A 12 107.676 6.397 -9.449 1.00 0.00 H new ATOM 0 HA THR A 12 106.588 8.873 -10.076 1.00 0.00 H new ATOM 0 HB THR A 12 105.877 6.925 -7.835 1.00 0.00 H new ATOM 0 HG1 THR A 12 104.319 6.257 -9.430 1.00 0.00 H new ATOM 0 HG21 THR A 12 103.642 7.993 -7.888 1.00 0.00 H new ATOM 0 HG22 THR A 12 104.898 9.162 -7.418 1.00 0.00 H new ATOM 0 HG23 THR A 12 104.238 9.182 -9.070 1.00 0.00 H new ATOM 193 N SER A 13 106.539 10.427 -7.964 1.00 0.00 N ATOM 194 CA SER A 13 106.882 11.453 -6.934 1.00 0.00 C ATOM 195 C SER A 13 106.922 10.801 -5.548 1.00 0.00 C ATOM 196 O SER A 13 106.988 11.473 -4.538 1.00 0.00 O ATOM 197 CB SER A 13 105.825 12.558 -6.946 1.00 0.00 C ATOM 198 OG SER A 13 106.385 13.748 -6.405 1.00 0.00 O ATOM 0 H SER A 13 105.728 10.651 -8.541 1.00 0.00 H new ATOM 0 HA SER A 13 107.860 11.879 -7.160 1.00 0.00 H new ATOM 0 HB2 SER A 13 105.479 12.735 -7.964 1.00 0.00 H new ATOM 0 HB3 SER A 13 104.956 12.253 -6.363 1.00 0.00 H new ATOM 0 HG SER A 13 105.711 14.459 -6.412 1.00 0.00 H new ATOM 204 N GLY A 14 106.866 9.500 -5.493 1.00 0.00 N ATOM 205 CA GLY A 14 106.881 8.801 -4.177 1.00 0.00 C ATOM 206 C GLY A 14 107.968 9.387 -3.272 1.00 0.00 C ATOM 207 O GLY A 14 107.842 9.391 -2.063 1.00 0.00 O ATOM 0 H GLY A 14 106.810 8.887 -6.307 1.00 0.00 H new ATOM 0 HA2 GLY A 14 105.908 8.898 -3.696 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.059 7.736 -4.326 1.00 0.00 H new ATOM 211 N ARG A 15 109.039 9.868 -3.835 1.00 0.00 N ATOM 212 CA ARG A 15 110.130 10.434 -2.991 1.00 0.00 C ATOM 213 C ARG A 15 109.612 11.612 -2.156 1.00 0.00 C ATOM 214 O ARG A 15 109.651 11.585 -0.942 1.00 0.00 O ATOM 215 CB ARG A 15 111.276 10.912 -3.888 1.00 0.00 C ATOM 216 CG ARG A 15 110.709 11.449 -5.203 1.00 0.00 C ATOM 217 CD ARG A 15 111.486 12.696 -5.635 1.00 0.00 C ATOM 218 NE ARG A 15 111.476 12.796 -7.121 1.00 0.00 N ATOM 219 CZ ARG A 15 112.142 13.748 -7.715 1.00 0.00 C ATOM 220 NH1 ARG A 15 112.815 14.613 -7.007 1.00 0.00 N ATOM 221 NH2 ARG A 15 112.134 13.836 -9.017 1.00 0.00 N ATOM 0 H ARG A 15 109.208 9.895 -4.841 1.00 0.00 H new ATOM 0 HA ARG A 15 110.487 9.656 -2.316 1.00 0.00 H new ATOM 0 HB2 ARG A 15 111.847 11.690 -3.382 1.00 0.00 H new ATOM 0 HB3 ARG A 15 111.964 10.090 -4.086 1.00 0.00 H new ATOM 0 HG2 ARG A 15 110.774 10.684 -5.976 1.00 0.00 H new ATOM 0 HG3 ARG A 15 109.653 11.692 -5.082 1.00 0.00 H new ATOM 0 HD2 ARG A 15 111.037 13.587 -5.197 1.00 0.00 H new ATOM 0 HD3 ARG A 15 112.512 12.643 -5.270 1.00 0.00 H new ATOM 0 HE ARG A 15 110.949 12.120 -7.674 1.00 0.00 H new ATOM 0 HH11 ARG A 15 112.821 14.545 -5.989 1.00 0.00 H new ATOM 0 HH12 ARG A 15 113.336 15.357 -7.471 1.00 0.00 H new ATOM 0 HH21 ARG A 15 111.607 13.161 -9.571 1.00 0.00 H new ATOM 0 HH22 ARG A 15 112.655 14.580 -9.481 1.00 0.00 H new ATOM 235 N GLU A 16 109.151 12.656 -2.792 1.00 0.00 N ATOM 236 CA GLU A 16 108.662 13.842 -2.026 1.00 0.00 C ATOM 237 C GLU A 16 107.218 13.636 -1.559 1.00 0.00 C ATOM 238 O GLU A 16 106.828 14.094 -0.504 1.00 0.00 O ATOM 239 CB GLU A 16 108.735 15.088 -2.922 1.00 0.00 C ATOM 240 CG GLU A 16 107.365 15.370 -3.547 1.00 0.00 C ATOM 241 CD GLU A 16 107.510 16.442 -4.629 1.00 0.00 C ATOM 242 OE1 GLU A 16 108.425 16.330 -5.428 1.00 0.00 O ATOM 243 OE2 GLU A 16 106.703 17.357 -4.640 1.00 0.00 O ATOM 0 H GLU A 16 109.091 12.740 -3.807 1.00 0.00 H new ATOM 0 HA GLU A 16 109.293 13.972 -1.147 1.00 0.00 H new ATOM 0 HB2 GLU A 16 109.060 15.948 -2.336 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.477 14.938 -3.706 1.00 0.00 H new ATOM 0 HG2 GLU A 16 106.955 14.457 -3.977 1.00 0.00 H new ATOM 0 HG3 GLU A 16 106.665 15.704 -2.781 1.00 0.00 H new ATOM 250 N GLU A 17 106.413 12.985 -2.347 1.00 0.00 N ATOM 251 CA GLU A 17 104.988 12.792 -1.959 1.00 0.00 C ATOM 252 C GLU A 17 104.850 11.742 -0.853 1.00 0.00 C ATOM 253 O GLU A 17 104.189 11.965 0.142 1.00 0.00 O ATOM 254 CB GLU A 17 104.191 12.339 -3.184 1.00 0.00 C ATOM 255 CG GLU A 17 102.793 11.896 -2.748 1.00 0.00 C ATOM 256 CD GLU A 17 101.803 12.133 -3.890 1.00 0.00 C ATOM 257 OE1 GLU A 17 101.707 11.274 -4.752 1.00 0.00 O ATOM 258 OE2 GLU A 17 101.158 13.168 -3.884 1.00 0.00 O ATOM 0 H GLU A 17 106.679 12.577 -3.244 1.00 0.00 H new ATOM 0 HA GLU A 17 104.604 13.740 -1.582 1.00 0.00 H new ATOM 0 HB2 GLU A 17 104.118 13.153 -3.905 1.00 0.00 H new ATOM 0 HB3 GLU A 17 104.706 11.517 -3.682 1.00 0.00 H new ATOM 0 HG2 GLU A 17 102.803 10.841 -2.474 1.00 0.00 H new ATOM 0 HG3 GLU A 17 102.483 12.452 -1.863 1.00 0.00 H new ATOM 265 N LEU A 18 105.429 10.588 -1.024 1.00 0.00 N ATOM 266 CA LEU A 18 105.274 9.528 0.013 1.00 0.00 C ATOM 267 C LEU A 18 106.163 9.791 1.233 1.00 0.00 C ATOM 268 O LEU A 18 105.783 9.480 2.343 1.00 0.00 O ATOM 269 CB LEU A 18 105.616 8.164 -0.591 1.00 0.00 C ATOM 270 CG LEU A 18 104.371 7.273 -0.565 1.00 0.00 C ATOM 271 CD1 LEU A 18 103.920 7.064 0.884 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.245 7.943 -1.360 1.00 0.00 C ATOM 0 H LEU A 18 105.999 10.332 -1.830 1.00 0.00 H new ATOM 0 HA LEU A 18 104.237 9.538 0.349 1.00 0.00 H new ATOM 0 HB2 LEU A 18 105.969 8.285 -1.615 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.424 7.696 -0.028 1.00 0.00 H new ATOM 0 HG LEU A 18 104.607 6.308 -1.013 1.00 0.00 H new ATOM 0 HD11 LEU A 18 103.034 6.430 0.901 1.00 0.00 H new ATOM 0 HD12 LEU A 18 104.720 6.585 1.449 1.00 0.00 H new ATOM 0 HD13 LEU A 18 103.685 8.028 1.335 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.359 7.308 -1.341 1.00 0.00 H new ATOM 0 HD22 LEU A 18 103.009 8.909 -0.913 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.565 8.089 -2.392 1.00 0.00 H new ATOM 284 N THR A 19 107.335 10.345 1.067 1.00 0.00 N ATOM 285 CA THR A 19 108.186 10.583 2.267 1.00 0.00 C ATOM 286 C THR A 19 107.559 11.692 3.105 1.00 0.00 C ATOM 287 O THR A 19 107.286 11.519 4.274 1.00 0.00 O ATOM 288 CB THR A 19 109.594 10.993 1.835 1.00 0.00 C ATOM 289 OG1 THR A 19 110.055 10.087 0.844 1.00 0.00 O ATOM 290 CG2 THR A 19 110.538 10.961 3.044 1.00 0.00 C ATOM 0 H THR A 19 107.732 10.637 0.174 1.00 0.00 H new ATOM 0 HA THR A 19 108.253 9.668 2.856 1.00 0.00 H new ATOM 0 HB THR A 19 109.573 12.004 1.429 1.00 0.00 H new ATOM 0 HG1 THR A 19 109.649 10.312 -0.019 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.540 11.254 2.731 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.178 11.654 3.805 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.567 9.952 3.456 1.00 0.00 H new ATOM 298 N ARG A 20 107.315 12.823 2.508 1.00 0.00 N ATOM 299 CA ARG A 20 106.690 13.947 3.253 1.00 0.00 C ATOM 300 C ARG A 20 105.405 13.469 3.936 1.00 0.00 C ATOM 301 O ARG A 20 105.014 13.973 4.970 1.00 0.00 O ATOM 302 CB ARG A 20 106.342 15.062 2.271 1.00 0.00 C ATOM 303 CG ARG A 20 107.626 15.723 1.787 1.00 0.00 C ATOM 304 CD ARG A 20 107.330 16.590 0.560 1.00 0.00 C ATOM 305 NE ARG A 20 105.856 16.705 0.374 1.00 0.00 N ATOM 306 CZ ARG A 20 105.376 17.413 -0.612 1.00 0.00 C ATOM 307 NH1 ARG A 20 106.188 18.019 -1.435 1.00 0.00 N ATOM 308 NH2 ARG A 20 104.086 17.514 -0.775 1.00 0.00 N ATOM 0 H ARG A 20 107.523 13.018 1.529 1.00 0.00 H new ATOM 0 HA ARG A 20 107.388 14.311 4.007 1.00 0.00 H new ATOM 0 HB2 ARG A 20 105.786 14.657 1.425 1.00 0.00 H new ATOM 0 HB3 ARG A 20 105.699 15.799 2.752 1.00 0.00 H new ATOM 0 HG2 ARG A 20 108.053 16.334 2.582 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.366 14.963 1.537 1.00 0.00 H new ATOM 0 HD2 ARG A 20 107.769 17.580 0.687 1.00 0.00 H new ATOM 0 HD3 ARG A 20 107.786 16.150 -0.327 1.00 0.00 H new ATOM 0 HE ARG A 20 105.222 16.231 1.017 1.00 0.00 H new ATOM 0 HH11 ARG A 20 107.197 17.939 -1.307 1.00 0.00 H new ATOM 0 HH12 ARG A 20 105.814 18.572 -2.206 1.00 0.00 H new ATOM 0 HH21 ARG A 20 103.452 17.040 -0.132 1.00 0.00 H new ATOM 0 HH22 ARG A 20 103.711 18.067 -1.546 1.00 0.00 H new ATOM 322 N GLN A 21 104.734 12.514 3.351 1.00 0.00 N ATOM 323 CA GLN A 21 103.461 12.017 3.946 1.00 0.00 C ATOM 324 C GLN A 21 103.732 11.065 5.117 1.00 0.00 C ATOM 325 O GLN A 21 102.866 10.828 5.934 1.00 0.00 O ATOM 326 CB GLN A 21 102.652 11.286 2.877 1.00 0.00 C ATOM 327 CG GLN A 21 102.218 12.278 1.797 1.00 0.00 C ATOM 328 CD GLN A 21 100.897 12.932 2.206 1.00 0.00 C ATOM 329 OE1 GLN A 21 100.780 13.465 3.291 1.00 0.00 O ATOM 330 NE2 GLN A 21 99.891 12.915 1.375 1.00 0.00 N ATOM 0 H GLN A 21 105.014 12.055 2.484 1.00 0.00 H new ATOM 0 HA GLN A 21 102.901 12.874 4.321 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.250 10.489 2.435 1.00 0.00 H new ATOM 0 HB3 GLN A 21 101.777 10.816 3.326 1.00 0.00 H new ATOM 0 HG2 GLN A 21 102.985 13.040 1.658 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.102 11.765 0.842 1.00 0.00 H new ATOM 0 HE21 GLN A 21 99.990 12.467 0.464 1.00 0.00 H new ATOM 0 HE22 GLN A 21 99.006 13.349 1.637 1.00 0.00 H new ATOM 339 N VAL A 22 104.906 10.500 5.208 1.00 0.00 N ATOM 340 CA VAL A 22 105.171 9.557 6.335 1.00 0.00 C ATOM 341 C VAL A 22 104.681 10.185 7.641 1.00 0.00 C ATOM 342 O VAL A 22 104.233 9.499 8.538 1.00 0.00 O ATOM 343 CB VAL A 22 106.671 9.255 6.443 1.00 0.00 C ATOM 344 CG1 VAL A 22 107.212 8.840 5.076 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.418 10.498 6.934 1.00 0.00 C ATOM 0 H VAL A 22 105.682 10.646 4.563 1.00 0.00 H new ATOM 0 HA VAL A 22 104.641 8.623 6.148 1.00 0.00 H new ATOM 0 HB VAL A 22 106.821 8.442 7.154 1.00 0.00 H new ATOM 0 HG11 VAL A 22 108.278 8.626 5.156 1.00 0.00 H new ATOM 0 HG12 VAL A 22 106.688 7.948 4.733 1.00 0.00 H new ATOM 0 HG13 VAL A 22 107.057 9.649 4.362 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.483 10.277 7.009 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.266 11.316 6.230 1.00 0.00 H new ATOM 0 HG23 VAL A 22 107.038 10.787 7.914 1.00 0.00 H new ATOM 355 N GLY A 23 104.745 11.484 7.753 1.00 0.00 N ATOM 356 CA GLY A 23 104.263 12.141 8.999 1.00 0.00 C ATOM 357 C GLY A 23 102.818 11.710 9.247 1.00 0.00 C ATOM 358 O GLY A 23 102.267 11.912 10.311 1.00 0.00 O ATOM 0 H GLY A 23 105.108 12.115 7.039 1.00 0.00 H new ATOM 0 HA2 GLY A 23 104.892 11.860 9.843 1.00 0.00 H new ATOM 0 HA3 GLY A 23 104.324 13.225 8.903 1.00 0.00 H new ATOM 362 N ARG A 24 102.207 11.107 8.264 1.00 0.00 N ATOM 363 CA ARG A 24 100.801 10.644 8.419 1.00 0.00 C ATOM 364 C ARG A 24 100.767 9.119 8.326 1.00 0.00 C ATOM 365 O ARG A 24 100.094 8.454 9.088 1.00 0.00 O ATOM 366 CB ARG A 24 99.940 11.244 7.305 1.00 0.00 C ATOM 367 CG ARG A 24 99.404 12.606 7.751 1.00 0.00 C ATOM 368 CD ARG A 24 99.182 13.493 6.524 1.00 0.00 C ATOM 369 NE ARG A 24 98.273 14.618 6.883 1.00 0.00 N ATOM 370 CZ ARG A 24 97.711 15.328 5.943 1.00 0.00 C ATOM 371 NH1 ARG A 24 97.946 15.053 4.689 1.00 0.00 N ATOM 372 NH2 ARG A 24 96.915 16.313 6.256 1.00 0.00 N ATOM 0 H ARG A 24 102.626 10.914 7.354 1.00 0.00 H new ATOM 0 HA ARG A 24 100.411 10.963 9.386 1.00 0.00 H new ATOM 0 HB2 ARG A 24 100.529 11.354 6.395 1.00 0.00 H new ATOM 0 HB3 ARG A 24 99.112 10.575 7.070 1.00 0.00 H new ATOM 0 HG2 ARG A 24 98.469 12.480 8.296 1.00 0.00 H new ATOM 0 HG3 ARG A 24 100.109 13.081 8.433 1.00 0.00 H new ATOM 0 HD2 ARG A 24 100.135 13.882 6.166 1.00 0.00 H new ATOM 0 HD3 ARG A 24 98.751 12.908 5.712 1.00 0.00 H new ATOM 0 HE ARG A 24 98.090 14.833 7.863 1.00 0.00 H new ATOM 0 HH11 ARG A 24 98.569 14.283 4.444 1.00 0.00 H new ATOM 0 HH12 ARG A 24 97.507 15.608 3.954 1.00 0.00 H new ATOM 0 HH21 ARG A 24 96.731 16.529 7.236 1.00 0.00 H new ATOM 0 HH22 ARG A 24 96.476 16.867 5.521 1.00 0.00 H new ATOM 386 N TYR A 25 101.494 8.557 7.396 1.00 0.00 N ATOM 387 CA TYR A 25 101.508 7.074 7.257 1.00 0.00 C ATOM 388 C TYR A 25 102.699 6.504 8.029 1.00 0.00 C ATOM 389 O TYR A 25 102.653 5.397 8.527 1.00 0.00 O ATOM 390 CB TYR A 25 101.636 6.689 5.780 1.00 0.00 C ATOM 391 CG TYR A 25 100.878 7.673 4.920 1.00 0.00 C ATOM 392 CD1 TYR A 25 99.765 8.348 5.436 1.00 0.00 C ATOM 393 CD2 TYR A 25 101.291 7.909 3.603 1.00 0.00 C ATOM 394 CE1 TYR A 25 99.066 9.258 4.635 1.00 0.00 C ATOM 395 CE2 TYR A 25 100.591 8.819 2.803 1.00 0.00 C ATOM 396 CZ TYR A 25 99.479 9.494 3.318 1.00 0.00 C ATOM 397 OH TYR A 25 98.789 10.391 2.529 1.00 0.00 O ATOM 0 H TYR A 25 102.077 9.061 6.728 1.00 0.00 H new ATOM 0 HA TYR A 25 100.578 6.669 7.656 1.00 0.00 H new ATOM 0 HB2 TYR A 25 102.687 6.674 5.490 1.00 0.00 H new ATOM 0 HB3 TYR A 25 101.248 5.683 5.623 1.00 0.00 H new ATOM 0 HD1 TYR A 25 99.446 8.166 6.452 1.00 0.00 H new ATOM 0 HD2 TYR A 25 102.150 7.389 3.205 1.00 0.00 H new ATOM 0 HE1 TYR A 25 98.207 9.779 5.033 1.00 0.00 H new ATOM 0 HE2 TYR A 25 100.909 9.000 1.787 1.00 0.00 H new ATOM 0 HH TYR A 25 99.207 10.438 1.644 1.00 0.00 H new ATOM 407 N LYS A 26 103.768 7.248 8.131 1.00 0.00 N ATOM 408 CA LYS A 26 104.955 6.736 8.869 1.00 0.00 C ATOM 409 C LYS A 26 105.444 5.445 8.207 1.00 0.00 C ATOM 410 O LYS A 26 106.442 4.875 8.598 1.00 0.00 O ATOM 411 CB LYS A 26 104.569 6.452 10.322 1.00 0.00 C ATOM 412 CG LYS A 26 105.766 6.732 11.233 1.00 0.00 C ATOM 413 CD LYS A 26 105.409 6.363 12.673 1.00 0.00 C ATOM 414 CE LYS A 26 105.228 4.848 12.782 1.00 0.00 C ATOM 415 NZ LYS A 26 105.525 4.411 14.176 1.00 0.00 N ATOM 0 H LYS A 26 103.869 8.183 7.737 1.00 0.00 H new ATOM 0 HA LYS A 26 105.750 7.481 8.846 1.00 0.00 H new ATOM 0 HB2 LYS A 26 103.723 7.075 10.613 1.00 0.00 H new ATOM 0 HB3 LYS A 26 104.252 5.415 10.429 1.00 0.00 H new ATOM 0 HG2 LYS A 26 106.630 6.156 10.903 1.00 0.00 H new ATOM 0 HG3 LYS A 26 106.043 7.785 11.174 1.00 0.00 H new ATOM 0 HD2 LYS A 26 106.195 6.696 13.350 1.00 0.00 H new ATOM 0 HD3 LYS A 26 104.493 6.872 12.974 1.00 0.00 H new ATOM 0 HE2 LYS A 26 104.208 4.573 12.513 1.00 0.00 H new ATOM 0 HE3 LYS A 26 105.891 4.340 12.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 105.402 3.381 14.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 106.505 4.661 14.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 104.875 4.886 14.835 1.00 0.00 H new ATOM 429 N ASN A 27 104.746 4.981 7.205 1.00 0.00 N ATOM 430 CA ASN A 27 105.171 3.729 6.519 1.00 0.00 C ATOM 431 C ASN A 27 106.326 4.040 5.566 1.00 0.00 C ATOM 432 O ASN A 27 106.444 5.134 5.054 1.00 0.00 O ATOM 433 CB ASN A 27 103.993 3.155 5.728 1.00 0.00 C ATOM 434 CG ASN A 27 103.213 2.178 6.610 1.00 0.00 C ATOM 435 OD1 ASN A 27 102.581 1.266 6.114 1.00 0.00 O ATOM 436 ND2 ASN A 27 103.232 2.330 7.906 1.00 0.00 N ATOM 0 H ASN A 27 103.901 5.415 6.833 1.00 0.00 H new ATOM 0 HA ASN A 27 105.498 2.999 7.260 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.339 3.960 5.393 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.355 2.646 4.835 1.00 0.00 H new ATOM 0 HD21 ASN A 27 102.716 1.683 8.503 1.00 0.00 H new ATOM 0 HD22 ASN A 27 103.762 3.095 8.322 1.00 0.00 H new ATOM 443 N LYS A 28 107.182 3.085 5.330 1.00 0.00 N ATOM 444 CA LYS A 28 108.338 3.319 4.418 1.00 0.00 C ATOM 445 C LYS A 28 108.433 2.159 3.419 1.00 0.00 C ATOM 446 O LYS A 28 108.620 2.348 2.227 1.00 0.00 O ATOM 447 CB LYS A 28 109.623 3.376 5.244 1.00 0.00 C ATOM 448 CG LYS A 28 109.368 4.118 6.563 1.00 0.00 C ATOM 449 CD LYS A 28 109.229 5.619 6.299 1.00 0.00 C ATOM 450 CE LYS A 28 109.733 6.397 7.517 1.00 0.00 C ATOM 451 NZ LYS A 28 111.200 6.184 7.671 1.00 0.00 N ATOM 0 H LYS A 28 107.131 2.148 5.731 1.00 0.00 H new ATOM 0 HA LYS A 28 108.202 4.258 3.881 1.00 0.00 H new ATOM 0 HB2 LYS A 28 109.978 2.366 5.448 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.406 3.881 4.679 1.00 0.00 H new ATOM 0 HG2 LYS A 28 108.462 3.738 7.035 1.00 0.00 H new ATOM 0 HG3 LYS A 28 110.189 3.937 7.257 1.00 0.00 H new ATOM 0 HD2 LYS A 28 109.800 5.898 5.413 1.00 0.00 H new ATOM 0 HD3 LYS A 28 108.187 5.870 6.099 1.00 0.00 H new ATOM 0 HE2 LYS A 28 109.520 7.459 7.397 1.00 0.00 H new ATOM 0 HE3 LYS A 28 109.211 6.066 8.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 111.389 5.718 8.