USER MOD reduce.3.24.130724 H: found=0, std=0, add=944, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 945 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 114 ASN : amide:sc= 0.596 K(o=0.6,f=-7!) USER MOD Set 1.2: A 116 GLN : amide:sc= 0 K(o=0.6,f=-3.5!) USER MOD Set 2.1: A 29 SER OG : rot -170:sc= -0.0156 USER MOD Set 2.2: A 94 LYS NZ :NH3+ -147:sc= -0.468 (180deg=-1.08) USER MOD Set 3.1: A 27 SER OG : rot 67:sc= 0.522 USER MOD Set 3.2: A 40 MET CE :methyl 146:sc= -0.868 (180deg=-1.65) USER MOD Set 4.1: A 16 ASN : amide:sc= 0.993 K(o=-1.9,f=-18!) USER MOD Set 4.2: A 19 MET CE :methyl 154:sc= -1.81 (180deg=-3.48!) USER MOD Set 4.3: A 20 LYS NZ :NH3+ -160:sc= 1.17 (180deg=0) USER MOD Set 4.4: A 48 MET CE :methyl 152:sc= -2.25 (180deg=-2.52!) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.03 K(o=-0.03,f=-8.6!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 140:sc= 0.144 (180deg=-0.285) USER MOD Single : A 24 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 35 GLN : amide:sc= -0.296 X(o=-0.3,f=-0.3) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 71:sc= 0.813 USER MOD Single : A 47 MET CE :methyl 176:sc= 0 (180deg=-0.0285) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.602 X(o=-0.6,f=-0.26) USER MOD Single : A 68 MET CE :methyl -110:sc= -0.602 (180deg=-3.17!) USER MOD Single : A 69 ASN : amide:sc= 0.646 K(o=0.65,f=0) USER MOD Single : A 70 MET CE :methyl 132:sc= -0.062 (180deg=-0.631) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 75:sc= 0.289 USER MOD Single : A 76 MET CE :methyl -175:sc= 0 (180deg=-0.0386) USER MOD Single : A 86 ASN : amide:sc= 1.12 K(o=1.1,f=-0.4) USER MOD Single : A 87 ASN : amide:sc= -0.154 K(o=-0.15,f=-6.9!) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 62:sc= 1.24 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.0489 K(o=-0.049,f=-1.5!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 108 SER OG : rot 81:sc= 0.00643 USER MOD Single : A 109 THR OG1 : rot -62:sc= 1.17 USER MOD Single : A 110 MET CE :methyl 152:sc= -0.162 (180deg=-1.3) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 69:sc= 0.779 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= -0.0139 X(o=-0.014,f=-0.33) USER MOD Single : A 125 MET CE :methyl 142:sc= -0.0801 (180deg=-0.722) USER MOD Single : A 126 THR OG1 : rot 73:sc= 0.717 USER MOD Single : A 127 MET CE :methyl 163:sc= -0.234 (180deg=-0.644) USER MOD Single : A 134 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 82 N SER A 7 3.102 0.825 -4.973 1.00 0.00 N ATOM 83 CA SER A 7 3.973 1.967 -5.065 1.00 0.00 C ATOM 84 C SER A 7 4.852 1.767 -6.262 1.00 0.00 C ATOM 85 O SER A 7 5.183 0.638 -6.621 1.00 0.00 O ATOM 86 CB SER A 7 4.882 2.124 -3.829 1.00 0.00 C ATOM 87 OG SER A 7 4.117 2.521 -2.697 1.00 0.00 O ATOM 0 HA SER A 7 3.354 2.861 -5.137 1.00 0.00 H new ATOM 0 HB2 SER A 7 5.389 1.182 -3.621 1.00 0.00 H new ATOM 0 HB3 SER A 7 5.656 2.865 -4.031 1.00 0.00 H new ATOM 0 HG SER A 7 4.707 2.615 -1.920 1.00 0.00 H new ATOM 93 N PRO A 8 5.236 2.857 -6.896 1.00 0.00 N ATOM 94 CA PRO A 8 6.106 2.804 -8.043 1.00 0.00 C ATOM 95 C PRO A 8 7.557 2.872 -7.667 1.00 0.00 C ATOM 96 O PRO A 8 8.245 1.857 -7.643 1.00 0.00 O ATOM 97 CB PRO A 8 5.686 4.018 -8.880 1.00 0.00 C ATOM 98 CG PRO A 8 5.049 5.001 -7.886 1.00 0.00 C ATOM 99 CD PRO A 8 4.844 4.231 -6.572 1.00 0.00 C ATOM 0 HA PRO A 8 6.010 1.862 -8.583 1.00 0.00 H new ATOM 0 HB2 PRO A 8 6.545 4.466 -9.380 1.00 0.00 H new ATOM 0 HB3 PRO A 8 4.978 3.732 -9.658 1.00 0.00 H new ATOM 0 HG2 PRO A 8 5.693 5.866 -7.731 1.00 0.00 H new ATOM 0 HG3 PRO A 8 4.099 5.375 -8.267 1.00 0.00 H new ATOM 0 HD2 PRO A 8 5.457 4.642 -5.770 1.00 0.00 H new ATOM 0 HD3 PRO A 8 3.808 4.281 -6.238 1.00 0.00 H new ATOM 107 N TRP A 9 8.058 4.087 -7.348 1.00 0.00 N ATOM 108 CA TRP A 9 9.445 4.232 -6.982 1.00 0.00 C ATOM 109 C TRP A 9 9.555 4.165 -5.482 1.00 0.00 C ATOM 110 O TRP A 9 10.656 4.105 -4.937 1.00 0.00 O ATOM 111 CB TRP A 9 10.043 5.578 -7.429 1.00 0.00 C ATOM 112 CG TRP A 9 9.938 5.814 -8.919 1.00 0.00 C ATOM 113 CD1 TRP A 9 10.804 5.425 -9.901 1.00 0.00 C ATOM 114 CD2 TRP A 9 8.876 6.531 -9.585 1.00 0.00 C ATOM 115 NE1 TRP A 9 10.349 5.844 -11.120 1.00 0.00 N ATOM 116 CE2 TRP A 9 9.171 6.522 -10.945 1.00 0.00 C ATOM 117 CE3 TRP A 9 7.745 7.146 -9.130 1.00 0.00 C ATOM 118 CZ2 TRP A 9 8.353 7.121 -11.855 1.00 0.00 C ATOM 119 CZ3 TRP A 9 6.914 7.753 -10.047 1.00 0.00 C ATOM 120 CH2 TRP A 9 7.213