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 111.547 5.584 6.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 111.689 7.102 7.644 1.00 0.00 H new ATOM 465 N LYS A 29 108.304 0.956 3.910 1.00 0.00 N ATOM 466 CA LYS A 29 108.380 -0.241 3.026 1.00 0.00 C ATOM 467 C LYS A 29 107.130 -0.305 2.147 1.00 0.00 C ATOM 468 O LYS A 29 106.969 -1.189 1.332 1.00 0.00 O ATOM 469 CB LYS A 29 108.447 -1.499 3.898 1.00 0.00 C ATOM 470 CG LYS A 29 107.649 -1.280 5.185 1.00 0.00 C ATOM 471 CD LYS A 29 106.221 -0.854 4.839 1.00 0.00 C ATOM 472 CE LYS A 29 105.307 -1.111 6.038 1.00 0.00 C ATOM 473 NZ LYS A 29 106.037 -0.787 7.297 1.00 0.00 N ATOM 0 H LYS A 29 108.148 0.750 4.897 1.00 0.00 H new ATOM 0 HA LYS A 29 109.266 -0.177 2.394 1.00 0.00 H new ATOM 0 HB2 LYS A 29 108.047 -2.353 3.352 1.00 0.00 H new ATOM 0 HB3 LYS A 29 109.485 -1.732 4.138 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.633 -2.196 5.775 1.00 0.00 H new ATOM 0 HG3 LYS A 29 108.129 -0.516 5.796 1.00 0.00 H new ATOM 0 HD2 LYS A 29 106.200 0.203 4.572 1.00 0.00 H new ATOM 0 HD3 LYS A 29 105.865 -1.409 3.971 1.00 0.00 H new ATOM 0 HE2 LYS A 29 104.407 -0.502 5.960 1.00 0.00 H new ATOM 0 HE3 LYS A 29 104.987 -2.153 6.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 105.353 -0.630 8.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 106.664 -1.578 7.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 106.604 0.074 7.158 1.00 0.00 H new ATOM 487 N PHE A 30 106.234 0.616 2.328 1.00 0.00 N ATOM 488 CA PHE A 30 104.970 0.606 1.534 1.00 0.00 C ATOM 489 C PHE A 30 105.226 0.937 0.055 1.00 0.00 C ATOM 490 O PHE A 30 105.206 0.074 -0.800 1.00 0.00 O ATOM 491 CB PHE A 30 104.089 1.711 2.115 1.00 0.00 C ATOM 492 CG PHE A 30 104.909 2.992 2.271 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.254 3.060 1.837 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.321 4.123 2.849 1.00 0.00 C ATOM 495 CE1 PHE A 30 106.981 4.244 1.982 1.00 0.00 C ATOM 496 CE2 PHE A 30 105.058 5.306 2.993 1.00 0.00 C ATOM 497 CZ PHE A 30 106.387 5.364 2.558 1.00 0.00 C ATOM 0 H PHE A 30 106.318 1.383 2.995 1.00 0.00 H new ATOM 0 HA PHE A 30 104.513 -0.382 1.586 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.235 1.891 1.461 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.691 1.402 3.082 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.720 2.193 1.392 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.295 4.084 3.185 1.00 0.00 H new ATOM 0 HE1 PHE A 30 108.006 4.291 1.646 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.599 6.175 3.441 1.00 0.00 H new ATOM 0 HZ PHE A 30 106.952 6.278 2.669 1.00 0.00 H new ATOM 507 N MET A 31 105.496 2.179 -0.235 1.00 0.00 N ATOM 508 CA MET A 31 105.792 2.600 -1.626 1.00 0.00 C ATOM 509 C MET A 31 107.249 2.286 -1.943 1.00 0.00 C ATOM 510 O MET A 31 107.579 1.749 -2.982 1.00 0.00 O ATOM 511 CB MET A 31 105.557 4.104 -1.753 1.00 0.00 C ATOM 512 CG MET A 31 106.262 4.632 -3.004 1.00 0.00 C ATOM 513 SD MET A 31 105.866 3.567 -4.414 1.00 0.00 S ATOM 514 CE MET A 31 105.867 4.859 -5.681 1.00 0.00 C ATOM 0 H MET A 31 105.524 2.933 0.451 1.00 0.00 H new ATOM 0 HA MET A 31 105.143 2.068 -2.322 1.00 0.00 H new ATOM 0 HB2 MET A 31 104.488 4.311 -1.811 1.00 0.00 H new ATOM 0 HB3 MET A 31 105.933 4.617 -0.868 1.00 0.00 H new ATOM 0 HG2 MET A 31 105.947 5.655 -3.208 1.00 0.00 H new ATOM 0 HG3 MET A 31 107.340 4.656 -2.844 1.00 0.00 H new ATOM 0 HE1 MET A 31 105.641 4.417 -6.651 1.00 0.00 H new ATOM 0 HE2 MET A 31 105.113 5.607 -5.438 1.00 0.00 H new ATOM 0 HE3 MET A 31 106.848 5.332 -5.718 1.00 0.00 H new ATOM 524 N GLN A 32 108.126 2.653 -1.049 1.00 0.00 N ATOM 525 CA GLN A 32 109.569 2.420 -1.272 1.00 0.00 C ATOM 526 C GLN A 32 109.892 0.931 -1.098 1.00 0.00 C ATOM 527 O GLN A 32 110.825 0.420 -1.681 1.00 0.00 O ATOM 528 CB GLN A 32 110.366 3.284 -0.292 1.00 0.00 C ATOM 529 CG GLN A 32 110.028 4.758 -0.531 1.00 0.00 C ATOM 530 CD GLN A 32 110.784 5.625 0.477 1.00 0.00 C ATOM 531 OE1 GLN A 32 111.896 5.310 0.853 1.00 0.00 O ATOM 532 NE2 GLN A 32 110.225 6.713 0.932 1.00 0.00 N ATOM 0 H GLN A 32 107.895 3.109 -0.166 1.00 0.00 H new ATOM 0 HA GLN A 32 109.844 2.700 -2.289 1.00 0.00 H new ATOM 0 HB2 GLN A 32 110.127 3.005 0.734 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.435 3.117 -0.427 1.00 0.00 H new ATOM 0 HG2 GLN A 32 110.298 5.044 -1.547 1.00 0.00 H new ATOM 0 HG3 GLN A 32 108.954 4.917 -0.430 1.00 0.00 H new ATOM 0 HE21 GLN A 32 109.292 6.977 0.616 1.00 0.00 H new ATOM 0 HE22 GLN A 32 110.721 7.299 1.603 1.00 0.00 H new ATOM 541 N GLY A 33 109.142 0.224 -0.297 1.00 0.00 N ATOM 542 CA GLY A 33 109.438 -1.224 -0.115 1.00 0.00 C ATOM 543 C GLY A 33 108.965 -1.987 -1.352 1.00 0.00 C ATOM 544 O GLY A 33 109.631 -2.882 -1.836 1.00 0.00 O ATOM 0 H GLY A 33 108.347 0.581 0.233 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.507 -1.374 0.034 1.00 0.00 H new ATOM 0 HA3 GLY A 33 108.936 -1.602 0.776 1.00 0.00 H new ATOM 548 N THR A 34 107.820 -1.636 -1.873 1.00 0.00 N ATOM 549 CA THR A 34 107.308 -2.338 -3.082 1.00 0.00 C ATOM 550 C THR A 34 108.148 -1.934 -4.294 1.00 0.00 C ATOM 551 O THR A 34 108.272 -2.677 -5.247 1.00 0.00 O ATOM 552 CB THR A 34 105.843 -1.957 -3.320 1.00 0.00 C ATOM 553 OG1 THR A 34 105.327 -2.721 -4.401 1.00 0.00 O ATOM 554 CG2 THR A 34 105.744 -0.468 -3.654 1.00 0.00 C ATOM 0 H THR A 34 107.219 -0.895 -1.513 1.00 0.00 H new ATOM 0 HA THR A 34 107.377 -3.416 -2.933 1.00 0.00 H new ATOM 0 HB THR A 34 105.265 -2.162 -2.419 1.00 0.00 H new ATOM 0 HG1 THR A 34 104.390 -2.480 -4.554 1.00 0.00 H new ATOM 0 HG21 THR A 34 104.701 -0.201 -3.822 1.00 0.00 H new ATOM 0 HG22 THR A 34 106.139 0.118 -2.824 1.00 0.00 H new ATOM 0 HG23 THR A 34 106.322 -0.258 -4.554 1.00 0.00 H new ATOM 562 N VAL A 35 108.734 -0.766 -4.268 1.00 0.00 N ATOM 563 CA VAL A 35 109.570 -0.336 -5.423 1.00 0.00 C ATOM 564 C VAL A 35 110.908 -1.081 -5.366 1.00 0.00 C ATOM 565 O VAL A 35 111.321 -1.701 -6.324 1.00 0.00 O ATOM 566 CB VAL A 35 109.790 1.181 -5.370 1.00 0.00 C ATOM 567 CG1 VAL A 35 110.876 1.509 -4.353 1.00 0.00 C ATOM 568 CG2 VAL A 35 110.217 1.694 -6.748 1.00 0.00 C ATOM 0 H VAL A 35 108.670 -0.096 -3.501 1.00 0.00 H new ATOM 0 HA VAL A 35 109.067 -0.573 -6.360 1.00 0.00 H new ATOM 0 HB VAL A 35 108.858 1.663 -5.076 1.00 0.00 H new ATOM 0 HG11 VAL A 35 111.029 2.588 -4.319 1.00 0.00 H new ATOM 0 HG12 VAL A 35 110.571 1.154 -3.368 1.00 0.00 H new ATOM 0 HG13 VAL A 35 111.806 1.020 -4.643 1.00 0.00 H new ATOM 0 HG21 VAL A 35 110.371 2.772 -6.703 1.00 0.00 H new ATOM 0 HG22 VAL A 35 111.145 1.207 -7.046 1.00 0.00 H new ATOM 0 HG23 VAL A 35 109.439 1.469 -7.477 1.00 0.00 H new ATOM 578 N ALA A 36 111.580 -1.052 -4.243 1.00 0.00 N ATOM 579 CA ALA A 36 112.868 -1.788 -4.133 1.00 0.00 C ATOM 580 C ALA A 36 112.666 -3.177 -4.724 1.00 0.00 C ATOM 581 O ALA A 36 113.445 -3.648 -5.529 1.00 0.00 O ATOM 582 CB ALA A 36 113.259 -1.917 -2.660 1.00 0.00 C ATOM 0 H ALA A 36 111.291 -0.552 -3.403 1.00 0.00 H new ATOM 0 HA ALA A 36 113.657 -1.256 -4.665 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.203 -2.456 -2.580 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.371 -0.924 -2.225 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.483 -2.463 -2.124 1.00 0.00 H new ATOM 588 N VAL A 37 111.606 -3.828 -4.335 1.00 0.00 N ATOM 589 CA VAL A 37 111.321 -5.182 -4.874 1.00 0.00 C ATOM 590 C VAL A 37 111.314 -5.099 -6.396 1.00 0.00 C ATOM 591 O VAL A 37 111.884 -5.932 -7.078 1.00 0.00 O ATOM 592 CB VAL A 37 109.949 -5.650 -4.383 1.00 0.00 C ATOM 593 CG1 VAL A 37 109.759 -7.129 -4.722 1.00 0.00 C ATOM 594 CG2 VAL A 37 109.848 -5.452 -2.865 1.00 0.00 C ATOM 0 H VAL A 37 110.923 -3.477 -3.664 1.00 0.00 H new ATOM 0 HA VAL A 37 112.080 -5.889 -4.537 1.00 0.00 H new ATOM 0 HB VAL A 37 109.172 -5.064 -4.875 1.00 0.00 H new ATOM 0 HG11 VAL A 37 108.781 -7.460 -4.371 1.00 0.00 H new ATOM 0 HG12 VAL A 37 109.823 -7.266 -5.801 1.00 0.00 H new ATOM 0 HG13 VAL A 37 110.537 -7.717 -4.235 1.00 0.00 H new ATOM 0 HG21 VAL A 37 108.870 -5.786 -2.519 1.00 0.00 H new ATOM 0 HG22 VAL A 37 110.626 -6.033 -2.370 1.00 0.00 H new ATOM 0 HG23 VAL A 37 109.976 -4.396 -2.626 1.00 0.00 H new ATOM 604 N CYS A 38 110.696 -4.085 -6.939 1.00 0.00 N ATOM 605 CA CYS A 38 110.686 -3.947 -8.414 1.00 0.00 C ATOM 606 C CYS A 38 112.132 -4.043 -8.888 1.00 0.00 C ATOM 607 O CYS A 38 112.417 -4.472 -9.987 1.00 0.00 O ATOM 608 CB CYS A 38 110.098 -2.591 -8.811 1.00 0.00 C ATOM 609 SG CYS A 38 108.458 -2.405 -8.069 1.00 0.00 S ATOM 0 H CYS A 38 110.203 -3.354 -6.426 1.00 0.00 H new ATOM 0 HA CYS A 38 110.076 -4.727 -8.869 1.00 0.00 H new ATOM 0 HB2 CYS A 38 110.753 -1.787 -8.477 1.00 0.00 H new ATOM 0 HB3 CYS A 38 110.029 -2.516 -9.896 1.00 0.00 H new ATOM 0 HG CYS A 38 108.562 -2.432 -6.773 1.00 0.00 H new ATOM 615 N ALA A 39 113.053 -3.647 -8.055 1.00 0.00 N ATOM 616 CA ALA A 39 114.481 -3.731 -8.439 1.00 0.00 C ATOM 617 C ALA A 39 114.983 -5.170 -8.266 1.00 0.00 C ATOM 618 O ALA A 39 115.590 -5.739 -9.149 1.00 0.00 O ATOM 619 CB ALA A 39 115.302 -2.802 -7.552 1.00 0.00 C ATOM 0 H ALA A 39 112.874 -3.269 -7.125 1.00 0.00 H new ATOM 0 HA ALA A 39 114.588 -3.434 -9.482 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.353 -2.864 -7.835 1.00 0.00 H new ATOM 0 HB2 ALA A 39 114.952 -1.777 -7.677 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.188 -3.100 -6.510 1.00 0.00 H new ATOM 625 N ARG A 40 114.759 -5.744 -7.113 1.00 0.00 N ATOM 626 CA ARG A 40 115.255 -7.126 -6.839 1.00 0.00 C ATOM 627 C ARG A 40 115.080 -8.032 -8.061 1.00 0.00 C ATOM 628 O ARG A 40 115.943 -8.827 -8.366 1.00 0.00 O ATOM 629 CB ARG A 40 114.490 -7.717 -5.652 1.00 0.00 C ATOM 630 CG ARG A 40 114.986 -9.141 -5.378 1.00 0.00 C ATOM 631 CD ARG A 40 114.018 -10.154 -5.995 1.00 0.00 C ATOM 632 NE ARG A 40 112.633 -9.869 -5.526 1.00 0.00 N ATOM 633 CZ ARG A 40 111.701 -10.774 -5.655 1.00 0.00 C ATOM 634 NH1 ARG A 40 111.983 -11.928 -6.196 1.00 0.00 N ATOM 635 NH2 ARG A 40 110.488 -10.524 -5.244 1.00 0.00 N ATOM 0 H ARG A 40 114.249 -5.311 -6.343 1.00 0.00 H new ATOM 0 HA ARG A 40 116.318 -7.067 -6.607 1.00 0.00 H new ATOM 0 HB2 ARG A 40 114.633 -7.095 -4.768 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.421 -7.728 -5.865 1.00 0.00 H new ATOM 0 HG2 ARG A 40 115.983 -9.276 -5.797 1.00 0.00 H new ATOM 0 HG3 ARG A 40 115.066 -9.308 -4.304 1.00 0.00 H new ATOM 0 HD2 ARG A 40 114.063 -10.100 -7.083 1.00 0.00 H new ATOM 0 HD3 ARG A 40 114.307 -11.167 -5.714 1.00 0.00 H new ATOM 0 HE ARG A 40 112.413 -8.967 -5.104 1.00 0.00 H new ATOM 0 HH11 ARG A 40 112.931 -12.122 -6.518 1.00 0.00 H new ATOM 0 HH12 ARG A 40 111.255 -12.635 -6.297 1.00 0.00 H new ATOM 0 HH21 ARG A 40 110.268 -9.622 -4.822 1.00 0.00 H new ATOM 0 HH22 ARG A 40 109.760 -11.231 -5.345 1.00 0.00 H new ATOM 649 N ILE A 41 113.982 -7.948 -8.757 1.00 0.00 N ATOM 650 CA ILE A 41 113.811 -8.842 -9.943 1.00 0.00 C ATOM 651 C ILE A 41 114.305 -8.160 -11.226 1.00 0.00 C ATOM 652 O ILE A 41 114.619 -8.818 -12.198 1.00 0.00 O ATOM 653 CB ILE A 41 112.341 -9.229 -10.102 1.00 0.00 C ATOM 654 CG1 ILE A 41 111.451 -8.106 -9.574 1.00 0.00 C ATOM 655 CG2 ILE A 41 112.074 -10.503 -9.307 1.00 0.00 C ATOM 656 CD1 ILE A 41 111.846 -6.794 -10.246 1.00 0.00 C ATOM 0 H ILE A 41 113.207 -7.313 -8.565 1.00 0.00 H new ATOM 0 HA ILE A 41 114.408 -9.739 -9.776 1.00 0.00 H new ATOM 0 HB ILE A 41 112.120 -9.395 -11.156 1.00 0.00 H new ATOM 0 HG12 ILE A 41 110.404 -8.331 -9.776 1.00 0.00 H new ATOM 0 HG13 ILE A 41 111.556 -8.020 -8.492 1.00 0.00 H new ATOM 0 HG21 ILE A 41 111.027 -10.786 -9.415 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.708 -11.306 -9.683 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.296 -10.328 -8.254 1.00 0.00 H new ATOM 0 HD11 ILE A 41 111.213 -5.989 -9.872 1.00 0.00 H new ATOM 0 HD12 ILE A 41 112.889 -6.570 -10.022 1.00 0.00 H new ATOM 0 HD13 ILE A 41 111.718 -6.885 -11.325 1.00 0.00 H new ATOM 668 N ALA A 42 114.368 -6.855 -11.255 1.00 0.00 N ATOM 669 CA ALA A 42 114.831 -6.169 -12.496 1.00 0.00 C ATOM 670 C ALA A 42 116.354 -6.020 -12.466 1.00 0.00 C ATOM 671 O ALA A 42 116.956 -5.504 -13.386 1.00 0.00 O ATOM 672 CB ALA A 42 114.167 -4.793 -12.596 1.00 0.00 C ATOM 0 H ALA A 42 114.121 -6.239 -10.480 1.00 0.00 H new ATOM 0 HA ALA A 42 114.553 -6.763 -13.367 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.505 -4.291 -13.503 1.00 0.00 H new ATOM 0 HB2 ALA A 42 113.084 -4.913 -12.630 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.439 -4.194 -11.727 1.00 0.00 H new ATOM 678 N VAL A 43 116.976 -6.460 -11.405 1.00 0.00 N ATOM 679 CA VAL A 43 118.464 -6.340 -11.292 1.00 0.00 C ATOM 680 C VAL A 43 119.123 -6.418 -12.675 1.00 0.00 C ATOM 681 O VAL A 43 120.101 -5.753 -12.939 1.00 0.00 O ATOM 682 CB VAL A 43 118.998 -7.455 -10.392 1.00 0.00 C ATOM 683 CG1 VAL A 43 117.880 -7.973 -9.495 1.00 0.00 C ATOM 684 CG2 VAL A 43 119.532 -8.605 -11.242 1.00 0.00 C ATOM 0 H VAL A 43 116.518 -6.900 -10.607 1.00 0.00 H new ATOM 0 HA VAL A 43 118.706 -5.371 -10.855 1.00 0.00 H new ATOM 0 HB VAL A 43 119.805 -7.054 -9.779 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.265 -8.767 -8.856 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.504 -7.159 -8.876 1.00 0.00 H new ATOM 0 HG13 VAL A 43 117.071 -8.364 -10.111 1.00 0.00 H new ATOM 0 HG21 VAL A 43 119.910 -9.394 -10.591 1.00 0.00 H new ATOM 0 HG22 VAL A 43 118.729 -9.001 -11.864 1.00 0.00 H new ATOM 0 HG23 VAL A 43 120.339 -8.243 -11.879 1.00 0.00 H new ATOM 694 N ALA A 44 118.608 -7.223 -13.556 1.00 0.00 N ATOM 695 CA ALA A 44 119.230 -7.332 -14.905 1.00 0.00 C ATOM 696 C ALA A 44 120.568 -8.066 -14.781 1.00 0.00 C ATOM 697 O ALA A 44 120.881 -8.942 -15.563 1.00 0.00 O ATOM 698 CB ALA A 44 119.465 -5.931 -15.475 1.00 0.00 C ATOM 0 H ALA A 44 117.787 -7.809 -13.404 1.00 0.00 H new ATOM 0 HA ALA A 44 118.568 -7.885 -15.572 1.00 0.00 H new ATOM 0 HB1 ALA A 44 119.920 -6.011 -16.462 1.00 0.00 H new ATOM 0 HB2 ALA A 44 118.513 -5.407 -15.556 1.00 0.00 H new ATOM 0 HB3 ALA A 44 120.130 -5.376 -14.813 1.00 0.00 H new ATOM 704 N SER A 45 121.359 -7.721 -13.798 1.00 0.00 N ATOM 705 CA SER A 45 122.672 -8.406 -13.620 1.00 0.00 C ATOM 706 C SER A 45 122.488 -9.905 -13.842 1.00 0.00 C ATOM 707 O SER A 45 123.425 -10.623 -14.127 1.00 0.00 O ATOM 708 CB SER A 45 123.187 -8.164 -12.203 1.00 0.00 C ATOM 709 OG SER A 45 124.601 -8.313 -12.185 1.00 0.00 O ATOM 0 H SER A 45 121.152 -6.995 -13.112 1.00 0.00 H new ATOM 0 HA SER A 45 123.391 -8.011 -14.338 1.00 0.00 H new ATOM 0 HB2 SER A 45 122.911 -7.164 -11.869 1.00 0.00 H new ATOM 0 HB3 SER A 45 122.727 -8.869 -11.511 1.00 0.00 H new ATOM 0 HG SER A 45 125.022 -7.473 -12.463 1.00 0.00 H new ATOM 715 N ASP A 46 121.279 -10.375 -13.715 1.00 0.00 N ATOM 716 CA ASP A 46 121.009 -11.828 -13.921 1.00 0.00 C ATOM 717 C ASP A 46 121.284 -12.603 -12.628 1.00 0.00 C ATOM 718 O ASP A 46 121.119 -13.806 -12.572 1.00 0.00 O ATOM 719 CB ASP A 46 121.909 -12.364 -15.037 1.00 0.00 C ATOM 720 CG ASP A 46 121.188 -13.492 -15.778 1.00 0.00 C ATOM 721 OD1 ASP A 46 120.050 -13.286 -16.167 1.00 0.00 O ATOM 722 OD2 ASP A 46 121.786 -14.543 -15.943 1.00 0.00 O ATOM 0 H ASP A 46 120.461 -9.814 -13.476 1.00 0.00 H new ATOM 0 HA ASP A 46 119.963 -11.958 -14.200 1.00 0.00 H new ATOM 0 HB2 ASP A 46 122.162 -11.562 -15.731 1.00 0.00 H new ATOM 0 HB3 ASP A 46 122.846 -12.731 -14.618 1.00 0.00 H new ATOM 727 N GLY A 47 121.695 -11.931 -11.586 1.00 0.00 N ATOM 728 CA GLY A 47 121.968 -12.645 -10.304 1.00 0.00 C ATOM 729 C GLY A 47 120.693 -12.665 -9.459 1.00 0.00 C ATOM 730 O GLY A 47 120.277 -13.695 -8.969 1.00 0.00 O ATOM 0 H GLY A 47 121.853 -10.924 -11.566 1.00 0.00 H new ATOM 0 HA2 GLY A 47 122.302 -13.663 -10.505 1.00 0.00 H new ATOM 0 HA3 GLY A 47 122.771 -12.147 -9.760 1.00 0.00 H new ATOM 734 N VAL A 48 120.066 -11.532 -9.296 1.00 0.00 N ATOM 735 CA VAL A 48 118.810 -11.476 -8.495 1.00 0.00 C ATOM 736 C VAL A 48 119.105 -11.779 -7.026 1.00 0.00 C ATOM 737 O VAL A 48 120.037 -12.487 -6.698 1.00 0.00 O ATOM 738 CB VAL A 48 117.814 -12.501 -9.038 1.00 0.00 C ATOM 739 CG1 VAL A 48 116.400 -12.124 -8.593 1.00 0.00 C ATOM 740 CG2 VAL A 48 117.880 -12.516 -10.567 1.00 0.00 C ATOM 0 H VAL A 48 120.371 -10.639 -9.685 1.00 0.00 H new ATOM 0 HA VAL A 48 118.386 -10.475 -8.571 1.00 0.00 H new ATOM 0 HB VAL A 48 118.065 -13.490 -8.653 1.00 0.00 H new ATOM 0 HG11 VAL A 48 115.690 -12.855 -8.980 1.00 0.00 H new ATOM 0 HG12 VAL A 48 116.352 -12.113 -7.504 1.00 0.00 H new ATOM 0 HG13 VAL A 48 116.149 -11.135 -8.977 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.170 -13.247 -10.955 1.00 0.00 H new ATOM 0 HG22 VAL A 48 117.630 -11.527 -10.952 1.00 0.00 H new ATOM 0 HG23 VAL A 48 118.887 -12.785 -10.885 1.00 0.00 H new ATOM 750 N SER A 49 118.310 -11.245 -6.138 1.00 0.00 N ATOM 751 CA SER A 49 118.527 -11.495 -4.686 1.00 0.00 C ATOM 752 C SER A 49 117.247 -12.069 -4.075 1.00 0.00 C ATOM 753 O SER A 49 116.704 -13.043 -4.558 1.00 0.00 O ATOM 754 CB SER A 49 118.880 -10.180 -3.990 1.00 0.00 C ATOM 755 OG SER A 49 117.687 -9.455 -3.721 1.00 0.00 O ATOM 0 H SER A 49 117.516 -10.644 -6.358 1.00 0.00 H new ATOM 0 HA SER A 49 119.344 -12.205 -4.555 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.415 -10.379 -3.062 1.00 0.00 H new ATOM 0 HB3 SER A 49 119.544 -9.589 -4.620 1.00 0.00 H new ATOM 0 HG SER A 49 117.898 -8.668 -3.176 1.00 0.00 H new ATOM 761 N SER A 50 116.759 -11.472 -3.019 1.00 0.00 N ATOM 762 CA SER A 50 115.517 -11.979 -2.374 1.00 0.00 C ATOM 763 C SER A 50 115.534 -11.585 -0.899 1.00 0.00 C ATOM 764 O SER A 50 114.832 -10.689 -0.477 1.00 0.00 O ATOM 765 CB SER A 50 115.455 -13.503 -2.490 1.00 0.00 C ATOM 766 OG SER A 50 116.776 -14.026 -2.521 1.00 0.00 O ATOM 0 H SER A 50 117.171 -10.651 -2.575 1.00 0.00 H new ATOM 0 HA SER A 50 114.646 -11.549 -2.868 1.00 0.00 H new ATOM 0 HB2 SER A 50 114.906 -13.921 -1.647 1.00 0.00 H new ATOM 0 HB3 SER A 50 114.917 -13.789 -3.394 1.00 0.00 H new ATOM 0 HG SER A 50 116.982 -14.341 -3.426 1.00 0.00 H new ATOM 772 N GLU A 51 116.338 -12.246 -0.114 1.00 0.00 N ATOM 773 CA GLU A 51 116.411 -11.911 1.333 1.00 0.00 C ATOM 774 C GLU A 51 117.117 -10.565 1.516 1.00 0.00 C ATOM 775 O GLU A 51 116.866 -9.849 2.464 1.00 0.00 O ATOM 776 CB GLU A 51 117.193 -13.000 2.069 1.00 0.00 C ATOM 777 CG GLU A 51 116.830 -14.369 1.492 1.00 0.00 C ATOM 778 CD GLU A 51 117.361 -15.470 2.412 1.00 0.00 C ATOM 779 OE1 GLU A 51 116.756 -15.691 3.449 1.00 0.00 O ATOM 780 OE2 GLU A 51 118.363 -16.073 2.066 1.00 0.00 O ATOM 0 H GLU A 51 116.949 -13.006 -0.414 1.00 0.00 H new ATOM 0 HA GLU A 51 115.402 -11.848 1.740 1.00 0.00 H new ATOM 0 HB2 GLU A 51 118.264 -12.824 1.969 1.00 0.00 H new ATOM 0 HB3 GLU A 51 116.963 -12.970 3.134 1.00 0.00 H new ATOM 0 HG2 GLU A 51 115.748 -14.457 1.390 1.00 0.00 H new ATOM 0 HG3 GLU A 51 117.255 -14.479 0.494 1.00 0.00 H new ATOM 787 N GLU A 52 118.005 -10.214 0.625 1.00 0.00 N ATOM 788 CA GLU A 52 118.721 -8.915 0.774 1.00 0.00 C ATOM 789 C GLU A 52 117.763 -7.757 0.480 1.00 0.00 C ATOM 790 O GLU A 52 117.619 -6.853 1.278 1.00 0.00 O ATOM 791 CB GLU A 52 119.900 -8.868 -0.196 1.00 0.00 C ATOM 792 CG GLU A 52 121.196 -9.178 0.558 1.00 0.00 C ATOM 793 CD GLU A 52 121.466 -8.076 1.585 1.00 0.00 C ATOM 794 OE1 GLU A 52 120.665 -7.159 1.665 1.00 0.00 O ATOM 795 OE2 GLU A 52 122.468 -8.168 2.274 1.00 0.00 O ATOM 0 H GLU A 52 118.264 -10.766 -0.193 1.00 0.00 H new ATOM 0 HA GLU A 52 119.089 -8.822 1.796 1.00 0.00 H new ATOM 0 HB2 GLU A 52 119.753 -9.590 -0.999 1.00 0.00 H new ATOM 0 HB3 GLU A 52 119.964 -7.884 -0.660 1.00 0.00 H new ATOM 0 HG2 GLU A 52 121.116 -10.144 1.058 1.00 0.00 H new ATOM 0 HG3 GLU A 52 122.028 -9.249 -0.142 1.00 0.00 H new ATOM 802 N LYS A 53 117.087 -7.775 -0.641 1.00 0.00 N ATOM 803 CA LYS A 53 116.134 -6.662 -0.920 1.00 0.00 C ATOM 804 C LYS A 53 115.163 -6.597 0.249 1.00 0.00 C ATOM 805 O LYS A 53 114.889 -5.547 0.791 1.00 0.00 O ATOM 806 CB LYS A 53 115.352 -6.919 -2.219 1.00 0.00 C ATOM 807 CG LYS A 53 114.066 -6.081 -2.223 1.00 0.00 C ATOM 808 CD LYS A 53 112.880 -6.922 -1.727 1.00 0.00 C ATOM 809 CE LYS A 53 112.565 -8.033 -2.732 1.00 0.00 C ATOM 810 NZ LYS A 53 113.239 -9.293 -2.308 1.00 0.00 N ATOM 0 H LYS A 53 117.151 -8.496 -1.360 1.00 0.00 H new ATOM 0 HA LYS A 53 116.680 -5.726 -1.039 1.00 0.00 H new ATOM 0 HB2 LYS A 53 115.967 -6.663 -3.082 1.00 0.00 H new ATOM 0 HB3 LYS A 53 115.108 -7.978 -2.304 1.00 0.00 H new ATOM 0 HG2 LYS A 53 114.192 -5.206 -1.585 1.00 0.00 H new ATOM 0 HG3 LYS A 53 113.865 -5.715 -3.230 1.00 0.00 H new ATOM 0 HD2 LYS A 53 113.114 -7.356 -0.755 1.00 0.00 H new ATOM 0 HD3 LYS A 53 112.005 -6.286 -1.590 1.00 0.00 H new ATOM 0 HE2 LYS A 53 111.488 -8.187 -2.794 1.00 0.00 H new ATOM 0 HE3 LYS A 53 112.903 -7.744 -3.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 113.636 -9.772 -3.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 114.004 -9.070 -1.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 112.548 -9.918 -1.846 1.00 0.00 H new ATOM 824 N GLN A 54 114.652 -7.731 0.640 1.00 0.00 N ATOM 825 CA GLN A 54 113.697 -7.780 1.777 1.00 0.00 C ATOM 826 C GLN A 54 114.318 -7.068 2.988 1.00 0.00 C ATOM 827 O GLN A 54 113.664 -6.310 3.684 1.00 0.00 O ATOM 828 CB GLN A 54 113.396 -9.254 2.092 1.00 0.00 C ATOM 829 CG GLN A 54 113.971 -9.652 3.452 1.00 0.00 C ATOM 830 CD GLN A 54 113.179 -8.967 4.568 1.00 0.00 C ATOM 831 OE1 GLN A 54 113.726 -8.634 5.601 1.00 0.00 O ATOM 832 NE2 GLN A 54 111.904 -8.743 4.403 1.00 0.00 N ATOM 0 H GLN A 54 114.859 -8.634 0.214 1.00 0.00 H new ATOM 0 HA GLN A 54 112.765 -7.274 1.527 1.00 0.00 H new ATOM 0 HB2 GLN A 54 112.318 -9.418 2.087 1.00 0.00 H new ATOM 0 HB3 GLN A 54 113.819 -9.890 1.314 1.00 0.00 H new ATOM 0 HG2 GLN A 54 113.927 -10.734 3.573 1.00 0.00 H new ATOM 0 HG3 GLN A 54 115.021 -9.367 3.511 1.00 0.00 H new ATOM 0 HE21 GLN A 54 111.445 -9.023 3.536 1.00 0.00 H new ATOM 0 HE22 GLN A 54 111.366 -8.288 5.141 1.00 0.00 H new ATOM 841 N LYS A 55 115.581 -7.292 3.235 1.00 0.00 N ATOM 842 CA LYS A 55 116.244 -6.617 4.385 1.00 0.00 C ATOM 843 C LYS A 55 116.254 -5.112 4.125 1.00 0.00 C ATOM 844 O LYS A 55 115.910 -4.319 4.979 1.00 0.00 O ATOM 845 CB LYS A 55 117.682 -7.130 4.522 1.00 0.00 C ATOM 846 CG LYS A 55 117.819 -7.940 5.814 1.00 0.00 C ATOM 847 CD LYS A 55 116.968 -9.208 5.715 1.00 0.00 C ATOM 848 CE LYS A 55 117.495 -10.255 6.697 1.00 0.00 C ATOM 849 NZ LYS A 55 118.570 -11.054 6.042 1.00 0.00 N ATOM 0 H LYS A 55 116.180 -7.912 2.690 1.00 0.00 H new ATOM 0 HA LYS A 55 115.704 -6.831 5.307 1.00 0.00 H new ATOM 0 HB2 LYS A 55 117.941 -7.750 3.663 1.00 0.00 H new ATOM 0 HB3 LYS A 55 118.378 -6.291 4.531 1.00 0.00 H new ATOM 0 HG2 LYS A 55 118.863 -8.203 5.982 1.00 0.00 H new ATOM 0 HG3 LYS A 55 117.500 -7.341 6.667 1.00 0.00 H new ATOM 0 HD2 LYS A 55 115.926 -8.978 5.937 1.00 0.00 H new ATOM 0 HD3 LYS A 55 116.998 -9.600 4.698 1.00 0.00 H new ATOM 0 HE2 LYS A 55 117.883 -9.768 7.591 1.00 0.00 H new ATOM 0 HE3 LYS A 55 116.684 -10.910 7.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 118.929 -11.766 6.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 118.185 -11.530 5.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 119.347 -10.424 5.758 1.00 0.00 H new ATOM 863 N MET A 56 116.639 -4.715 2.943 1.00 0.00 N ATOM 864 CA MET A 56 116.666 -3.267 2.615 1.00 0.00 C ATOM 865 C MET A 56 115.296 -2.652 2.921 1.00 0.00 C ATOM 866 O MET A 56 115.202 -1.543 3.405 1.00 0.00 O ATOM 867 CB MET A 56 116.997 -3.100 1.131 1.00 0.00 C ATOM 868 CG MET A 56 116.770 -1.649 0.706 1.00 0.00 C ATOM 869 SD MET A 56 115.255 -1.545 -0.276 1.00 0.00 S ATOM 870 CE MET A 56 114.565 -0.079 0.525 1.00 0.00 C ATOM 0 H MET A 56 116.936 -5.335 2.190 1.00 0.00 H new ATOM 0 HA MET A 56 117.424 -2.761 3.213 1.00 0.00 H new ATOM 0 HB2 MET A 56 118.033 -3.384 0.947 1.00 0.00 H new ATOM 0 HB3 MET A 56 116.373 -3.765 0.533 1.00 0.00 H new ATOM 0 HG2 MET A 56 116.692 -1.008 1.584 1.00 0.00 H new ATOM 0 HG3 MET A 56 117.620 -1.291 0.124 1.00 0.00 H new ATOM 0 HE1 MET A 56 113.738 0.306 -0.071 1.00 0.00 H new ATOM 0 HE2 MET A 56 114.204 -0.343 1.519 1.00 0.00 H new ATOM 0 HE3 MET A 56 115.337 0.686 0.611 1.00 0.00 H new ATOM 880 N ILE A 57 114.228 -3.361 2.664 1.00 0.00 N ATOM 881 CA ILE A 57 112.884 -2.791 2.973 1.00 0.00 C ATOM 882 C ILE A 57 112.845 -2.453 4.463 1.00 0.00 C ATOM 883 O ILE A 57 112.404 -1.394 4.860 1.00 0.00 O ATOM 884 CB ILE A 57 111.786 -3.805 2.639 1.00 0.00 C ATOM 885 CG1 ILE A 57 112.248 -4.684 1.479 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.497 -3.074 2.239 1.00 0.00 C ATOM 887 CD1 ILE A 57 112.650 -3.804 0.293 1.00 0.00 C ATOM 0 H ILE A 57 114.227 -4.297 2.259 1.00 0.00 H new ATOM 0 HA ILE A 57 112.712 -1.896 2.375 1.00 0.00 H new ATOM 0 HB ILE A 57 111.589 -4.421 3.517 1.00 0.00 H new ATOM 0 HG12 ILE A 57 113.092 -5.299 1.790 1.00 0.00 H new ATOM 0 HG13 ILE A 57 111.449 -5.364 1.185 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.723 -3.804 2.004 1.00 0.00 H new ATOM 0 HG22 ILE A 57 110.164 -2.445 3.065 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.688 -2.452 1.364 1.00 0.00 H new ATOM 0 HD11 ILE A 57 112.979 -4.435 -0.533 1.00 0.00 H new ATOM 0 HD12 ILE A 57 111.794 -3.208 -0.024 1.00 0.00 H new ATOM 0 HD13 ILE A 57 113.463 -3.142 0.590 1.00 0.00 H new ATOM 899 N GLY A 58 113.332 -3.333 5.295 1.00 0.00 N ATOM 900 CA GLY A 58 113.346 -3.028 6.754 1.00 0.00 C ATOM 901 C GLY A 58 114.038 -1.675 6.944 1.00 0.00 C ATOM 902 O GLY A 58 113.573 -0.811 7.670 1.00 0.00 O ATOM 0 H GLY A 58 113.717 -4.240 5.032 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.330 -2.996 7.147 1.00 0.00 H new ATOM 0 HA3 GLY A 58 113.875 -3.808 7.302 1.00 0.00 H new ATOM 906 N PHE A 59 115.136 -1.476 6.265 1.00 0.00 N ATOM 907 CA PHE A 59 115.848 -0.176 6.371 1.00 0.00 C ATOM 908 C PHE A 59 114.851 0.924 6.026 1.00 0.00 C ATOM 909 O PHE A 59 114.794 1.953 6.667 1.00 0.00 O ATOM 910 CB PHE A 59 117.019 -0.159 5.379 1.00 0.00 C ATOM 911 CG PHE A 59 117.077 1.167 4.658 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.740 2.251 5.239 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.476 1.306 3.402 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.798 3.476 4.567 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.534 2.530 2.730 1.00 0.00 C ATOM 916 CZ PHE A 59 117.194 3.614 3.311 1.00 0.00 C ATOM 0 H PHE A 59 115.568 -2.159 5.643 1.00 0.00 H new ATOM 0 HA PHE A 59 116.242 -0.025 7.376 1.00 0.00 H new ATOM 0 HB2 PHE A 59 117.956 -0.334 5.909 1.00 0.00 H new ATOM 0 HB3 PHE A 59 116.905 -0.968 4.658 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.207 2.143 6.207 1.00 0.00 H new ATOM 0 HD2 PHE A 59 115.967 0.467 2.952 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.308 4.315 5.016 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.068 2.637 1.761 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.239 4.560 2.792 1.00 0.00 H new ATOM 926 N LEU A 60 114.046 0.693 5.028 1.00 0.00 N ATOM 927 CA LEU A 60 113.024 1.698 4.644 1.00 0.00 C ATOM 928 C LEU A 60 112.232 2.075 5.889 1.00 0.00 C ATOM 929 O LEU A 60 112.008 3.234 6.170 1.00 0.00 O ATOM 930 CB LEU A 60 112.086 1.078 3.606 1.00 0.00 C ATOM 931 CG LEU A 60 112.065 1.898 2.310 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.480 2.362 1.938 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.527 1.005 1.194 1.00 0.00 C ATOM 0 H LEU A 60 114.054 -0.154 4.460 1.00 0.00 H new ATOM 0 HA LEU A 60 113.496 2.585 4.221 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.405 0.059 3.388 1.00 0.00 H new ATOM 0 HB3 LEU A 60 111.078 1.016 4.016 1.00 0.00 H new ATOM 0 HG LEU A 60 111.437 2.778 2.448 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.442 2.942 1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.882 2.981 2.740 1.00 0.00 H new ATOM 0 HD13 LEU A 60 114.122 1.493 1.794 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.502 1.566 0.260 1.00 0.00 H new ATOM 0 HD22 LEU A 60 112.175 0.136 1.079 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.519 0.675 1.446 1.00 0.00 H new ATOM 945 N ARG A 61 111.814 1.103 6.649 1.00 0.00 N ATOM 946 CA ARG A 61 111.048 1.416 7.880 1.00 0.00 C ATOM 947 C ARG A 61 111.815 2.485 8.651 1.00 0.00 C ATOM 948 O ARG A 61 111.240 3.366 9.259 1.00 0.00 O ATOM 949 CB ARG A 61 110.917 0.156 8.740 1.00 0.00 C ATOM 950 CG ARG A 61 110.455 -1.013 7.867 1.00 0.00 C ATOM 951 CD ARG A 61 110.463 -2.301 8.693 1.00 0.00 C ATOM 952 NE ARG A 61 111.788 -2.457 9.356 1.00 0.00 N ATOM 953 CZ ARG A 61 111.959 -3.380 10.263 1.00 0.00 C ATOM 954 NH1 ARG A 61 110.970 -4.167 10.588 1.00 0.00 N ATOM 955 NH2 ARG A 61 113.119 -3.517 10.845 1.00 0.00 N ATOM 0 H ARG A 61 111.970 0.111 6.470 1.00 0.00 H new ATOM 0 HA ARG A 61 110.050 1.772 7.626 1.00 0.00 H new ATOM 0 HB2 ARG A 61 111.874 -0.080 9.206 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.203 0.326 9.546 1.00 0.00 H new ATOM 0 HG2 ARG A 61 109.453 -0.821 7.483 1.00 0.00 H new ATOM 0 HG3 ARG A 61 111.112 -1.118 7.004 1.00 0.00 H new ATOM 0 HD2 ARG A 61 109.671 -2.271 9.441 1.00 0.00 H new ATOM 0 HD3 ARG A 61 110.262 -3.159 8.051 1.00 0.00 H new ATOM 0 HE ARG A 61 112.561 -1.843 9.101 1.00 0.00 H new ATOM 0 HH11 ARG A 61 110.063 -4.061 10.133 1.00 0.00 H new ATOM 0 HH12 ARG A 61 111.104 -4.888 11.297 1.00 0.00 H new ATOM 0 HH21 ARG A 61 113.893 -2.903 10.591 1.00 0.00 H new ATOM 0 HH22 ARG A 61 113.252 -4.238 11.554 1.00 0.00 H new ATOM 969 N SER A 62 113.118 2.414 8.621 1.00 0.00 N ATOM 970 CA SER A 62 113.938 3.428 9.344 1.00 0.00 C ATOM 971 C SER A 62 114.716 4.294 8.339 1.00 0.00 C ATOM 972 O SER A 62 115.556 5.084 8.717 1.00 0.00 O ATOM 973 CB SER A 62 114.912 2.715 10.281 1.00 0.00 C ATOM 974 OG SER A 62 115.744 3.678 10.914 1.00 0.00 O ATOM 0 H SER A 62 113.650 1.698 8.127 1.00 0.00 H new ATOM 0 HA SER A 62 113.281 4.074 9.926 1.00 0.00 H new ATOM 0 HB2 SER A 62 114.363 2.144 11.029 1.00 0.00 H new ATOM 0 HB3 SER A 62 115.520 2.004 9.721 1.00 0.00 H new ATOM 0 HG SER A 62 116.369 3.224 11.517 1.00 0.00 H new ATOM 980 N SER A 63 114.458 4.143 7.062 1.00 0.00 N ATOM 981 CA SER A 63 115.196 4.951 6.041 1.00 0.00 C ATOM 982 C SER A 63 115.290 6.411 6.482 1.00 0.00 C ATOM 983 O SER A 63 114.793 6.792 7.520 1.00 0.00 O ATOM 984 CB SER A 63 114.469 4.888 4.697 1.00 0.00 C ATOM 985 OG SER A 63 113.086 4.656 4.917 1.00 0.00 O ATOM 0 H SER A 63 113.768 3.495 6.683 1.00 0.00 H new ATOM 0 HA SER A 63 116.199 4.537 5.939 1.00 0.00 H new ATOM 0 HB2 SER A 63 114.610 5.821 4.151 1.00 0.00 H new ATOM 0 HB3 SER A 63 114.889 4.092 4.081 1.00 0.00 H new ATOM 0 HG SER A 63 112.630 4.555 4.055 1.00 0.00 H new ATOM 991 N GLU A 64 115.922 7.233 5.688 1.00 0.00 N ATOM 992 CA GLU A 64 116.048 8.671 6.048 1.00 0.00 C ATOM 993 C GLU A 64 114.659 9.305 6.072 1.00 0.00 C ATOM 994 O GLU A 64 114.465 10.379 6.605 1.00 0.00 O ATOM 995 CB GLU A 64 116.920 9.386 5.013 1.00 0.00 C ATOM 996 CG GLU A 64 117.134 10.844 5.438 1.00 0.00 C ATOM 997 CD GLU A 64 118.632 11.122 5.587 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.386 10.671 4.740 1.00 0.00 O ATOM 999 OE2 GLU A 64 118.999 11.781 6.546 1.00 0.00 O ATOM 0 H GLU A 64 116.357 6.968 4.804 1.00 0.00 H new ATOM 0 HA GLU A 64 116.510 8.763 7.031 1.00 0.00 H new ATOM 0 HB2 GLU A 64 117.881 8.879 4.920 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.444 9.349 4.033 1.00 0.00 H new ATOM 0 HG2 GLU A 64 116.701 11.516 4.697 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.623 11.037 6.381 1.00 0.00 H new ATOM 1006 N GLU A 65 113.687 8.645 5.501 1.00 0.00 N ATOM 1007 CA GLU A 65 112.309 9.208 5.497 1.00 0.00 C ATOM 1008 C GLU A 65 112.002 9.773 6.884 1.00 0.00 C ATOM 1009 O GLU A 65 111.061 10.519 7.069 1.00 0.00 O ATOM 1010 CB GLU A 65 111.303 8.104 5.158 1.00 0.00 C ATOM 1011 CG GLU A 65 111.241 7.900 3.638 1.00 0.00 C ATOM 1012 CD GLU A 65 111.486 6.426 3.306 1.00 0.00 C ATOM 1013 OE1 GLU A 65 110.524 5.675 3.289 1.00 0.00 O ATOM 1014 OE2 GLU A 65 112.630 6.074 3.073 1.00 0.00 O ATOM 0 H GLU A 65 113.789 7.742 5.038 1.00 0.00 H new ATOM 0 HA GLU A 65 112.235 9.999 4.750 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.593 7.174 5.647 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.317 8.370 5.538 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.268 8.211 3.259 1.00 0.00 H new ATOM 0 HG3 GLU A 65 111.989 8.523 3.147 1.00 0.00 H new ATOM 1021 N LEU A 66 112.799 9.430 7.861 1.00 0.00 N ATOM 1022 CA LEU A 66 112.560 9.956 9.236 1.00 0.00 C ATOM 1023 C LEU A 66 112.365 11.469 9.151 1.00 0.00 C ATOM 1024 O LEU A 66 111.690 12.071 9.962 1.00 0.00 O ATOM 1025 CB LEU A 66 113.771 9.658 10.130 1.00 0.00 C ATOM 1026 CG LEU A 66 114.197 8.192 9.974 1.00 0.00 C ATOM 1027 CD1 LEU A 66 115.718 8.110 9.808 1.00 0.00 C ATOM 1028 CD2 LEU A 66 113.787 7.404 11.219 1.00 0.00 C ATOM 0 H LEU A 66 113.603 8.810 7.766 1.00 0.00 H new ATOM 0 HA LEU A 66 111.676 9.479 9.661 1.00 0.00 H new ATOM 0 HB2 LEU A 66 114.599 10.315 9.864 1.00 0.00 H new ATOM 0 HB3 LEU A 66 113.523 9.863 11.171 1.00 0.00 H new ATOM 0 HG LEU A 66 113.710 7.771 9.094 1.00 0.00 H new ATOM 0 HD11 LEU A 66 116.016 7.067 9.698 1.00 0.00 H new ATOM 0 HD12 LEU A 66 116.018 8.669 8.922 1.00 0.00 H new ATOM 0 HD13 LEU A 66 116.203 8.535 10.687 1.00 0.00 H new ATOM 0 HD21 LEU A 66 114.090 6.363 11.107 1.00 0.00 H new ATOM 0 HD22 LEU A 66 114.273 7.831 12.096 1.00 0.00 H new ATOM 0 HD23 LEU A 66 112.705 7.456 11.342 1.00 0.00 H new ATOM 1040 N LYS A 67 112.961 12.083 8.168 1.00 0.00 N ATOM 1041 CA LYS A 67 112.830 13.558 8.007 1.00 0.00 C ATOM 1042 C LYS A 67 111.448 13.897 7.443 1.00 0.00 C ATOM 1043 O LYS A 67 110.769 14.763 7.953 1.00 0.00 O ATOM 1044 CB LYS A 67 113.908 14.056 7.046 1.00 0.00 C ATOM 1045 CG LYS A 67 114.072 13.053 5.899 1.00 0.00 C ATOM 1046 CD LYS A 67 113.819 13.751 4.567 1.00 0.00 C ATOM 1047 CE LYS A 67 113.639 12.698 3.474 1.00 0.00 C ATOM 1048 NZ LYS A 67 114.891 11.899 3.340 1.00 0.00 N ATOM 0 H LYS A 67 113.538 11.623 7.464 1.00 0.00 H new ATOM 0 HA LYS A 67 112.949 14.041 8.977 1.00 0.00 H new ATOM 0 HB2 LYS A 67 113.635 15.035 6.651 1.00 0.00 H new ATOM 0 HB3 LYS A 67 114.853 14.178 7.575 1.00 0.00 H new ATOM 0 HG2 LYS A 67 115.076 12.630 5.914 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.375 12.225 6.025 1.00 0.00 H new ATOM 0 HD2 LYS A 67 112.930 14.378 4.634 1.00 0.00 H new ATOM 0 HD3 LYS A 67 114.654 14.407 4.322 1.00 0.00 H new ATOM 0 HE2 LYS A 67 112.802 12.044 3.719 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.400 13.180 2.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 114.923 11.460 2.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 115.715 12.522 3.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 114.909 11.157 4.069 1.00 0.00 H new ATOM 1062 N VAL A 68 111.030 13.226 6.395 1.00 0.00 N ATOM 1063 CA VAL A 68 109.689 13.511 5.802 1.00 0.00 C ATOM 1064 C VAL A 68 109.800 14.683 4.820 1.00 0.00 C ATOM 1065 O VAL A 68 108.989 15.583 4.844 1.00 0.00 O ATOM 1066 CB VAL A 68 108.704 13.872 6.930 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.264 13.825 6.417 1.00 0.00 C ATOM 1068 CG2 VAL A 68 108.859 12.876 8.086 1.00 0.00 C ATOM 0 H VAL A 68 111.562 12.493 5.926 1.00 0.00 H new ATOM 0 HA VAL A 68 109.329 12.631 5.270 1.00 0.00 H new ATOM 0 HB VAL A 68 108.926 14.881 7.277 1.00 0.00 H new ATOM 0 HG11 VAL A 68 106.581 14.083 7.226 1.00 0.00 H new ATOM 0 HG12 VAL A 68 107.145 14.538 5.601 1.00 0.00 H new ATOM 0 HG13 VAL A 68 107.038 12.821 6.057 1.00 0.00 H new ATOM 0 HG21 VAL A 68 108.162 13.133 8.883 1.00 0.00 H new ATOM 0 HG22 VAL A 68 108.647 11.868 7.729 1.00 0.00 H new ATOM 0 HG23 VAL A 68 109.879 12.918 8.468 1.00 0.00 H new ATOM 1078 N PHE A 69 110.790 14.685 3.949 1.00 0.00 N ATOM 1079 CA PHE A 69 110.917 15.825 2.987 1.00 0.00 C ATOM 1080 C PHE A 69 112.011 15.581 1.934 1.00 0.00 C ATOM 1081 O PHE A 69 111.736 15.546 0.751 1.00 0.00 O ATOM 1082 CB PHE A 69 111.267 17.103 3.754 1.00 0.00 C ATOM 1083 CG PHE A 69 110.064 17.596 4.520 1.00 0.00 C ATOM 1084 CD1 PHE A 69 108.996 18.196 3.842 1.00 0.00 C ATOM 1085 CD2 PHE A 69 110.018 17.453 5.912 1.00 0.00 C ATOM 1086 CE1 PHE A 69 107.882 18.651 4.557 1.00 0.00 C ATOM 1087 CE2 PHE A 69 108.905 17.909 6.626 1.00 0.00 C ATOM 1088 CZ PHE A 69 107.836 18.508 5.949 1.00 0.00 C ATOM 0 H PHE A 69 111.501 13.959 3.866 1.00 0.00 H new ATOM 0 HA PHE A 69 109.960 15.921 2.474 1.00 0.00 H new ATOM 0 HB2 PHE A 69 112.091 16.910 4.441 1.00 0.00 H new ATOM 0 HB3 PHE A 69 111.605 17.872 3.059 1.00 0.00 H new ATOM 0 HD1 PHE A 69 109.032 18.308 2.768 1.00 0.00 H new ATOM 0 HD2 PHE A 69 110.842 16.990 6.435 1.00 0.00 H new ATOM 0 HE1 PHE A 69 107.057 19.113 4.034 1.00 0.00 H new ATOM 0 HE2 PHE A 69 108.870 17.799 7.700 1.00 0.00 H new ATOM 0 HZ PHE A 69 106.976 18.860 6.500 1.00 0.00 H new ATOM 1098 N ASP A 70 113.251 15.462 2.337 1.00 0.00 N ATOM 1099 CA ASP A 70 114.343 15.281 1.329 1.00 0.00 C ATOM 1100 C ASP A 70 113.961 14.204 0.316 1.00 0.00 C ATOM 1101 O ASP A 70 114.314 13.045 0.446 1.00 0.00 O ATOM 1102 CB ASP A 70 115.652 14.891 2.022 1.00 0.00 C ATOM 1103 CG ASP A 70 116.007 15.942 3.075 1.00 0.00 C ATOM 1104 OD1 ASP A 70 115.131 16.711 3.435 1.00 0.00 O ATOM 1105 OD2 ASP A 70 117.149 15.961 3.504 1.00 0.00 O ATOM 0 H ASP A 70 113.554 15.482 3.311 1.00 0.00 H new ATOM 0 HA ASP A 70 114.484 16.228 0.807 1.00 0.00 H new ATOM 0 HB2 ASP A 70 115.550 13.912 2.490 1.00 0.00 H new ATOM 0 HB3 ASP A 70 116.454 14.811 1.288 1.00 0.00 H new ATOM 1110 N THR A 71 113.254 14.592 -0.707 1.00 0.00 N ATOM 1111 CA THR A 71 112.852 13.620 -1.755 1.00 0.00 C ATOM 1112 C THR A 71 114.110 13.045 -2.403 1.00 0.00 C ATOM 1113 O THR A 71 114.170 11.882 -2.748 1.00 0.00 O ATOM 1114 CB THR A 71 112.019 14.336 -2.820 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.762 14.409 -4.028 1.00 0.00 O ATOM 1116 CG2 THR A 71 111.681 15.752 -2.346 1.00 0.00 C ATOM 0 H THR A 71 112.936 15.549 -0.862 1.00 0.00 H new ATOM 0 HA THR A 71 112.262 12.819 -1.310 1.00 0.00 H new ATOM 0 HB THR A 71 111.096 13.782 -2.989 1.00 0.00 H new ATOM 0 HG1 THR A 71 113.025 15.338 -4.195 1.00 0.00 H new ATOM 0 HG21 THR A 71 111.088 16.259 -3.107 1.00 0.00 H new ATOM 0 HG22 THR A 71 111.112 15.699 -1.418 1.00 0.00 H new ATOM 0 HG23 THR A 71 112.603 16.308 -2.175 1.00 0.00 H new ATOM 1124 N ALA A 72 115.118 13.856 -2.566 1.00 0.00 N ATOM 1125 CA ALA A 72 116.376 13.362 -3.186 1.00 0.00 C ATOM 1126 C ALA A 72 116.889 12.171 -2.379 1.00 0.00 C ATOM 1127 O ALA A 72 117.378 11.205 -2.926 1.00 0.00 O ATOM 1128 CB ALA A 72 117.424 14.476 -3.179 1.00 0.00 C ATOM 0 H ALA A 72 115.124 14.840 -2.296 1.00 0.00 H new ATOM 0 HA ALA A 72 116.186 13.058 -4.215 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.345 14.112 -3.634 1.00 0.00 H new ATOM 0 HB2 ALA A 72 117.052 15.329 -3.746 1.00 0.00 H new ATOM 0 HB3 ALA A 72 117.623 14.782 -2.152 1.00 0.00 H new ATOM 1134 N GLU A 73 116.773 12.236 -1.080 1.00 0.00 N ATOM 1135 CA GLU A 73 117.247 11.110 -0.228 1.00 0.00 C ATOM 1136 C GLU A 73 116.436 9.850 -0.547 1.00 0.00 C ATOM 1137 O GLU A 73 116.965 8.754 -0.613 1.00 0.00 O ATOM 1138 CB GLU A 73 117.057 11.476 1.245 1.00 0.00 C ATOM 1139 CG GLU A 73 118.281 12.246 1.743 1.00 0.00 C ATOM 1140 CD GLU A 73 119.498 11.319 1.754 1.00 0.00 C ATOM 1141 OE1 GLU A 73 119.321 10.144 2.028 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.587 11.800 1.487 1.00 0.00 O ATOM 0 H GLU A 73 116.369 13.023 -0.572 1.00 0.00 H new ATOM 0 HA GLU A 73 118.302 10.922 -0.426 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.159 12.082 1.367 1.00 0.00 H new ATOM 0 HB3 GLU A 73 116.916 10.573 1.839 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.470 13.105 1.099 1.00 0.00 H new ATOM 0 HG3 GLU A 73 118.097 12.634 2.745 1.00 0.00 H new ATOM 1149 N VAL A 74 115.154 9.997 -0.748 1.00 0.00 N ATOM 1150 CA VAL A 74 114.313 8.809 -1.059 1.00 0.00 C ATOM 1151 C VAL A 74 114.784 8.197 -2.380 1.00 0.00 C ATOM 1152 O VAL A 74 115.295 7.090 -2.422 1.00 0.00 O ATOM 1153 CB VAL A 74 112.851 9.247 -1.175 1.00 0.00 C ATOM 1154 CG1 VAL A 74 111.936 8.022 -1.104 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.509 10.202 -0.026 1.00 0.00 C ATOM 0 H VAL A 74 114.655 10.886 -0.710 1.00 0.00 H new ATOM 0 HA VAL A 74 114.402 8.066 -0.266 1.00 0.00 H new ATOM 0 HB VAL A 74 112.704 9.754 -2.129 1.00 0.00 H new ATOM 0 HG11 VAL A 74 110.896 8.339 -1.187 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.174 7.342 -1.922 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.085 7.511 -0.153 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.468 10.513 -0.109 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.661 9.694 0.927 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.155 11.078 -0.077 1.00 0.00 H new ATOM 1165 N ILE A 75 114.642 8.912 -3.460 1.00 0.00 N ATOM 1166 CA ILE A 75 115.111 8.368 -4.758 1.00 0.00 C ATOM 1167 C ILE A 75 116.562 7.933 -4.586 1.00 0.00 C ATOM 1168 O ILE A 75 117.055 7.079 -5.288 1.00 0.00 O ATOM 1169 CB ILE A 75 115.020 9.441 -5.847 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.652 10.745 -5.342 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.551 9.688 -6.205 1.00 0.00 C ATOM 1172 CD1 ILE A 75 117.107 10.824 -5.810 1.00 0.00 C ATOM 0 H ILE A 75 114.225 9.842 -3.498 1.00 0.00 H new ATOM 0 HA ILE A 75 114.489 7.524 -5.057 1.00 0.00 H new ATOM 0 HB ILE A 75 115.556 9.100 -6.733 1.00 0.00 H new ATOM 0 HG12 ILE A 75 115.092 11.602 -5.717 1.00 0.00 H new ATOM 0 HG13 ILE A 75 115.607 10.786 -4.254 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.489 10.452 -6.980 1.00 0.00 H new ATOM 0 HG22 ILE A 75 113.105 8.763 -6.571 1.00 0.00 H new ATOM 0 HG23 ILE A 75 113.012 10.025 -5.319 1.00 0.00 H new ATOM 0 HD11 ILE A 75 117.555 11.751 -5.451 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.663 9.975 -5.414 1.00 0.00 H new ATOM 0 HD13 ILE A 75 117.140 10.803 -6.899 1.00 0.00 H new ATOM 1184 N GLU A 76 117.249 8.513 -3.644 1.00 0.00 N ATOM 1185 CA GLU A 76 118.668 8.128 -3.418 1.00 0.00 C ATOM 1186 C GLU A 76 118.739 6.627 -3.169 1.00 0.00 C ATOM 1187 O GLU A 76 119.633 5.954 -3.642 1.00 0.00 O ATOM 1188 CB GLU A 76 119.226 8.872 -2.205 1.00 0.00 C ATOM 1189 CG GLU A 76 120.722 9.127 -2.403 1.00 0.00 C ATOM 1190 CD GLU A 76 121.274 9.891 -1.198 1.00 0.00 C ATOM 1191 OE1 GLU A 76 120.743 9.712 -0.114 1.00 0.00 O ATOM 1192 OE2 GLU A 76 122.217 10.642 -1.380 1.00 0.00 O ATOM 0 H GLU A 76 116.890 9.236 -3.021 1.00 0.00 H new ATOM 0 HA GLU A 76 119.259 8.389 -4.296 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.700 9.817 -2.072 1.00 0.00 H new ATOM 0 HB3 GLU A 76 119.063 8.287 -1.300 1.00 0.00 H new ATOM 0 HG2 GLU A 76 121.250 8.181 -2.520 1.00 0.00 H new ATOM 0 HG3 GLU A 76 120.886 9.699 -3.316 1.00 0.00 H new ATOM 1199 N PHE A 77 117.805 6.084 -2.434 1.00 0.00 N ATOM 1200 CA PHE A 77 117.852 4.621 -2.185 1.00 0.00 C ATOM 1201 C PHE A 77 117.343 3.882 -3.427 1.00 0.00 C ATOM 1202 O PHE A 77 118.061 3.101 -4.016 1.00 0.00 O ATOM 1203 CB PHE A 77 116.996 4.273 -0.964 1.00 0.00 C ATOM 1204 CG PHE A 77 115.706 3.625 -1.402 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.681 2.265 -1.729 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.536 4.386 -1.477 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.483 1.667 -2.130 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.339 3.789 -1.880 1.00 0.00 C ATOM 1209 CZ PHE A 77 113.311 2.429 -2.205 1.00 0.00 C ATOM 0 H PHE A 77 117.026 6.583 -2.004 1.00 0.00 H new ATOM 0 HA PHE A 77 118.878 4.314 -1.984 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.545 3.600 -0.306 1.00 0.00 H new ATOM 0 HB3 PHE A 77 116.782 5.175 -0.391 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.586 1.678 -1.672 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.557 5.436 -1.223 1.00 0.00 H new ATOM 0 HE1 PHE A 77 114.461 0.617 -2.382 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.435 4.378 -1.941 1.00 0.00 H new ATOM 0 HZ PHE A 77 112.385 1.967 -2.514 1.00 0.00 H new ATOM 1219 N PHE A 78 116.119 4.113 -3.846 1.00 0.00 N ATOM 1220 CA PHE A 78 115.627 3.391 -5.056 1.00 0.00 C ATOM 1221 C PHE A 78 116.519 3.709 -6.260 1.00 0.00 C ATOM 1222 O PHE A 78 116.998 2.821 -6.933 1.00 0.00 O ATOM 1223 CB PHE A 78 114.191 3.799 -5.375 1.00 0.00 C ATOM 1224 CG PHE A 78 113.633 2.847 -6.413 1.00 0.00 C ATOM 1225 CD1 PHE A 78 113.629 1.463 -6.175 1.00 0.00 C ATOM 1226 CD2 PHE A 78 113.127 3.345 -7.620 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.118 0.587 -7.139 1.00 0.00 C ATOM 1228 CE2 PHE A 78 112.618 2.465 -8.583 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.614 1.088 -8.343 1.00 0.00 C ATOM 0 H PHE A 78 115.456 4.755 -3.412 1.00 0.00 H new ATOM 0 HA PHE A 78 115.659 2.321 -4.850 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.581 3.772 -4.472 1.00 0.00 H new ATOM 0 HB3 PHE A 78 114.163 4.823 -5.748 1.00 0.00 H new ATOM 0 HD1 PHE A 78 114.021 1.074 -5.247 1.00 0.00 H new ATOM 0 HD2 PHE A 78 113.129 4.408 -7.808 1.00 0.00 H new ATOM 0 HE1 PHE A 78 113.113 -0.477 -6.953 1.00 0.00 H new ATOM 0 HE2 PHE A 78 112.228 2.851 -9.513 1.00 0.00 H new ATOM 0 HZ PHE A 78 112.222 0.411 -9.088 1.00 0.00 H new ATOM 1239 N ASN A 79 116.743 4.964 -6.547 1.00 0.00 N ATOM 1240 CA ASN A 79 117.600 5.307 -7.719 1.00 0.00 C ATOM 1241 C ASN A 79 118.903 4.522 -7.628 1.00 0.00 C ATOM 1242 O ASN A 79 119.450 4.091 -8.623 1.00 0.00 O ATOM 1243 CB ASN A 79 117.907 6.810 -7.731 1.00 0.00 C ATOM 1244 CG ASN A 79 119.032 7.118 -6.741 1.00 0.00 C ATOM 1245 OD1 ASN A 79 119.163 6.463 -5.729 1.00 0.00 O ATOM 1246 ND2 ASN A 79 119.856 8.098 -6.995 1.00 0.00 N ATOM 0 H ASN A 79 116.374 5.759 -6.026 1.00 0.00 H new ATOM 0 HA ASN A 79 117.073 5.050 -8.638 1.00 0.00 H new ATOM 0 HB2 ASN A 79 118.197 7.123 -8.734 1.00 0.00 H new ATOM 0 HB3 ASN A 79 117.013 7.375 -7.467 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.610 8.313 -6.342 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.746 8.649 -7.846 1.00 0.00 H new ATOM 1253 N LYS A 80 119.398 4.313 -6.442 1.00 0.00 N ATOM 1254 CA LYS A 80 120.652 3.534 -6.302 1.00 0.00 C ATOM 1255 C LYS A 80 120.316 2.057 -6.486 1.00 0.00 C ATOM 1256 O LYS A 80 121.103 1.287 -6.999 1.00 0.00 O ATOM 1257 CB LYS A 80 121.254 3.762 -4.914 1.00 0.00 C ATOM 1258 CG LYS A 80 122.162 4.996 -4.947 1.00 0.00 C ATOM 1259 CD LYS A 80 123.532 4.624 -5.525 1.00 0.00 C ATOM 1260 CE LYS A 80 124.191 3.558 -4.648 1.00 0.00 C ATOM 1261 NZ LYS A 80 125.646 3.854 -4.515 1.00 0.00 N ATOM 0 H LYS A 80 118.989 4.647 -5.569 1.00 0.00 H new ATOM 0 HA LYS A 80 121.379 3.851 -7.050 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.460 3.901 -4.180 1.00 0.00 H new ATOM 0 HB3 LYS A 80 121.824 2.886 -4.605 1.00 0.00 H new ATOM 0 HG2 LYS A 80 121.704 5.779 -5.551 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.280 5.398 -3.941 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.419 4.252 -6.543 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.167 5.508 -5.578 1.00 0.00 H new ATOM 0 HE2 LYS A 80 123.721 3.540 -3.665 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.048 2.571 -5.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.095 3.129 -3.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.088 3.850 -5.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 125.771 4.789 -4.077 1.00 0.00 H new ATOM 1275 N LEU A 81 119.140 1.658 -6.080 1.00 0.00 N ATOM 1276 CA LEU A 81 118.743 0.233 -6.242 1.00 0.00 C ATOM 1277 C LEU A 81 118.555 -0.073 -7.736 1.00 0.00 C ATOM 1278 O LEU A 81 119.150 -0.981 -8.271 1.00 0.00 O ATOM 1279 CB LEU A 81 117.420 -0.027 -5.495 1.00 0.00 C ATOM 1280 CG LEU A 81 117.567 0.232 -3.985 1.00 0.00 C ATOM 1281 CD1 LEU A 81 116.714 -0.782 -3.221 1.00 0.00 C ATOM 1282 CD2 LEU A 81 119.030 0.099 -3.538 1.00 0.00 C ATOM 0 H LEU A 81 118.440 2.258 -5.644 1.00 0.00 H new ATOM 0 HA LEU A 81 119.521 -0.410 -5.829 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.639 0.615 -5.901 1.00 0.00 H new ATOM 0 HB3 LEU A 81 117.104 -1.057 -5.660 1.00 0.00 H new ATOM 0 HG LEU A 81 117.235 1.249 -3.774 1.00 0.00 H new ATOM 0 HD11 LEU A 81 116.812 -0.606 -2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.670 -0.672 -3.513 1.00 0.00 H new ATOM 0 HD13 LEU A 81 117.052 -1.792 -3.455 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.102 0.288 -2.467 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.386 -0.908 -3.754 1.00 0.00 H new ATOM 0 HD23 LEU A 81 119.642 0.823 -4.076 1.00 0.00 H new ATOM 1294 N VAL A 82 117.733 0.675 -8.416 1.00 0.00 N ATOM 1295 CA VAL A 82 117.511 0.407 -9.868 1.00 0.00 C ATOM 1296 C VAL A 82 118.825 0.513 -10.646 1.00 0.00 C ATOM 1297 O VAL A 82 119.181 -0.365 -11.400 1.00 0.00 O ATOM 1298 CB VAL A 82 116.530 1.433 -10.429 1.00 0.00 C ATOM 1299 CG1 VAL A 82 115.100 0.968 -10.167 1.00 0.00 C ATOM 1300 CG2 VAL A 82 116.765 2.787 -9.753 1.00 0.00 C ATOM 0 H VAL A 82 117.205 1.459 -8.033 1.00 0.00 H new ATOM 0 HA VAL A 82 117.112 -0.602 -9.974 1.00 0.00 H new ATOM 0 HB VAL A 82 116.684 1.535 -11.503 1.00 0.00 H new ATOM 0 HG11 VAL A 82 114.400 1.701 -10.568 1.00 0.00 H new ATOM 0 HG12 VAL A 82 114.936 0.006 -10.652 1.00 0.00 H new ATOM 0 HG13 VAL A 82 114.942 0.865 -9.093 1.00 0.00 H new ATOM 0 HG21 VAL A 82 116.065 3.520 -10.153 1.00 0.00 H new ATOM 0 HG22 VAL A 82 116.612 2.688 -8.678 1.00 0.00 H new ATOM 0 HG23 VAL A 82 117.786 3.118 -9.946 1.00 0.00 H new ATOM 1310 N THR A 83 119.534 1.590 -10.499 1.00 0.00 N ATOM 1311 CA THR A 83 120.805 1.746 -11.268 1.00 0.00 C ATOM 1312 C THR A 83 121.901 0.809 -10.733 1.00 0.00 C ATOM 1313 O THR A 83 122.595 0.164 -11.494 1.00 0.00 O ATOM 1314 CB THR A 83 121.277 3.198 -11.174 1.00 0.00 C ATOM 1315 OG1 THR A 83 122.062 3.513 -12.316 1.00 0.00 O ATOM 1316 CG2 THR A 83 122.114 3.387 -9.913 1.00 0.00 C ATOM 0 H THR A 83 119.296 2.369 -9.885 1.00 0.00 H new ATOM 0 HA THR A 83 120.613 1.481 -12.308 1.00 0.00 H new ATOM 0 HB THR A 83 120.411 3.858 -11.132 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.364 4.444 -12.259 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.448 4.423 -9.850 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.512 3.146 -9.037 1.00 0.00 H new ATOM 0 HG23 THR A 83 122.981 2.728 -9.950 1.00 0.00 H new ATOM 1324 N SER A 84 122.090 0.752 -9.443 1.00 0.00 N ATOM 1325 CA SER A 84 123.172 -0.116 -8.882 1.00 0.00 C ATOM 1326 C SER A 84 122.771 -1.599 -8.866 1.00 0.00 C ATOM 1327 O SER A 84 123.585 -2.467 -9.112 1.00 0.00 O ATOM 1328 CB SER A 84 123.481 0.331 -7.453 1.00 0.00 C ATOM 1329 OG SER A 84 123.301 1.737 -7.351 1.00 0.00 O ATOM 0 H SER A 84 121.545 1.267 -8.752 1.00 0.00 H new ATOM 0 HA SER A 84 124.049 -0.012 -9.521 1.00 0.00 H new ATOM 0 HB2 SER A 84 122.826 -0.183 -6.749 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.504 0.064 -7.189 1.00 0.00 H new ATOM 0 HG SER A 84 122.345 1.948 -7.390 1.00 0.00 H new ATOM 1335 N PHE A 85 121.546 -1.905 -8.542 1.00 0.00 N ATOM 1336 CA PHE A 85 121.127 -3.340 -8.469 1.00 0.00 C ATOM 1337 C PHE A 85 121.499 -4.108 -9.745 1.00 0.00 C ATOM 1338 O PHE A 85 121.134 -5.253 -9.905 1.00 0.00 O ATOM 1339 CB PHE A 85 119.618 -3.440 -8.216 1.00 0.00 C ATOM 1340 CG PHE A 85 118.844 -3.330 -9.512 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.396 -2.698 -10.635 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.570 -3.895 -9.591 1.00 0.00 C ATOM 1343 CE1 PHE A 85 118.672 -2.639 -11.831 1.00 0.00 C ATOM 1344 CE2 PHE A 85 116.844 -3.830 -10.785 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.397 -3.204 -11.906 1.00 0.00 C ATOM 0 H PHE A 85 120.815 -1.228 -8.324 1.00 0.00 H new ATOM 0 HA PHE A 85 121.664 -3.797 -7.638 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.389 -4.389 -7.730 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.307 -2.649 -7.534 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.380 -2.257 -10.577 1.00 0.00 H new ATOM 0 HD2 PHE A 85 117.143 -4.384 -8.728 1.00 0.00 H new ATOM 0 HE1 PHE A 85 119.100 -2.156 -12.697 1.00 0.00 H new ATOM 0 HE2 PHE A 85 115.856 -4.263 -10.841 1.00 0.00 H new ATOM 0 HZ PHE A 85 116.839 -3.157 -12.829 1.00 0.00 H new ATOM 1355 N ASP A 86 122.207 -3.510 -10.664 1.00 0.00 N ATOM 1356 CA ASP A 86 122.563 -4.266 -11.899 1.00 0.00 C ATOM 1357 C ASP A 86 123.903 -4.976 -11.701 1.00 0.00 C ATOM 1358 O ASP A 86 124.424 -5.606 -12.600 1.00 0.00 O ATOM 1359 CB ASP A 86 122.635 -3.327 -13.100 1.00 0.00 C ATOM 1360 CG ASP A 86 123.500 -2.113 -12.756 1.00 0.00 C ATOM 1361 OD1 ASP A 86 123.696 -1.865 -11.577 1.00 0.00 O ATOM 1362 OD2 ASP A 86 123.951 -1.451 -13.676 1.00 0.00 O ATOM 0 H ASP A 86 122.549 -2.550 -10.617 1.00 0.00 H new ATOM 0 HA ASP A 86 121.790 -5.009 -12.092 1.00 0.00 H new ATOM 0 HB2 ASP A 86 123.053 -3.852 -13.959 1.00 0.00 H new ATOM 0 HB3 ASP A 86 121.633 -3.003 -13.381 1.00 0.00 H new ATOM 1367 N PHE A 87 124.446 -4.908 -10.518 1.00 0.00 N ATOM 1368 CA PHE A 87 125.730 -5.610 -10.238 1.00 0.00 C ATOM 1369 C PHE A 87 125.528 -6.466 -8.988 1.00 0.00 C ATOM 1370 O PHE A 87 125.325 -7.661 -9.067 1.00 0.00 O ATOM 1371 CB PHE A 87 126.862 -4.586 -10.014 1.00 0.00 C ATOM 1372 CG PHE A 87 127.690 -4.969 -8.800 1.00 0.00 C ATOM 1373 CD1 PHE A 87 128.041 -6.308 -8.574 1.00 0.00 C ATOM 1374 CD2 PHE A 87 128.088 -3.985 -7.884 1.00 0.00 C ATOM 1375 CE1 PHE A 87 128.777 -6.653 -7.443 1.00 0.00 C ATOM 1376 CE2 PHE A 87 128.835 -4.338 -6.755 1.00 0.00 C ATOM 1377 CZ PHE A 87 129.176 -5.674 -6.536 1.00 0.00 C ATOM 0 H PHE A 87 124.054 -4.394 -9.729 1.00 0.00 H new ATOM 0 HA PHE A 87 126.014 -6.237 -11.083 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.499 -4.540 -10.897 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.439 -3.591 -9.874 1.00 0.00 H new ATOM 0 HD1 PHE A 87 127.741 -7.071 -9.277 1.00 0.00 H new ATOM 0 HD2 PHE A 87 127.817 -2.953 -8.050 1.00 0.00 H new ATOM 0 HE1 PHE A 87 129.040 -7.686 -7.268 1.00 0.00 H new ATOM 0 HE2 PHE A 87 129.147 -3.578 -6.054 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.749 -5.949 -5.663 1.00 0.00 H new ATOM 1387 N ASP A 88 125.574 -5.861 -7.836 1.00 0.00 N ATOM 1388 CA ASP A 88 125.376 -6.627 -6.581 1.00 0.00 C ATOM 1389 C ASP A 88 123.913 -6.540 -6.180 1.00 0.00 C ATOM 1390 O ASP A 88 123.521 -5.689 -5.411 1.00 0.00 O ATOM 1391 CB ASP A 88 126.223 -6.022 -5.469 1.00 0.00 C ATOM 1392 CG ASP A 88 126.318 -4.509 -5.669 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.581 -3.991 -6.491 1.00 0.00 O ATOM 1394 OD2 ASP A 88 127.122 -3.892 -4.994 1.00 0.00 O ATOM 0 H ASP A 88 125.741 -4.863 -7.711 1.00 0.00 H new ATOM 0 HA ASP A 88 125.668 -7.665 -6.739 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.781 -6.245 -4.498 1.00 0.00 H new ATOM 0 HB3 ASP A 88 127.219 -6.464 -5.474 1.00 0.00 H new ATOM 1399 N LEU A 89 123.101 -7.406 -6.687 1.00 0.00 N ATOM 1400 CA LEU A 89 121.673 -7.358 -6.323 1.00 0.00 C ATOM 1401 C LEU A 89 121.560 -7.474 -4.808 1.00 0.00 C ATOM 1402 O LEU A 89 121.124 -6.569 -4.131 1.00 0.00 O ATOM 1403 CB LEU A 89 120.935 -8.524 -6.983 1.00 0.00 C ATOM 1404 CG LEU A 89 121.411 -8.726 -8.433 1.00 0.00 C ATOM 1405 CD1 LEU A 89 122.046 -7.451 -8.999 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.436 -9.854 -8.486 1.00 0.00 C ATOM 0 H LEU A 89 123.364 -8.146 -7.338 1.00 0.00 H new ATOM 0 HA LEU A 89 121.230 -6.422 -6.663 1.00 0.00 H new ATOM 0 HB2 LEU A 89 121.103 -9.436 -6.411 1.00 0.00 H new ATOM 0 HB3 LEU A 89 119.862 -8.333 -6.972 1.00 0.00 H new ATOM 0 HG LEU A 89 120.539 -8.977 -9.037 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.370 -7.630 -10.024 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.314 -6.643 -8.986 1.00 0.00 H new ATOM 0 HD13 LEU A 89 122.906 -7.171 -8.390 1.00 0.00 H new ATOM 0 HD21 LEU A 89 122.770 -9.994 -9.514 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.290 -9.600 -7.858 1.00 0.00 H new ATOM 0 HD23 LEU A 89 121.981 -10.776 -8.124 1.00 0.00 H new ATOM 1418 N GLU A 90 121.955 -8.586 -4.273 1.00 0.00 N ATOM 1419 CA GLU A 90 121.861 -8.777 -2.800 1.00 0.00 C ATOM 1420 C GLU A 90 122.797 -7.819 -2.061 1.00 0.00 C ATOM 1421 O GLU A 90 122.425 -7.214 -1.074 1.00 0.00 O ATOM 1422 CB GLU A 90 122.242 -10.218 -2.452 1.00 0.00 C ATOM 1423 CG GLU A 90 122.263 -11.055 -3.726 1.00 0.00 C ATOM 1424 CD GLU A 90 123.588 -10.838 -4.460 1.00 0.00 C ATOM 1425 OE1 GLU A 90 124.621 -11.098 -3.867 1.00 0.00 O ATOM 1426 OE2 GLU A 90 123.546 -10.415 -5.604 1.00 0.00 O ATOM 0 H GLU A 90 122.341 -9.376 -4.790 1.00 0.00 H new ATOM 0 HA GLU A 90 120.837 -8.570 -2.490 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.220 -10.242 -1.971 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.527 -10.634 -1.742 1.00 0.00 H new ATOM 0 HG2 GLU A 90 122.139 -12.110 -3.482 1.00 0.00 H new ATOM 0 HG3 GLU A 90 121.429 -10.777 -4.370 1.00 0.00 H new ATOM 1433 N ILE A 91 124.014 -7.697 -2.503 1.00 0.00 N ATOM 1434 CA ILE A 91 124.968 -6.806 -1.788 1.00 0.00 C ATOM 1435 C ILE A 91 124.732 -5.340 -2.164 1.00 0.00 C ATOM 1436 O ILE A 91 125.020 -4.441 -1.397 1.00 0.00 O ATOM 1437 CB ILE A 91 126.403 -7.204 -2.153 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.400 -8.622 -2.729 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.296 -7.161 -0.912 1.00 0.00 C ATOM 1440 CD1 ILE A 91 127.822 -9.177 -2.732 1.00 0.00 C ATOM 0 H ILE A 91 124.390 -8.172 -3.324 1.00 0.00 H new ATOM 0 HA ILE A 91 124.811 -6.916 -0.715 1.00 0.00 H new ATOM 0 HB ILE A 91 126.792 -6.503 -2.892 1.00 0.00 H new ATOM 0 HG12 ILE A 91 125.749 -9.265 -2.136 1.00 0.00 H new ATOM 0 HG13 ILE A 91 126.000 -8.613 -3.743 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.312 -7.446 -1.185 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.300 -6.151 -0.501 1.00 0.00 H new ATOM 0 HG23 ILE A 91 126.913 -7.855 -0.164 1.00 0.00 H new ATOM 0 HD11 ILE A 91 127.818 -10.187 -3.142 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.460 -8.539 -3.344 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.205 -9.202 -1.712 1.00 0.00 H new ATOM 1452 N GLY A 92 124.230 -5.086 -3.337 1.00 0.00 N ATOM 1453 CA GLY A 92 124.002 -3.671 -3.757 1.00 0.00 C ATOM 1454 C GLY A 92 123.038 -2.976 -2.793 1.00 0.00 C ATOM 1455 O GLY A 92 123.332 -1.926 -2.257 1.00 0.00 O ATOM 0 H GLY A 92 123.967 -5.792 -4.024 1.00 0.00 H new ATOM 0 HA2 GLY A 92 124.951 -3.135 -3.782 1.00 0.00 H new ATOM 0 HA3 GLY A 92 123.596 -3.646 -4.768 1.00 0.00 H new ATOM 1459 N LYS A 93 121.887 -3.545 -2.576 1.00 0.00 N ATOM 1460 CA LYS A 93 120.897 -2.911 -1.657 1.00 0.00 C ATOM 1461 C LYS A 93 121.291 -3.155 -0.196 1.00 0.00 C ATOM 1462 O LYS A 93 120.801 -2.500 0.704 1.00 0.00 O ATOM 1463 CB LYS A 93 119.504 -3.500 -1.911 1.00 0.00 C ATOM 1464 CG LYS A 93 119.619 -4.898 -2.535 1.00 0.00 C ATOM 1465 CD LYS A 93 119.318 -4.825 -4.036 1.00 0.00 C ATOM 1466 CE LYS A 93 118.843 -6.193 -4.528 1.00 0.00 C ATOM 1467 NZ LYS A 93 117.380 -6.140 -4.806 1.00 0.00 N ATOM 0 H LYS A 93 121.586 -4.425 -2.996 1.00 0.00 H new ATOM 0 HA LYS A 93 120.883 -1.838 -1.847 1.00 0.00 H new ATOM 0 HB2 LYS A 93 118.950 -3.558 -0.974 1.00 0.00 H new ATOM 0 HB3 LYS A 93 118.940 -2.844 -2.574 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.621 -5.296 -2.375 1.00 0.00 H new ATOM 0 HG3 LYS A 93 118.923 -5.581 -2.048 1.00 0.00 H new ATOM 0 HD2 LYS A 93 118.554 -4.072 -4.228 1.00 0.00 H new ATOM 0 HD3 LYS A 93 120.211 -4.520 -4.582 1.00 0.00 H new ATOM 0 HE2 LYS A 93 119.386 -6.475 -5.430 1.00 0.00 H new ATOM 0 HE3 LYS A 93 119.054 -6.955 -3.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 116.979 -7.098 -4.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 116.916 -5.523 -4.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 117.222 -5.763 -5.762 1.00 0.00 H new ATOM 1481 N GLY A 94 122.154 -4.101 0.049 1.00 0.00 N ATOM 1482 CA GLY A 94 122.555 -4.399 1.455 1.00 0.00 C ATOM 1483 C GLY A 94 123.304 -3.214 2.081 1.00 0.00 C ATOM 1484 O GLY A 94 122.972 -2.769 3.161 1.00 0.00 O ATOM 0 H GLY A 94 122.599 -4.681 -0.662 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.669 -4.627 2.048 1.00 0.00 H new ATOM 0 HA3 GLY A 94 123.189 -5.285 1.475 1.00 0.00 H new ATOM 1488 N GLU A 95 124.322 -2.709 1.433 1.00 0.00 N ATOM 1489 CA GLU A 95 125.086 -1.570 2.030 1.00 0.00 C ATOM 1490 C GLU A 95 124.438 -0.234 1.664 1.00 0.00 C ATOM 1491 O GLU A 95 124.333 0.659 2.484 1.00 0.00 O ATOM 1492 CB GLU A 95 126.525 -1.580 1.505 1.00 0.00 C ATOM 1493 CG GLU A 95 127.192 -0.235 1.821 1.00 0.00 C ATOM 1494 CD GLU A 95 126.915 0.141 3.278 1.00 0.00 C ATOM 1495 OE1 GLU A 95 126.916 -0.752 4.110 1.00 0.00 O ATOM 1496 OE2 GLU A 95 126.706 1.314 3.537 1.00 0.00 O ATOM 0 H GLU A 95 124.656 -3.031 0.525 1.00 0.00 H new ATOM 0 HA GLU A 95 125.081 -1.687 3.114 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.086 -2.394 1.965 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.530 -1.757 0.430 1.00 0.00 H new ATOM 0 HG2 GLU A 95 128.266 -0.300 1.649 1.00 0.00 H new ATOM 0 HG3 GLU A 95 126.809 0.538 1.155 1.00 0.00 H new ATOM 1503 N THR A 96 124.028 -0.073 0.440 1.00 0.00 N ATOM 1504 CA THR A 96 123.419 1.223 0.034 1.00 0.00 C ATOM 1505 C THR A 96 122.338 1.639 1.035 1.00 0.00 C ATOM 1506 O THR A 96 122.322 2.757 1.516 1.00 0.00 O ATOM 1507 CB THR A 96 122.814 1.092 -1.362 1.00 0.00 C ATOM 1508 OG1 THR A 96 122.196 -0.178 -1.490 1.00 0.00 O ATOM 1509 CG2 THR A 96 123.924 1.235 -2.404 1.00 0.00 C ATOM 0 H THR A 96 124.087 -0.778 -0.295 1.00 0.00 H new ATOM 0 HA THR A 96 124.194 1.989 0.020 1.00 0.00 H new ATOM 0 HB THR A 96 122.068 1.871 -1.517 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.734 -0.746 -2.080 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.499 1.142 -3.403 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.397 2.211 -2.300 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.668 0.453 -2.252 1.00 0.00 H new ATOM 1517 N MET A 97 121.439 0.751 1.359 1.00 0.00 N ATOM 1518 CA MET A 97 120.363 1.103 2.330 1.00 0.00 C ATOM 1519 C MET A 97 120.998 1.672 3.605 1.00 0.00 C ATOM 1520 O MET A 97 120.382 2.418 4.353 1.00 0.00 O ATOM 1521 CB MET A 97 119.576 -0.165 2.676 1.00 0.00 C ATOM 1522 CG MET A 97 120.537 -1.240 3.187 1.00 0.00 C ATOM 1523 SD MET A 97 120.721 -1.081 4.981 1.00 0.00 S ATOM 1524 CE MET A 97 120.410 -2.814 5.395 1.00 0.00 C ATOM 0 H MET A 97 121.402 -0.201 0.995 1.00 0.00 H new ATOM 0 HA MET A 97 119.696 1.847 1.894 1.00 0.00 H new ATOM 0 HB2 MET A 97 118.825 0.056 3.434 1.00 0.00 H new ATOM 0 HB3 MET A 97 119.044 -0.527 1.796 1.00 0.00 H new ATOM 0 HG2 MET A 97 120.158 -2.231 2.936 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.507 -1.137 2.701 1.00 0.00 H new ATOM 0 HE1 MET A 97 120.475 -2.947 6.475 1.00 0.00 H new ATOM 0 HE2 MET A 97 119.414 -3.097 5.054 1.00 0.00 H new ATOM 0 HE3 MET A 97 121.153 -3.444 4.906 1.00 0.00 H new ATOM 1534 N LYS A 98 122.225 1.316 3.859 1.00 0.00 N ATOM 1535 CA LYS A 98 122.917 1.804 5.084 1.00 0.00 C ATOM 1536 C LYS A 98 123.326 3.272 4.940 1.00 0.00 C ATOM 1537 O LYS A 98 123.166 4.051 5.856 1.00 0.00 O ATOM 1538 CB LYS A 98 124.170 0.957 5.318 1.00 0.00 C ATOM 1539 CG LYS A 98 124.214 0.490 6.776 1.00 0.00 C ATOM 1540 CD LYS A 98 123.250 -0.682 6.966 1.00 0.00 C ATOM 1541 CE LYS A 98 123.524 -1.356 8.312 1.00 0.00 C ATOM 1542 NZ LYS A 98 123.829 -0.316 9.335 1.00 0.00 N ATOM 0 H LYS A 98 122.783 0.702 3.265 1.00 0.00 H new ATOM 0 HA LYS A 98 122.231 1.718 5.927 1.00 0.00 H new ATOM 0 HB2 LYS A 98 124.168 0.095 4.650 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.062 1.538 5.085 1.00 0.00 H new ATOM 0 HG2 LYS A 98 125.227 0.188 7.042 1.00 0.00 H new ATOM 0 HG3 LYS A 98 123.941 1.310 7.440 1.00 0.00 H new ATOM 0 HD2 LYS A 98 122.220 -0.329 6.927 1.00 0.00 H new ATOM 0 HD3 LYS A 98 123.371 -1.401 6.156 1.00 0.00 H new ATOM 0 HE2 LYS A 98 122.658 -1.942 8.620 1.00 0.00 H new ATOM 0 HE3 LYS A 98 124.361 -2.048 8.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 123.715 -0.721 10.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 124.808 0.014 9.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 123.177 0.486 9.220 1.00 0.00 H new ATOM 1556 N TYR A 99 123.879 3.666 3.824 1.00 0.00 N ATOM 1557 CA TYR A 99 124.305 5.088 3.701 1.00 0.00 C ATOM 1558 C TYR A 99 123.091 6.011 3.794 1.00 0.00 C ATOM 1559 O TYR A 99 123.198 7.122 4.276 1.00 0.00 O ATOM 1560 CB TYR A 99 125.067 5.315 2.388 1.00 0.00 C ATOM 1561 CG TYR A 99 124.113 5.510 1.238 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.363 6.686 1.128 1.00 0.00 C ATOM 1563 CD2 TYR A 99 123.991 4.510 0.274 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.488 6.855 0.048 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.119 4.676 -0.806 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.365 5.850 -0.919 1.00 0.00 C ATOM 1567 OH TYR A 99 121.501 6.016 -1.981 1.00 0.00 O ATOM 0 H TYR A 99 124.051 3.078 3.008 1.00 0.00 H new ATOM 0 HA TYR A 99 124.980 5.322 4.524 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.711 6.189 2.483 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.715 4.462 2.187 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.459 7.461 1.874 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.572 3.604 0.362 1.00 0.00 H new ATOM 0 HE1 TYR A 99 121.907 7.761 -0.039 1.00 0.00 H new ATOM 0 HE2 TYR A 99 123.027 3.900 -1.552 1.00 0.00 H new ATOM 0 HH TYR A 99 120.939 5.219 -2.073 1.00 0.00 H new ATOM 1577 N ILE A 100 121.932 5.574 3.369 1.00 0.00 N ATOM 1578 CA ILE A 100 120.743 6.469 3.483 1.00 0.00 C ATOM 1579 C ILE A 100 120.428 6.677 4.963 1.00 0.00 C ATOM 1580 O ILE A 100 120.341 7.792 5.436 1.00 0.00 O ATOM 1581 CB ILE A 100 119.524 5.849 2.798 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.763 5.764 1.291 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.301 6.731 3.063 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.681 4.583 0.991 1.00 0.00 C ATOM 0 H ILE A 100 121.760 4.657 2.957 1.00 0.00 H new ATOM 0 HA ILE A 100 120.969 7.418 2.997 1.00 0.00 H new ATOM 0 HB ILE A 100 119.357 4.847 3.193 1.00 0.00 H new ATOM 0 HG12 ILE A 100 118.815 5.644 0.767 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.212 6.689 0.930 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.427 6.296 2.578 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.125 6.796 4.137 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.479 7.729 2.663 1.00 0.00 H new ATOM 0 HD11 ILE A 100 120.853 4.520 -0.083 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.633 4.723 1.504 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.214 3.662 1.338 1.00 0.00 H new ATOM 1596 N LEU A 101 120.266 5.612 5.704 1.00 0.00 N ATOM 1597 CA LEU A 101 119.967 5.767 7.157 1.00 0.00 C ATOM 1598 C LEU A 101 121.213 6.291 7.865 1.00 0.00 C ATOM 1599 O LEU A 101 121.186 7.319 8.512 1.00 0.00 O ATOM 1600 CB LEU A 101 119.580 4.410 7.746 1.00 0.00 C ATOM 1601 CG LEU A 101 118.167 4.486 8.318 1.00 0.00 C ATOM 1602 CD1 LEU A 101 117.681 3.077 8.669 1.00 0.00 C ATOM 1603 CD2 LEU A 101 118.174 5.359 9.576 1.00 0.00 C ATOM 0 H LEU A 101 120.327 4.650 5.369 1.00 0.00 H new ATOM 0 HA LEU A 101 119.142 6.467 7.292 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.631 3.640 6.976 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.285 4.127 8.527 1.00 0.00 H new ATOM 0 HG LEU A 101 117.496 4.923 7.578 1.00 0.00 H new ATOM 0 HD11 LEU A 101 116.672 3.131 9.078 1.00 0.00 H new ATOM 0 HD12 LEU A 101 117.676 2.460 7.771 1.00 0.00 H new ATOM 0 HD13 LEU A 101 118.349 2.636 9.409 1.00 0.00 H new ATOM 0 HD21 LEU A 101 117.166 5.414 9.986 1.00 0.00 H new ATOM 0 HD22 LEU A 101 118.844 4.923 10.317 1.00 0.00 H new ATOM 0 HD23 LEU A 101 118.518 6.362 9.321 1.00 0.00 H new ATOM 1615 N ALA A 102 122.307 5.599 7.737 1.00 0.00 N ATOM 1616 CA ALA A 102 123.552 6.067 8.393 1.00 0.00 C ATOM 1617 C ALA A 102 123.789 7.523 8.002 1.00 0.00 C ATOM 1618 O ALA A 102 123.388 8.434 8.700 1.00 0.00 O ATOM 1619 CB ALA A 102 124.732 5.213 7.926 1.00 0.00 C ATOM 0 H ALA A 102 122.392 4.731 7.207 1.00 0.00 H new ATOM 0 HA ALA A 102 123.458 5.981 9.475 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.646 5.559 8.410 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.554 4.171 8.190 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.839 5.300 6.845 1.00 0.00 H new ATOM 1625 N LEU A 103 124.427 7.749 6.887 1.00 0.00 N ATOM 1626 CA LEU A 103 124.689 9.146 6.444 1.00 0.00 C ATOM 1627 C LEU A 103 125.412 9.911 7.555 1.00 0.00 C ATOM 1628 O LEU A 103 126.037 10.923 7.309 1.00 0.00 O ATOM 1629 CB LEU A 103 123.363 9.840 6.123 1.00 0.00 C ATOM 1630 CG LEU A 103 123.621 11.315 5.815 1.00 0.00 C ATOM 1631 CD1 LEU A 103 124.652 11.430 4.691 1.00 0.00 C ATOM 1632 CD2 LEU A 103 122.313 11.979 5.376 1.00 0.00 C ATOM 0 H LEU A 103 124.779 7.024 6.262 1.00 0.00 H new ATOM 0 HA LEU A 103 125.314 9.130 5.551 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.885 9.358 5.270 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.679 9.748 6.966 1.00 0.00 H new ATOM 0 HG LEU A 103 124.001 11.811 6.708 1.00 0.00 H new ATOM 0 HD11 LEU A 103 124.836 12.482 4.472 1.00 0.00 H new ATOM 0 HD12 LEU A 103 125.583 10.956 5.002 1.00 0.00 H new ATOM 0 HD13 LEU A 103 124.273 10.934 3.797 1.00 0.00 H new ATOM 0 HD21 LEU A 103 122.495 13.031 5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 103 121.934 11.482 4.483 1.00 0.00 H new ATOM 0 HD23 LEU A 103 121.577 11.898 6.176 1.00 0.00 H new ATOM 1644 N LYS A 104 125.338 9.435 8.773 1.00 0.00 N ATOM 1645 CA LYS A 104 126.031 10.136 9.894 1.00 0.00 C ATOM 1646 C LYS A 104 127.268 10.839 9.337 1.00 0.00 C ATOM 1647 O LYS A 104 127.557 11.974 9.663 1.00 0.00 O ATOM 1648 CB LYS A 104 126.458 9.107 10.948 1.00 0.00 C ATOM 1649 CG LYS A 104 126.262 9.669 12.363 1.00 0.00 C ATOM 1650 CD LYS A 104 125.373 8.728 13.183 1.00 0.00 C ATOM 1651 CE LYS A 104 124.040 8.509 12.463 1.00 0.00 C ATOM 1652 NZ LYS A 104 123.803 9.621 11.500 1.00 0.00 N ATOM 0 H LYS A 104 124.828 8.592 9.038 1.00 0.00 H new ATOM 0 HA LYS A 104 125.363 10.865 10.353 1.00 0.00 H new ATOM 0 HB2 LYS A 104 125.875 8.194 10.830 1.00 0.00 H new ATOM 0 HB3 LYS A 104 127.504 8.839 10.799 1.00 0.00 H new ATOM 0 HG2 LYS A 104 127.228 9.788 12.853 1.00 0.00 H new ATOM 0 HG3 LYS A 104 125.807 10.658 12.310 1.00 0.00 H new ATOM 0 HD2 LYS A 104 125.878 7.773 13.330 1.00 0.00 H new ATOM 0 HD3 LYS A 104 125.197 9.151 14.172 1.00 0.00 H new ATOM 0 HE2 LYS A 104 124.052 7.555 11.936 1.00 0.00 H new ATOM 0 HE3 LYS A 104 123.227 8.463 13.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 122.803 9.904 11.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 124.402 10.433 11.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 124.038 9.303 10.538 1.00 0.00 H new ATOM 1666 N ASP A 105 127.988 10.170 8.480 1.00 0.00 N ATOM 1667 CA ASP A 105 129.197 10.785 7.871 1.00 0.00 C ATOM 1668 C ASP A 105 129.055 10.727 6.348 1.00 0.00 C ATOM 1669 O ASP A 105 128.638 11.680 5.722 1.00 0.00 O ATOM 1670 CB ASP A 105 130.443 10.011 8.307 1.00 0.00 C ATOM 1671 CG ASP A 105 130.913 10.527 9.668 1.00 0.00 C ATOM 1672 OD1 ASP A 105 130.064 10.821 10.494 1.00 0.00 O ATOM 1673 OD2 ASP A 105 132.114 10.620 9.862 1.00 0.00 O ATOM 0 H ASP A 105 127.788 9.218 8.174 1.00 0.00 H new ATOM 0 HA ASP A 105 129.296 11.821 8.196 1.00 0.00 H new ATOM 0 HB2 ASP A 105 130.220 8.946 8.367 1.00 0.00 H new ATOM 0 HB3 ASP A 105 131.235 10.130 7.568 1.00 0.00 H new ATOM 1678 N GLN A 106 129.378 9.608 5.753 1.00 0.00 N ATOM 1679 CA GLN A 106 129.245 9.474 4.272 1.00 0.00 C ATOM 1680 C GLN A 106 130.166 8.357 3.767 1.00 0.00 C ATOM 1681 O GLN A 106 129.709 7.348 3.268 1.00 0.00 O ATOM 1682 CB GLN A 106 129.616 10.797 3.587 1.00 0.00 C ATOM 1683 CG GLN A 106 128.342 11.558 3.202 1.00 0.00 C ATOM 1684 CD GLN A 106 128.589 13.063 3.327 1.00 0.00 C ATOM 1685 OE1 GLN A 106 127.658 13.836 3.435 1.00 0.00 O ATOM 1686 NE2 GLN A 106 129.813 13.514 3.316 1.00 0.00 N ATOM 0 H GLN A 106 129.729 8.778 6.231 1.00 0.00 H new ATOM 0 HA GLN A 106 128.211 9.226 4.032 1.00 0.00 H new ATOM 0 HB2 GLN A 106 130.226 11.405 4.256 1.00 0.00 H new ATOM 0 HB3 GLN A 106 130.216 10.601 2.698 1.00 0.00 H new ATOM 0 HG2 GLN A 106 128.052 11.310 2.181 1.00 0.00 H new ATOM 0 HG3 GLN A 106 127.517 11.259 3.849 1.00 0.00 H new ATOM 0 HE21 GLN A 106 130.595 12.865 3.225 1.00 0.00 H new ATOM 0 HE22 GLN A 106 129.988 14.515 3.398 1.00 0.00 H new ATOM 1695 N PRO A 107 131.454 8.540 3.890 1.00 0.00 N ATOM 1696 CA PRO A 107 132.462 7.535 3.433 1.00 0.00 C ATOM 1697 C PRO A 107 132.376 6.205 4.191 1.00 0.00 C ATOM 1698 O PRO A 107 132.843 5.190 3.719 1.00 0.00 O ATOM 1699 CB PRO A 107 133.810 8.209 3.709 1.00 0.00 C ATOM 1700 CG PRO A 107 133.528 9.255 4.734 1.00 0.00 C ATOM 1701 CD PRO A 107 132.100 9.723 4.478 1.00 0.00 C ATOM 0 HA PRO A 107 132.302 7.274 2.387 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.542 7.489 4.074 1.00 0.00 H new ATOM 0 HB3 PRO A 107 134.222 8.650 2.801 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.631 8.852 5.741 1.00 0.00 H new ATOM 0 HG3 PRO A 107 134.231 10.084 4.649 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.608 10.033 5.400 1.00 0.00 H new ATOM 0 HD3 PRO A 107 132.072 10.575 3.799 1.00 0.00 H new ATOM 1709 N GLU A 108 131.796 6.194 5.361 1.00 0.00 N ATOM 1710 CA GLU A 108 131.712 4.913 6.124 1.00 0.00 C ATOM 1711 C GLU A 108 130.740 3.967 5.419 1.00 0.00 C ATOM 1712 O GLU A 108 131.076 2.845 5.082 1.00 0.00 O ATOM 1713 CB GLU A 108 131.223 5.191 7.550 1.00 0.00 C ATOM 1714 CG GLU A 108 131.170 6.699 7.790 1.00 0.00 C ATOM 1715 CD GLU A 108 132.548 7.310 7.523 1.00 0.00 C ATOM 1716 OE1 GLU A 108 133.398 6.602 7.008 1.00 0.00 O ATOM 1717 OE2 GLU A 108 132.730 8.474 7.839 1.00 0.00 O ATOM 0 H GLU A 108 131.381 7.006 5.818 1.00 0.00 H new ATOM 0 HA GLU A 108 132.698 4.452 6.170 1.00 0.00 H new ATOM 0 HB2 GLU A 108 130.235 4.754 7.698 1.00 0.00 H new ATOM 0 HB3 GLU A 108 131.891 4.721 8.272 1.00 0.00 H new ATOM 0 HG2 GLU A 108 130.426 7.155 7.137 1.00 0.00 H new ATOM 0 HG3 GLU A 108 130.863 6.904 8.816 1.00 0.00 H new ATOM 1724 N ALA A 109 129.542 4.413 5.177 1.00 0.00 N ATOM 1725 CA ALA A 109 128.558 3.543 4.482 1.00 0.00 C ATOM 1726 C ALA A 109 129.114 3.189 3.102 1.00 0.00 C ATOM 1727 O ALA A 109 129.010 2.068 2.641 1.00 0.00 O ATOM 1728 CB ALA A 109 127.236 4.296 4.337 1.00 0.00 C ATOM 0 H ALA A 109 129.202 5.341 5.430 1.00 0.00 H new ATOM 0 HA ALA A 109 128.385 2.631 5.053 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.510 3.662 3.828 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.857 4.560 5.324 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.396 5.204 3.755 1.00 0.00 H new ATOM 1734 N ALA A 110 129.718 4.141 2.448 1.00 0.00 N ATOM 1735 CA ALA A 110 130.300 3.878 1.107 1.00 0.00 C ATOM 1736 C ALA A 110 131.459 2.893 1.250 1.00 0.00 C ATOM 1737 O ALA A 110 131.686 2.061 0.395 1.00 0.00 O ATOM 1738 CB ALA A 110 130.812 5.188 0.504 1.00 0.00 C ATOM 0 H ALA A 110 129.833 5.095 2.789 1.00 0.00 H new ATOM 0 HA ALA A 110 129.538 3.456 0.452 1.00 0.00 H new ATOM 0 HB1 ALA A 110 131.239 4.993 -0.480 1.00 0.00 H new ATOM 0 HB2 ALA A 110 129.985 5.892 0.408 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.577 5.613 1.154 1.00 0.00 H new ATOM 1744 N GLN A 111 132.191 2.968 2.330 1.00 0.00 N ATOM 1745 CA GLN A 111 133.321 2.018 2.511 1.00 0.00 C ATOM 1746 C GLN A 111 132.790 0.605 2.302 1.00 0.00 C ATOM 1747 O GLN A 111 133.307 -0.152 1.503 1.00 0.00 O ATOM 1748 CB GLN A 111 133.905 2.157 3.917 1.00 0.00 C ATOM 1749 CG GLN A 111 134.731 3.444 3.995 1.00 0.00 C ATOM 1750 CD GLN A 111 136.206 3.099 4.209 1.00 0.00 C ATOM 1751 OE1 GLN A 111 137.037 3.384 3.369 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.570 2.492 5.305 1.00 0.00 N ATOM 0 H GLN A 111 132.056 3.639 3.086 1.00 0.00 H new ATOM 0 HA GLN A 111 134.111 2.233 1.792 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.104 2.180 4.656 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.530 1.295 4.151 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.612 4.020 3.077 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.372 4.069 4.812 1.00 0.00 H new ATOM 0 HE21 GLN A 111 135.874 2.252 6.011 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.551 2.257 5.456 1.00 0.00 H new ATOM 1761 N LEU A 112 131.737 0.249 2.986 1.00 0.00 N ATOM 1762 CA LEU A 112 131.167 -1.107 2.779 1.00 0.00 C ATOM 1763 C LEU A 112 130.900 -1.264 1.287 1.00 0.00 C ATOM 1764 O LEU A 112 131.131 -2.301 0.703 1.00 0.00 O ATOM 1765 CB LEU A 112 129.859 -1.246 3.556 1.00 0.00 C ATOM 1766 CG LEU A 112 130.163 -1.679 4.989 1.00 0.00 C ATOM 1767 CD1 LEU A 112 130.654 -3.130 5.004 1.00 0.00 C ATOM 1768 CD2 LEU A 112 131.244 -0.771 5.573 1.00 0.00 C ATOM 0 H LEU A 112 131.254 0.831 3.670 1.00 0.00 H new ATOM 0 HA LEU A 112 131.857 -1.873 3.132 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.322 -0.298 3.557 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.212 -1.978 3.073 1.00 0.00 H new ATOM 0 HG LEU A 112 129.255 -1.603 5.587 1.00 0.00 H new ATOM 0 HD11 LEU A 112 130.869 -3.431 6.029 1.00 0.00 H new ATOM 0 HD12 LEU A 112 129.883 -3.779 4.589 1.00 0.00 H new ATOM 0 HD13 LEU A 112 131.560 -3.214 4.404 1.00 0.00 H new ATOM 0 HD21 LEU A 112 131.463 -1.078 6.596 1.00 0.00 H new ATOM 0 HD22 LEU A 112 132.148 -0.847 4.970 1.00 0.00 H new ATOM 0 HD23 LEU A 112 130.893 0.261 5.571 1.00 0.00 H new ATOM 1780 N ALA A 113 130.437 -0.222 0.661 1.00 0.00 N ATOM 1781 CA ALA A 113 130.180 -0.287 -0.802 1.00 0.00 C ATOM 1782 C ALA A 113 131.482 -0.670 -1.514 1.00 0.00 C ATOM 1783 O ALA A 113 131.471 -1.234 -2.590 1.00 0.00 O ATOM 1784 CB ALA A 113 129.703 1.078 -1.303 1.00 0.00 C ATOM 0 H ALA A 113 130.225 0.674 1.100 1.00 0.00 H new ATOM 0 HA ALA A 113 129.410 -1.030 -1.010 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.516 1.027 -2.376 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.784 1.354 -0.787 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.470 1.827 -1.104 1.00 0.00 H new ATOM 1790 N LEU A 114 132.605 -0.357 -0.919 1.00 0.00 N ATOM 1791 CA LEU A 114 133.916 -0.691 -1.558 1.00 0.00 C ATOM 1792 C LEU A 114 134.127 -2.204 -1.522 1.00 0.00 C ATOM 1793 O LEU A 114 134.295 -2.850 -2.548 1.00 0.00 O ATOM 1794 CB LEU A 114 135.047 0.000 -0.793 1.00 0.00 C ATOM 1795 CG LEU A 114 136.218 0.268 -1.741 1.00 0.00 C ATOM 1796 CD1 LEU A 114 136.602 -1.028 -2.457 1.00 0.00 C ATOM 1797 CD2 LEU A 114 135.809 1.321 -2.776 1.00 0.00 C ATOM 0 H LEU A 114 132.672 0.116 -0.018 1.00 0.00 H new ATOM 0 HA LEU A 114 133.915 -0.348 -2.593 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.691 0.937 -0.365 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.374 -0.626 0.037 1.00 0.00 H new ATOM 0 HG LEU A 114 137.071 0.634 -1.169 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.436 -0.837 -3.132 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.895 -1.777 -1.721 1.00 0.00 H new ATOM 0 HD13 LEU A 114 135.749 -1.394 -3.028 1.00 0.00 H new ATOM 0 HD21 LEU A 114 136.644 1.511 -3.451 1.00 0.00 H new ATOM 0 HD22 LEU A 114 134.956 0.957 -3.348 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.536 2.245 -2.267 1.00 0.00 H new ATOM 1809 N ARG A 115 134.089 -2.798 -0.361 1.00 0.00 N ATOM 1810 CA ARG A 115 134.255 -4.268 -0.323 1.00 0.00 C ATOM 1811 C ARG A 115 133.213 -4.822 -1.288 1.00 0.00 C ATOM 1812 O ARG A 115 133.494 -5.644 -2.133 1.00 0.00 O ATOM 1813 CB ARG A 115 134.040 -4.800 1.101 1.00 0.00 C ATOM 1814 CG ARG A 115 133.778 -3.632 2.054 1.00 0.00 C ATOM 1815 CD ARG A 115 135.054 -2.800 2.223 1.00 0.00 C ATOM 1816 NE ARG A 115 136.155 -3.395 1.415 1.00 0.00 N ATOM 1817 CZ ARG A 115 137.367 -2.923 1.517 1.00 0.00 C ATOM 1818 NH1 ARG A 115 137.615 -1.930 2.326 1.00 0.00 N ATOM 1819 NH2 ARG A 115 138.332 -3.445 0.810 1.00 0.00 N ATOM 0 H ARG A 115 133.953 -2.339 0.540 1.00 0.00 H new ATOM 0 HA ARG A 115 135.261 -4.573 -0.612 1.00 0.00 H new ATOM 0 HB2 ARG A 115 133.198 -5.492 1.118 1.00 0.00 H new ATOM 0 HB3 ARG A 115 134.917 -5.358 1.427 1.00 0.00 H new ATOM 0 HG2 ARG A 115 132.975 -3.007 1.664 1.00 0.00 H new ATOM 0 HG3 ARG A 115 133.448 -4.008 3.022 1.00 0.00 H new ATOM 0 HD2 ARG A 115 134.873 -1.772 1.908 1.00 0.00 H new ATOM 0 HD3 ARG A 115 135.340 -2.765 3.274 1.00 0.00 H new ATOM 0 HE ARG A 115 135.961 -4.171 0.782 1.00 0.00 H new ATOM 0 HH11 ARG A 115 136.861 -1.522 2.879 1.00 0.00 H new ATOM 0 HH12 ARG A 115 138.563 -1.561 2.405 1.00 0.00 H new ATOM 0 HH21 ARG A 115 138.138 -4.222 0.178 1.00 0.00 H new ATOM 0 HH22 ARG A 115 139.280 -3.076 0.890 1.00 0.00 H new ATOM 1833 N VAL A 116 132.017 -4.316 -1.232 1.00 0.00 N ATOM 1834 CA VAL A 116 131.003 -4.772 -2.202 1.00 0.00 C ATOM 1835 C VAL A 116 131.674 -4.706 -3.570 1.00 0.00 C ATOM 1836 O VAL A 116 131.425 -5.506 -4.444 1.00 0.00 O ATOM 1837 CB VAL A 116 129.795 -3.831 -2.148 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.277 -3.552 -3.558 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.677 -4.463 -1.312 1.00 0.00 C ATOM 0 H VAL A 116 131.704 -3.614 -0.562 1.00 0.00 H new ATOM 0 HA VAL A 116 130.649 -5.781 -1.989 1.00 0.00 H new ATOM 0 HB VAL A 116 130.107 -2.893 -1.689 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.419 -2.882 -3.504 1.00 0.00 H new ATOM 0 HG12 VAL A 116 130.065 -3.086 -4.149 1.00 0.00 H new ATOM 0 HG13 VAL A 116 128.977 -4.489 -4.028 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.822 -3.788 -1.278 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.376 -5.408 -1.763 1.00 0.00 H new ATOM 0 HG23 VAL A 116 129.037 -4.643 -0.299 1.00 0.00 H new ATOM 1849 N GLY A 117 132.563 -3.766 -3.742 1.00 0.00 N ATOM 1850 CA GLY A 117 133.284 -3.668 -5.033 1.00 0.00 C ATOM 1851 C GLY A 117 133.835 -5.051 -5.358 1.00 0.00 C ATOM 1852 O GLY A 117 133.661 -5.572 -6.454 1.00 0.00 O ATOM 0 H GLY A 117 132.817 -3.066 -3.045 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.613 -3.328 -5.822 1.00 0.00 H new ATOM 0 HA3 GLY A 117 134.092 -2.940 -4.966 1.00 0.00 H new ATOM 1856 N ILE A 118 134.485 -5.678 -4.408 1.00 0.00 N ATOM 1857 CA ILE A 118 135.008 -7.035 -4.703 1.00 0.00 C ATOM 1858 C ILE A 118 133.853 -7.866 -5.239 1.00 0.00 C ATOM 1859 O ILE A 118 134.033 -8.730 -6.073 1.00 0.00 O ATOM 1860 CB ILE A 118 135.654 -7.705 -3.470 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.762 -7.658 -2.216 1.00 0.00 C ATOM 1862 CG2 ILE A 118 136.952 -6.971 -3.150 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.351 -8.185 -2.500 1.00 0.00 C ATOM 0 H ILE A 118 134.669 -5.318 -3.471 1.00 0.00 H new ATOM 0 HA ILE A 118 135.805 -6.959 -5.443 1.00 0.00 H new ATOM 0 HB ILE A 118 135.816 -8.753 -3.721 1.00 0.00 H new ATOM 0 HG12 ILE A 118 135.218 -8.251 -1.423 1.00 0.00 H new ATOM 0 HG13 ILE A 118 134.700 -6.632 -1.852 1.00 0.00 H new ATOM 0 HG21 ILE A 118 137.424 -7.429 -2.281 1.00 0.00 H new ATOM 0 HG22 ILE A 118 137.626 -7.034 -4.005 1.00 0.00 H new ATOM 0 HG23 ILE A 118 136.735 -5.925 -2.935 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.754 -8.135 -1.590 1.00 0.00 H new ATOM 0 HD12 ILE A 118 132.884 -7.576 -3.274 1.00 0.00 H new ATOM 0 HD13 ILE A 118 133.410 -9.219 -2.838 1.00 0.00 H new ATOM 1875 N ALA A 119 132.654 -7.599 -4.788 1.00 0.00 N ATOM 1876 CA ALA A 119 131.503 -8.368 -5.305 1.00 0.00 C ATOM 1877 C ALA A 119 131.274 -7.978 -6.761 1.00 0.00 C ATOM 1878 O ALA A 119 130.836 -8.780 -7.557 1.00 0.00 O ATOM 1879 CB ALA A 119 130.256 -8.089 -4.467 1.00 0.00 C ATOM 0 H ALA A 119 132.432 -6.888 -4.091 1.00 0.00 H new ATOM 0 HA ALA A 119 131.712 -9.436 -5.242 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.417 -8.663 -4.861 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.440 -8.379 -3.433 1.00 0.00 H new ATOM 0 HB3 ALA A 119 130.020 -7.026 -4.509 1.00 0.00 H new ATOM 1885 N VAL A 120 131.603 -6.773 -7.148 1.00 0.00 N ATOM 1886 CA VAL A 120 131.413 -6.423 -8.579 1.00 0.00 C ATOM 1887 C VAL A 120 132.081 -7.532 -9.359 1.00 0.00 C ATOM 1888 O VAL A 120 131.586 -7.996 -10.367 1.00 0.00 O ATOM 1889 CB VAL A 120 132.066 -5.082 -8.894 1.00 0.00 C ATOM 1890 CG1 VAL A 120 131.858 -4.753 -10.372 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.425 -3.994 -8.035 1.00 0.00 C ATOM 0 H VAL A 120 131.984 -6.038 -6.552 1.00 0.00 H new ATOM 0 HA VAL A 120 130.357 -6.328 -8.834 1.00 0.00 H new ATOM 0 HB VAL A 120 133.133 -5.134 -8.679 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.324 -3.794 -10.600 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.311 -5.532 -10.985 1.00 0.00 H new ATOM 0 HG13 VAL A 120 130.791 -4.698 -10.586 1.00 0.00 H new ATOM 0 HG21 VAL A 120 131.890 -3.034 -8.258 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.358 -3.940 -8.252 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.569 -4.231 -6.981 1.00 0.00 H new ATOM 1901 N ALA A 121 133.173 -8.012 -8.847 1.00 0.00 N ATOM 1902 CA ALA A 121 133.846 -9.159 -9.503 1.00 0.00 C ATOM 1903 C ALA A 121 133.191 -10.435 -8.960 1.00 0.00 C ATOM 1904 O ALA A 121 133.253 -11.491 -9.558 1.00 0.00 O ATOM 1905 CB ALA A 121 135.337 -9.153 -9.161 1.00 0.00 C ATOM 0 H ALA A 121 133.628 -7.661 -8.004 1.00 0.00 H new ATOM 0 HA ALA A 121 133.746 -9.101 -10.587 1.00 0.00 H new ATOM 0 HB1 ALA A 121 135.825 -9.998 -9.646 1.00 0.00 H new ATOM 0 HB2 ALA A 121 135.787 -8.224 -9.511 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.463 -9.232 -8.081 1.00 0.00 H new ATOM 1911 N LYS A 122 132.562 -10.324 -7.812 1.00 0.00 N ATOM 1912 CA LYS A 122 131.887 -11.501 -7.181 1.00 0.00 C ATOM 1913 C LYS A 122 130.480 -11.099 -6.710 1.00 0.00 C ATOM 1914 O LYS A 122 130.126 -11.302 -5.566 1.00 0.00 O ATOM 1915 CB LYS A 122 132.704 -11.999 -5.984 1.00 0.00 C ATOM 1916 CG LYS A 122 134.198 -11.838 -6.270 1.00 0.00 C ATOM 1917 CD LYS A 122 134.975 -12.960 -5.578 1.00 0.00 C ATOM 1918 CE LYS A 122 136.429 -12.527 -5.378 1.00 0.00 C ATOM 1919 NZ LYS A 122 137.183 -13.617 -4.696 1.00 0.00 N ATOM 0 H LYS A 122 132.488 -9.456 -7.281 1.00 0.00 H new ATOM 0 HA LYS A 122 131.811 -12.301 -7.918 1.00 0.00 H new ATOM 0 HB2 LYS A 122 132.434 -11.438 -5.089 1.00 0.00 H new ATOM 0 HB3 LYS A 122 132.474 -13.046 -5.786 1.00 0.00 H new ATOM 0 HG2 LYS A 122 134.378 -11.866 -7.345 1.00 0.00 H new ATOM 0 HG3 LYS A 122 134.545 -10.868 -5.914 1.00 0.00 H new ATOM 0 HD2 LYS A 122 134.518 -13.193 -4.616 1.00 0.00 H new ATOM 0 HD3 LYS A 122 134.935 -13.869 -6.179 1.00 0.00 H new ATOM 0 HE2 LYS A 122 136.888 -12.300 -6.340 1.00 0.00 H new ATOM 0 HE3 LYS A 122 136.469 -11.615 -4.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 138.148 -13.292 -4.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 136.701 -13.871 -3.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 137.227 -14.450 -5.317 1.00 0.00 H new ATOM 1933 N SER A 123 129.691 -10.502 -7.565 1.00 0.00 N ATOM 1934 CA SER A 123 128.322 -10.058 -7.149 1.00 0.00 C ATOM 1935 C SER A 123 127.688 -11.096 -6.232 1.00 0.00 C ATOM 1936 O SER A 123 126.703 -10.836 -5.570 1.00 0.00 O ATOM 1937 CB SER A 123 127.447 -9.875 -8.388 1.00 0.00 C ATOM 1938 OG SER A 123 128.219 -9.288 -9.427 1.00 0.00 O ATOM 0 H SER A 123 129.934 -10.301 -8.535 1.00 0.00 H new ATOM 0 HA SER A 123 128.405 -9.113 -6.613 1.00 0.00 H new ATOM 0 HB2 SER A 123 127.051 -10.837 -8.713 1.00 0.00 H new ATOM 0 HB3 SER A 123 126.592 -9.242 -8.153 1.00 0.00 H new ATOM 0 HG SER A 123 128.676 -8.491 -9.085 1.00 0.00 H new ATOM 1944 N ASP A 124 128.246 -12.261 -6.177 1.00 0.00 N ATOM 1945 CA ASP A 124 127.678 -13.309 -5.289 1.00 0.00 C ATOM 1946 C ASP A 124 128.795 -14.261 -4.855 1.00 0.00 C ATOM 1947 O ASP A 124 128.698 -15.461 -5.016 1.00 0.00 O ATOM 1948 CB ASP A 124 126.589 -14.078 -6.044 1.00 0.00 C ATOM 1949 CG ASP A 124 127.236 -15.089 -6.993 1.00 0.00 C ATOM 1950 OD1 ASP A 124 128.341 -14.828 -7.441 1.00 0.00 O ATOM 1951 OD2 ASP A 124 126.617 -16.106 -7.255 1.00 0.00 O ATOM 0 H ASP A 124 129.072 -12.539 -6.707 1.00 0.00 H new ATOM 0 HA ASP A 124 127.238 -12.849 -4.404 1.00 0.00 H new ATOM 0 HB2 ASP A 124 125.938 -14.593 -5.338 1.00 0.00 H new ATOM 0 HB3 ASP A 124 125.964 -13.384 -6.607 1.00 0.00 H new ATOM 1956 N GLY A 125 129.860 -13.735 -4.306 1.00 0.00 N ATOM 1957 CA GLY A 125 130.978 -14.618 -3.869 1.00 0.00 C ATOM 1958 C GLY A 125 131.767 -13.956 -2.735 1.00 0.00 C ATOM 1959 O GLY A 125 132.122 -14.596 -1.765 1.00 0.00 O ATOM 0 H GLY A 125 130.002 -12.738 -4.143 1.00 0.00 H new ATOM 0 HA2 GLY A 125 130.583 -15.577 -3.535 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.640 -14.822 -4.711 1.00 0.00 H new ATOM 1963 N ASN A 126 132.057 -12.685 -2.846 1.00 0.00 N ATOM 1964 CA ASN A 126 132.837 -12.010 -1.769 1.00 0.00 C ATOM 1965 C ASN A 126 131.936 -11.049 -0.982 1.00 0.00 C ATOM 1966 O ASN A 126 130.751 -10.948 -1.229 1.00 0.00 O ATOM 1967 CB ASN A 126 134.009 -11.248 -2.390 1.00 0.00 C ATOM 1968 CG ASN A 126 135.242 -12.153 -2.426 1.00 0.00 C ATOM 1969 OD1 ASN A 126 135.122 -13.362 -2.436 1.00 0.00 O ATOM 1970 ND2 ASN A 126 136.431 -11.616 -2.448 1.00 0.00 N ATOM 0 H ASN A 126 131.789 -12.090 -3.630 1.00 0.00 H new ATOM 0 HA ASN A 126 133.222 -12.762 -1.080 1.00 0.00 H new ATOM 0 HB2 ASN A 126 133.753 -10.924 -3.399 1.00 0.00 H new ATOM 0 HB3 ASN A 126 134.221 -10.349 -1.811 1.00 0.00 H new ATOM 0 HD21 ASN A 126 137.259 -12.211 -2.474 1.00 0.00 H new ATOM 0 HD22 ASN A 126 136.532 -10.601 -2.440 1.00 0.00 H new ATOM 1977 N PHE A 127 132.499 -10.360 -0.022 1.00 0.00 N ATOM 1978 CA PHE A 127 131.704 -9.411 0.817 1.00 0.00 C ATOM 1979 C PHE A 127 131.188 -10.134 2.056 1.00 0.00 C ATOM 1980 O PHE A 127 131.200 -11.345 2.133 1.00 0.00 O ATOM 1981 CB PHE A 127 130.516 -8.845 0.037 1.00 0.00 C ATOM 1982 CG PHE A 127 130.160 -7.501 0.625 1.00 0.00 C ATOM 1983 CD1 PHE A 127 131.027 -6.422 0.446 1.00 0.00 C ATOM 1984 CD2 PHE A 127 128.981 -7.337 1.363 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.720 -5.174 1.003 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.671 -6.086 1.917 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.543 -5.006 1.736 1.00 0.00 C ATOM 0 H PHE A 127 133.488 -10.415 0.219 1.00 0.00 H new ATOM 0 HA PHE A 127 132.356 -8.586 1.105 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.769 -8.743 -1.018 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.665 -9.523 0.097 1.00 0.00 H new ATOM 0 HD1 PHE A 127 131.936 -6.550 -0.123 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.311 -8.172 1.505 1.00 0.00 H new ATOM 0 HE1 PHE A 127 131.394 -4.341 0.866 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.760 -5.956 2.483 1.00 0.00 H new ATOM 0 HZ PHE A 127 129.306 -4.043 2.163 1.00 0.00 H new ATOM 1997 N ASP A 128 130.740 -9.390 3.027 1.00 0.00 N ATOM 1998 CA ASP A 128 130.224 -10.006 4.273 1.00 0.00 C ATOM 1999 C ASP A 128 131.404 -10.347 5.184 1.00 0.00 C ATOM 2000 O ASP A 128 131.243 -10.577 6.365 1.00 0.00 O ATOM 2001 CB ASP A 128 129.432 -11.270 3.931 1.00 0.00 C ATOM 2002 CG ASP A 128 128.692 -11.069 2.606 1.00 0.00 C ATOM 2003 OD1 ASP A 128 127.877 -10.164 2.537 1.00 0.00 O ATOM 2004 OD2 ASP A 128 128.954 -11.823 1.684 1.00 0.00 O ATOM 0 H ASP A 128 130.710 -8.371 3.007 1.00 0.00 H new ATOM 0 HA ASP A 128 129.562 -9.310 4.788 1.00 0.00 H new ATOM 0 HB2 ASP A 128 130.105 -12.124 3.857 1.00 0.00 H new ATOM 0 HB3 ASP A 128 128.721 -11.492 4.726 1.00 0.00 H new ATOM 2009 N ASP A 129 132.595 -10.368 4.644 1.00 0.00 N ATOM 2010 CA ASP A 129 133.791 -10.685 5.478 1.00 0.00 C ATOM 2011 C ASP A 129 134.463 -9.387 5.927 1.00 0.00 C ATOM 2012 O ASP A 129 135.010 -9.306 7.009 1.00 0.00 O ATOM 2013 CB ASP A 129 134.780 -11.517 4.659 1.00 0.00 C ATOM 2014 CG ASP A 129 135.060 -10.814 3.329 1.00 0.00 C ATOM 2015 OD1 ASP A 129 135.528 -9.687 3.365 1.00 0.00 O ATOM 2016 OD2 ASP A 129 134.802 -11.413 2.299 1.00 0.00 O ATOM 0 H ASP A 129 132.790 -10.179 3.661 1.00 0.00 H new ATOM 0 HA ASP A 129 133.479 -11.252 6.355 1.00 0.00 H new ATOM 0 HB2 ASP A 129 135.708 -11.649 5.215 1.00 0.00 H new ATOM 0 HB3 ASP A 129 134.372 -12.512 4.478 1.00 0.00 H new ATOM 2021 N ASP A 130 134.417 -8.363 5.117 1.00 0.00 N ATOM 2022 CA ASP A 130 135.042 -7.077 5.523 1.00 0.00 C ATOM 2023 C ASP A 130 134.077 -6.367 6.464 1.00 0.00 C ATOM 2024 O ASP A 130 134.458 -5.536 7.264 1.00 0.00 O ATOM 2025 CB ASP A 130 135.291 -6.211 4.285 1.00 0.00 C ATOM 2026 CG ASP A 130 136.723 -6.424 3.792 1.00 0.00 C ATOM 2027 OD1 ASP A 130 137.624 -6.381 4.614 1.00 0.00 O ATOM 2028 OD2 ASP A 130 136.895 -6.627 2.601 1.00 0.00 O ATOM 0 H ASP A 130 133.976 -8.364 4.197 1.00 0.00 H new ATOM 0 HA ASP A 130 135.996 -7.255 6.020 1.00 0.00 H new ATOM 0 HB2 ASP A 130 134.582 -6.470 3.499 1.00 0.00 H new ATOM 0 HB3 ASP A 130 135.130 -5.160 4.525 1.00 0.00 H new ATOM 2033 N GLU A 131 132.823 -6.706 6.369 1.00 0.00 N ATOM 2034 CA GLU A 131 131.800 -6.080 7.241 1.00 0.00 C ATOM 2035 C GLU A 131 132.241 -6.164 8.704 1.00 0.00 C ATOM 2036 O GLU A 131 131.875 -5.341 9.504 1.00 0.00 O ATOM 2037 CB GLU A 131 130.472 -6.821 7.064 1.00 0.00 C ATOM 2038 CG GLU A 131 129.673 -6.188 5.922 1.00 0.00 C ATOM 2039 CD GLU A 131 128.638 -5.215 6.494 1.00 0.00 C ATOM 2040 OE1 GLU A 131 128.782 -4.837 7.645 1.00 0.00 O ATOM 2041 OE2 GLU A 131 127.721 -4.865 5.771 1.00 0.00 O ATOM 0 H GLU A 131 132.461 -7.400 5.715 1.00 0.00 H new ATOM 0 HA GLU A 131 131.679 -5.032 6.966 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.658 -7.873 6.850 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.896 -6.781 7.989 1.00 0.00 H new ATOM 0 HG2 GLU A 131 130.345 -5.662 5.243 1.00 0.00 H new ATOM 0 HG3 GLU A 131 129.175 -6.964 5.340 1.00 0.00 H new ATOM 2048 N LYS A 132 133.017 -7.150 9.065 1.00 0.00 N ATOM 2049 CA LYS A 132 133.460 -7.259 10.489 1.00 0.00 C ATOM 2050 C LYS A 132 134.363 -6.077 10.841 1.00 0.00 C ATOM 2051 O LYS A 132 134.120 -5.360 11.791 1.00 0.00 O ATOM 2052 CB LYS A 132 134.226 -8.565 10.689 1.00 0.00 C ATOM 2053 CG LYS A 132 133.526 -9.681 9.917 1.00 0.00 C ATOM 2054 CD LYS A 132 133.462 -10.944 10.776 1.00 0.00 C ATOM 2055 CE LYS A 132 133.057 -12.136 9.906 1.00 0.00 C ATOM 2056 NZ LYS A 132 133.441 -13.403 10.591 1.00 0.00 N ATOM 0 H LYS A 132 133.362 -7.881 8.443 1.00 0.00 H new ATOM 0 HA LYS A 132 132.585 -7.249 11.139 1.00 0.00 H new ATOM 0 HB2 LYS A 132 135.253 -8.455 10.341 1.00 0.00 H new ATOM 0 HB3 LYS A 132 134.273 -8.814 11.749 1.00 0.00 H new ATOM 0 HG2 LYS A 132 132.520 -9.368 9.639 1.00 0.00 H new ATOM 0 HG3 LYS A 132 134.063 -9.887 8.991 1.00 0.00 H new ATOM 0 HD2 LYS A 132 134.431 -11.131 11.239 1.00 0.00 H new ATOM 0 HD3 LYS A 132 132.743 -10.810 11.585 1.00 0.00 H new ATOM 0 HE2 LYS A 132 131.982 -12.119 9.725 1.00 0.00 H new ATOM 0 HE3 LYS A 132 133.545 -12.073 8.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 133.166 -14.214 10.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 134.470 -13.418 10.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 132.955 -13.463 11.509 1.00 0.00 H new ATOM 2070 N SER A 133 135.399 -5.859 10.083 1.00 0.00 N ATOM 2071 CA SER A 133 136.299 -4.712 10.380 1.00 0.00 C ATOM 2072 C SER A 133 135.604 -3.427 9.934 1.00 0.00 C ATOM 2073 O SER A 133 135.806 -2.364 10.492 1.00 0.00 O ATOM 2074 CB SER A 133 137.614 -4.878 9.618 1.00 0.00 C ATOM 2075 OG SER A 133 138.618 -4.085 10.236 1.00 0.00 O ATOM 0 H SER A 133 135.661 -6.422 9.274 1.00 0.00 H new ATOM 0 HA SER A 133 136.514 -4.671 11.448 1.00 0.00 H new ATOM 0 HB2 SER A 133 137.914 -5.926 9.612 1.00 0.00 H new ATOM 0 HB3 SER A 133 137.486 -4.577 8.578 1.00 0.00 H new ATOM 0 HG SER A 133 139.463 -4.190 9.751 1.00 0.00 H new ATOM 2081 N ALA A 134 134.778 -3.523 8.928 1.00 0.00 N ATOM 2082 CA ALA A 134 134.059 -2.321 8.435 1.00 0.00 C ATOM 2083 C ALA A 134 133.044 -1.867 9.486 1.00 0.00 C ATOM 2084 O ALA A 134 133.053 -0.729 9.912 1.00 0.00 O ATOM 2085 CB ALA A 134 133.339 -2.661 7.131 1.00 0.00 C ATOM 0 H ALA A 134 134.572 -4.387 8.427 1.00 0.00 H new ATOM 0 HA ALA A 134 134.771 -1.516 8.254 1.00 0.00 H new ATOM 0 HB1 ALA A 134 132.810 -1.780 6.767 1.00 0.00 H new ATOM 0 HB2 ALA A 134 134.067 -2.981 6.386 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.625 -3.465 7.309 1.00 0.00 H new ATOM 2091 N VAL A 135 132.172 -2.741 9.920 1.00 0.00 N ATOM 2092 CA VAL A 135 131.181 -2.329 10.952 1.00 0.00 C ATOM 2093 C VAL A 135 131.938 -1.748 12.143 1.00 0.00 C ATOM 2094 O VAL A 135 131.486 -0.831 12.794 1.00 0.00 O ATOM 2095 CB VAL A 135 130.336 -3.524 11.402 1.00 0.00 C ATOM 2096 CG1 VAL A 135 129.395 -3.942 10.266 1.00 0.00 C ATOM 2097 CG2 VAL A 135 131.249 -4.692 11.779 1.00 0.00 C ATOM 0 H VAL A 135 132.105 -3.710 9.608 1.00 0.00 H new ATOM 0 HA VAL A 135 130.508 -1.582 10.531 1.00 0.00 H new ATOM 0 HB VAL A 135 129.745 -3.241 12.273 1.00 0.00 H new ATOM 0 HG11 VAL A 135 128.793 -4.793 10.586 1.00 0.00 H new ATOM 0 HG12 VAL A 135 128.739 -3.109 10.012 1.00 0.00 H new ATOM 0 HG13 VAL A 135 129.982 -4.222 9.391 1.00 0.00 H new ATOM 0 HG21 VAL A 135 130.643 -5.539 12.098 1.00 0.00 H new ATOM 0 HG22 VAL A 135 131.848 -4.979 10.915 1.00 0.00 H new ATOM 0 HG23 VAL A 135 131.908 -4.390 12.593 1.00 0.00 H new ATOM 2107 N ARG A 136 133.100 -2.266 12.424 1.00 0.00 N ATOM 2108 CA ARG A 136 133.897 -1.730 13.561 1.00 0.00 C ATOM 2109 C ARG A 136 134.041 -0.217 13.385 1.00 0.00 C ATOM 2110 O ARG A 136 133.729 0.561 14.269 1.00 0.00 O ATOM 2111 CB ARG A 136 135.284 -2.383 13.544 1.00 0.00 C ATOM 2112 CG ARG A 136 136.031 -2.078 14.852 1.00 0.00 C ATOM 2113 CD ARG A 136 136.569 -3.378 15.472 1.00 0.00 C ATOM 2114 NE ARG A 136 138.042 -3.260 15.661 1.00 0.00 N ATOM 2115 CZ ARG A 136 138.711 -4.237 16.209 1.00 0.00 C ATOM 2116 NH1 ARG A 136 138.089 -5.320 16.590 1.00 0.00 N ATOM 2117 NH2 ARG A 136 140.001 -4.133 16.376 1.00 0.00 N ATOM 0 H ARG A 136 133.532 -3.037 11.916 1.00 0.00 H new ATOM 0 HA ARG A 136 133.404 -1.946 14.509 1.00 0.00 H new ATOM 0 HB2 ARG A 136 135.185 -3.461 13.416 1.00 0.00 H new ATOM 0 HB3 ARG A 136 135.858 -2.013 12.694 1.00 0.00 H new ATOM 0 HG2 ARG A 136 136.855 -1.391 14.657 1.00 0.00 H new ATOM 0 HG3 ARG A 136 135.361 -1.581 15.554 1.00 0.00 H new ATOM 0 HD2 ARG A 136 136.082 -3.567 16.429 1.00 0.00 H new ATOM 0 HD3 ARG A 136 136.340 -4.225 14.825 1.00 0.00 H new ATOM 0 HE ARG A 136 138.528 -2.415 15.362 1.00 0.00 H new ATOM 0 HH11 ARG A 136 137.081 -5.402 16.459 1.00 0.00 H new ATOM 0 HH12 ARG A 136 138.611 -6.084 17.018 1.00 0.00 H new ATOM 0 HH21 ARG A 136 140.487 -3.287 16.078 1.00 0.00 H new ATOM 0 HH22 ARG A 136 140.523 -4.897 16.805 1.00 0.00 H new ATOM 2131 N GLU A 137 134.506 0.202 12.241 1.00 0.00 N ATOM 2132 CA GLU A 137 134.675 1.659 11.981 1.00 0.00 C ATOM 2133 C GLU A 137 133.313 2.306 11.707 1.00 0.00 C ATOM 2134 O GLU A 137 133.114 3.476 11.960 1.00 0.00 O ATOM 2135 CB GLU A 137 135.584 1.856 10.766 1.00 0.00 C ATOM 2136 CG GLU A 137 136.939 1.196 11.030 1.00 0.00 C ATOM 2137 CD GLU A 137 138.030 1.947 10.264 1.00 0.00 C ATOM 2138 OE1 GLU A 137 137.732 2.461 9.199 1.00 0.00 O ATOM 2139 OE2 GLU A 137 139.146 1.994 10.756 1.00 0.00 O ATOM 0 H GLU A 137 134.778 -0.407 11.469 1.00 0.00 H new ATOM 0 HA GLU A 137 135.123 2.128 12.857 1.00 0.00 H new ATOM 0 HB2 GLU A 137 135.123 1.422 9.879 1.00 0.00 H new ATOM 0 HB3 GLU A 137 135.718 2.919 10.567 1.00 0.00 H new ATOM 0 HG2 GLU A 137 137.158 1.205 12.098 1.00 0.00 H new ATOM 0 HG3 GLU A 137 136.914 0.152 10.718 1.00 0.00 H new ATOM 2146 N ILE A 138 132.375 1.563 11.179 1.00 0.00 N ATOM 2147 CA ILE A 138 131.036 2.157 10.886 1.00 0.00 C ATOM 2148 C ILE A 138 130.308 2.447 12.202 1.00 0.00 C ATOM 2149 O ILE A 138 129.890 3.553 12.462 1.00 0.00 O ATOM 2150 CB ILE A 138 130.220 1.170 10.030 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.549 1.920 8.872 1.00 0.00 C ATOM 2152 CG2 ILE A 138 129.138 0.485 10.878 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.460 1.900 7.640 1.00 0.00 C ATOM 0 H ILE A 138 132.477 0.577 10.939 1.00 0.00 H new ATOM 0 HA ILE A 138 131.156 3.091 10.337 1.00 0.00 H new ATOM 0 HB ILE A 138 130.899 0.412 9.639 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.591 1.457 8.634 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.342 2.949 9.165 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.572 -0.208 10.255 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.608 -0.062 11.695 1.00 0.00 H new ATOM 0 HG23 ILE A 138 128.464 1.238 11.286 1.00 0.00 H new ATOM 0 HD11 ILE A 138 129.977 2.434 6.822 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.407 2.383 7.880 1.00 0.00 H new ATOM 0 HD13 ILE A 138 130.645 0.868 7.341 1.00 0.00 H new ATOM 2165 N ALA A 139 130.157 1.460 13.032 1.00 0.00 N ATOM 2166 CA ALA A 139 129.462 1.666 14.329 1.00 0.00 C ATOM 2167 C ALA A 139 130.122 2.820 15.078 1.00 0.00 C ATOM 2168 O ALA A 139 129.461 3.657 15.661 1.00 0.00 O ATOM 2169 CB ALA A 139 129.582 0.392 15.165 1.00 0.00 C ATOM 0 H ALA A 139 130.488 0.509 12.867 1.00 0.00 H new ATOM 0 HA ALA A 139 128.412 1.898 14.152 1.00 0.00 H new ATOM 0 HB1 ALA A 139 129.075 0.534 16.119 1.00 0.00 H new ATOM 0 HB2 ALA A 139 129.123 -0.439 14.630 1.00 0.00 H new ATOM 0 HB3 ALA A 139 130.634 0.171 15.343 1.00 0.00 H new ATOM 2175 N ARG A 140 131.423 2.864 15.074 1.00 0.00 N ATOM 2176 CA ARG A 140 132.133 3.954 15.795 1.00 0.00 C ATOM 2177 C ARG A 140 132.002 5.272 15.023 1.00 0.00 C ATOM 2178 O ARG A 140 131.718 6.308 15.592 1.00 0.00 O ATOM 2179 CB ARG A 140 133.613 3.585 15.924 1.00 0.00 C ATOM 2180 CG ARG A 140 133.811 2.681 17.143 1.00 0.00 C ATOM 2181 CD ARG A 140 134.212 3.529 18.351 1.00 0.00 C ATOM 2182 NE ARG A 140 135.579 4.084 18.136 1.00 0.00 N ATOM 2183 CZ ARG A 140 136.064 4.963 18.969 1.00 0.00 C ATOM 2184 NH1 ARG A 140 135.354 5.356 19.991 1.00 0.00 N ATOM 2185 NH2 ARG A 140 137.261 5.448 18.781 1.00 0.00 N ATOM 0 H ARG A 140 132.027 2.191 14.602 1.00 0.00 H new ATOM 0 HA ARG A 140 131.691 4.079 16.784 1.00 0.00 H new ATOM 0 HB2 ARG A 140 133.951 3.076 15.022 1.00 0.00 H new ATOM 0 HB3 ARG A 140 134.216 4.487 16.026 1.00 0.00 H new ATOM 0 HG2 ARG A 140 132.892 2.136 17.358 1.00 0.00 H new ATOM 0 HG3 ARG A 140 134.581 1.938 16.936 1.00 0.00 H new ATOM 0 HD2 ARG A 140 133.497 4.339 18.494 1.00 0.00 H new ATOM 0 HD3 ARG A 140 134.192 2.923 19.257 1.00 0.00 H new ATOM 0 HE ARG A 140 136.135 3.777 17.338 1.00 0.00 H new ATOM 0 HH11 ARG A 140 134.419 4.976 20.139 1.00 0.00 H new ATOM 0 HH12 ARG A 140 135.734 6.043 20.642 1.00 0.00 H new ATOM 0 HH21 ARG A 140 137.817 5.140 17.983 1.00 0.00 H new ATOM 0 HH22 ARG A 140 137.641 6.135 19.432 1.00 0.00 H new ATOM 2199 N SER A 141 132.215 5.247 13.735 1.00 0.00 N ATOM 2200 CA SER A 141 132.112 6.503 12.936 1.00 0.00 C ATOM 2201 C SER A 141 130.687 7.053 13.019 1.00 0.00 C ATOM 2202 O SER A 141 130.478 8.228 13.244 1.00 0.00 O ATOM 2203 CB SER A 141 132.458 6.206 11.477 1.00 0.00 C ATOM 2204 OG SER A 141 133.859 5.992 11.360 1.00 0.00 O ATOM 0 H SER A 141 132.456 4.412 13.201 1.00 0.00 H new ATOM 0 HA SER A 141 132.807 7.242 13.334 1.00 0.00 H new ATOM 0 HB2 SER A 141 131.914 5.326 11.134 1.00 0.00 H new ATOM 0 HB3 SER A 141 132.151 7.037 10.842 1.00 0.00 H new ATOM 0 HG SER A 141 134.061 5.049 11.531 1.00 0.00 H new ATOM 2210 N LEU A 142 129.706 6.213 12.845 1.00 0.00 N ATOM 2211 CA LEU A 142 128.298 6.687 12.920 1.00 0.00 C ATOM 2212 C LEU A 142 127.847 6.675 14.383 1.00 0.00 C ATOM 2213 O LEU A 142 127.584 7.709 14.965 1.00 0.00 O ATOM 2214 CB LEU A 142 127.399 5.768 12.087 1.00 0.00 C ATOM 2215 CG LEU A 142 128.114 5.379 10.791 1.00 0.00 C ATOM 2216 CD1 LEU A 142 127.276 4.345 10.042 1.00 0.00 C ATOM 2217 CD2 LEU A 142 128.291 6.614 9.908 1.00 0.00 C ATOM 0 H LEU A 142 129.819 5.217 12.654 1.00 0.00 H new ATOM 0 HA LEU A 142 128.227 7.700 12.525 1.00 0.00 H new ATOM 0 HB2 LEU A 142 127.149 4.874 12.658 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.460 6.272 11.858 1.00 0.00 H new ATOM 0 HG LEU A 142 129.091 4.961 11.031 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.783 4.066 9.118 1.00 0.00 H new ATOM 0 HD12 LEU A 142 127.146 3.461 10.666 1.00 0.00 H new ATOM 0 HD13 LEU A 142 126.300 4.769 9.806 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.800 6.332 8.986 1.00 0.00 H new ATOM 0 HD22 LEU A 142 127.314 7.033 9.669 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.885 7.358 10.438 1.00 0.00 H new ATOM 2229 N GLY A 143 127.770 5.521 14.992 1.00 0.00 N ATOM 2230 CA GLY A 143 127.353 5.475 16.423 1.00 0.00 C ATOM 2231 C GLY A 143 126.614 4.169 16.739 1.00 0.00 C ATOM 2232 O GLY A 143 125.658 4.163 17.489 1.00 0.00 O ATOM 0 H GLY A 143 127.976 4.618 14.565 1.00 0.00 H new ATOM 0 HA2 GLY A 143 128.230 5.565 17.064 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.708 6.325 16.645 1.00 0.00 H new ATOM 2236 N PHE A 144 127.045 3.059 16.195 1.00 0.00 N ATOM 2237 CA PHE A 144 126.349 1.771 16.503 1.00 0.00 C ATOM 2238 C PHE A 144 127.275 0.871 17.323 1.00 0.00 C ATOM 2239 O PHE A 144 128.243 1.324 17.897 1.00 0.00 O ATOM 2240 CB PHE A 144 125.960 1.042 15.213 1.00 0.00 C ATOM 2241 CG PHE A 144 125.520 2.029 14.161 1.00 0.00 C ATOM 2242 CD1 PHE A 144 124.840 3.195 14.526 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.789 1.767 12.813 1.00 0.00 C ATOM 2244 CE1 PHE A 144 124.431 4.102 13.542 1.00 0.00 C ATOM 2245 CE2 PHE A 144 125.379 2.672 11.829 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.700 3.841 12.193 1.00 0.00 C ATOM 0 H PHE A 144 127.839 2.987 15.558 1.00 0.00 H new ATOM 0 HA PHE A 144 125.445 1.996 17.069 1.00 0.00 H new ATOM 0 HB2 PHE A 144 126.808 0.463 14.846 1.00 0.00 H new ATOM 0 HB3 PHE A 144 125.156 0.335 15.416 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.631 3.395 15.566 1.00 0.00 H new ATOM 0 HD2 PHE A 144 126.313 0.866 12.532 1.00 0.00 H new ATOM 0 HE1 PHE A 144 123.908 5.004 13.823 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.586 2.469 10.789 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.384 4.541 11.434 1.00 0.00 H new ATOM 2256 N ASP A 145 126.983 -0.404 17.378 1.00 0.00 N ATOM 2257 CA ASP A 145 127.845 -1.342 18.158 1.00 0.00 C ATOM 2258 C ASP A 145 129.240 -1.392 17.525 1.00 0.00 C ATOM 2259 O ASP A 145 129.412 -1.905 16.437 1.00 0.00 O ATOM 2260 CB ASP A 145 127.225 -2.741 18.128 1.00 0.00 C ATOM 2261 CG ASP A 145 126.248 -2.892 19.295 1.00 0.00 C ATOM 2262 OD1 ASP A 145 126.584 -2.455 20.384 1.00 0.00 O ATOM 2263 OD2 ASP A 145 125.180 -3.441 19.081 1.00 0.00 O ATOM 0 H ASP A 145 126.183 -0.836 16.915 1.00 0.00 H new ATOM 0 HA ASP A 145 127.923 -0.998 19.189 1.00 0.00 H new ATOM 0 HB2 ASP A 145 126.706 -2.900 17.183 1.00 0.00 H new ATOM 0 HB3 ASP A 145 128.006 -3.498 18.194 1.00 0.00 H new ATOM 2268 N PRO A 146 130.229 -0.855 18.193 1.00 0.00 N ATOM 2269 CA PRO A 146 131.626 -0.831 17.676 1.00 0.00 C ATOM 2270 C PRO A 146 132.120 -2.206 17.213 1.00 0.00 C ATOM 2271 O PRO A 146 132.841 -2.884 17.918 1.00 0.00 O ATOM 2272 CB PRO A 146 132.457 -0.351 18.868 1.00 0.00 C ATOM 2273 CG PRO A 146 131.510 0.398 19.741 1.00 0.00 C ATOM 2274 CD PRO A 146 130.127 -0.210 19.513 1.00 0.00 C ATOM 0 HA PRO A 146 131.703 -0.191 16.797 1.00 0.00 H new ATOM 0 HB2 PRO A 146 132.900 -1.192 19.401 1.00 0.00 H new ATOM 0 HB3 PRO A 146 133.278 0.287 18.542 1.00 0.00 H new ATOM 0 HG2 PRO A 146 131.801 0.315 20.788 1.00 0.00 H new ATOM 0 HG3 PRO A 146 131.512 1.459 19.493 1.00 0.00 H new ATOM 0 HD2 PRO A 146 129.876 -0.932 20.290 1.00 0.00 H new ATOM 0 HD3 PRO A 146 129.349 0.554 19.524 1.00 0.00 H new ATOM 2282 N ALA A 147 131.758 -2.615 16.027 1.00 0.00 N ATOM 2283 CA ALA A 147 132.231 -3.931 15.517 1.00 0.00 C ATOM 2284 C ALA A 147 131.406 -5.067 16.112 1.00 0.00 C ATOM 2285 O ALA A 147 131.351 -5.241 17.312 1.00 0.00 O ATOM 2286 CB ALA A 147 133.693 -4.130 15.906 1.00 0.00 C ATOM 0 H ALA A 147 131.155 -2.094 15.390 1.00 0.00 H new ATOM 0 HA ALA A 147 132.122 -3.941 14.433 1.00 0.00 H new ATOM 0 HB1 ALA A 147 134.041 -5.093 15.533 1.00 0.00 H new ATOM 0 HB2 ALA A 147 134.297 -3.333 15.471 1.00 0.00 H new ATOM 0 HB3 ALA A 147 133.787 -4.106 16.992 1.00 0.00 H new ATOM 2292 N GLU A 148 130.786 -5.858 15.280 1.00 0.00 N ATOM 2293 CA GLU A 148 129.990 -7.001 15.805 1.00 0.00 C ATOM 2294 C GLU A 148 129.004 -7.498 14.739 1.00 0.00 C ATOM 2295 O GLU A 148 127.932 -7.974 15.058 1.00 0.00 O ATOM 2296 CB GLU A 148 129.211 -6.557 17.052 1.00 0.00 C ATOM 2297 CG GLU A 148 129.901 -7.083 18.316 1.00 0.00 C ATOM 2298 CD GLU A 148 129.742 -6.065 19.446 1.00 0.00 C ATOM 2299 OE1 GLU A 148 128.681 -6.039 20.048 1.00 0.00 O ATOM 2300 OE2 GLU A 148 130.683 -5.329 19.691 1.00 0.00 O ATOM 0 H GLU A 148 130.796 -5.763 14.265 1.00 0.00 H new ATOM 0 HA GLU A 148 130.670 -7.812 16.065 1.00 0.00 H new ATOM 0 HB2 GLU A 148 129.152 -5.469 17.086 1.00 0.00 H new ATOM 0 HB3 GLU A 148 128.188 -6.930 17.004 1.00 0.00 H new ATOM 0 HG2 GLU A 148 129.466 -8.039 18.609 1.00 0.00 H new ATOM 0 HG3 GLU A 148 130.958 -7.261 18.119 1.00 0.00 H new ATOM 2307 N PHE A 149 129.341 -7.396 13.478 1.00 0.00 N ATOM 2308 CA PHE A 149 128.393 -7.871 12.426 1.00 0.00 C ATOM 2309 C PHE A 149 129.084 -8.892 11.519 1.00 0.00 C ATOM 2310 O PHE A 149 129.335 -10.014 11.911 1.00 0.00 O ATOM 2311 CB PHE A 149 127.924 -6.682 11.589 1.00 0.00 C ATOM 2312 CG PHE A 149 127.430 -5.589 12.505 1.00 0.00 C ATOM 2313 CD1 PHE A 149 128.322 -4.946 13.370 1.00 0.00 C ATOM 2314 CD2 PHE A 149 126.080 -5.221 12.492 1.00 0.00 C ATOM 2315 CE1 PHE A 149 127.868 -3.936 14.220 1.00 0.00 C ATOM 2316 CE2 PHE A 149 125.625 -4.209 13.345 1.00 0.00 C ATOM 2317 CZ PHE A 149 126.520 -3.567 14.209 1.00 0.00 C ATOM 0 H PHE A 149 130.220 -7.009 13.135 1.00 0.00 H new ATOM 0 HA PHE A 149 127.536 -8.343 12.906 1.00 0.00 H new ATOM 0 HB2 PHE A 149 128.743 -6.312 10.972 1.00 0.00 H new ATOM 0 HB3 PHE A 149 127.128 -6.991 10.911 1.00 0.00 H new ATOM 0 HD1 PHE A 149 129.364 -5.231 13.380 1.00 0.00 H new ATOM 0 HD2 PHE A 149 125.390 -5.717 11.825 1.00 0.00 H new ATOM 0 HE1 PHE A 149 128.558 -3.440 14.886 1.00 0.00 H new ATOM 0 HE2 PHE A 149 124.583 -3.923 13.337 1.00 0.00 H new ATOM 0 HZ PHE A 149 126.169 -2.786 14.867 1.00 0.00 H new ATOM 2327 N GLY A 150 129.389 -8.513 10.308 1.00 0.00 N ATOM 2328 CA GLY A 150 130.057 -9.463 9.377 1.00 0.00 C ATOM 2329 C GLY A 150 129.003 -10.248 8.593 1.00 0.00 C ATOM 2330 O GLY A 150 129.305 -11.231 7.946 1.00 0.00 O ATOM 0 H GLY A 150 129.204 -7.586 9.924 1.00 0.00 H new ATOM 0 HA2 GLY A 150 130.704 -8.918 8.689 1.00 0.00 H new ATOM 0 HA3 GLY A 150 130.693 -10.149 9.937 1.00 0.00 H new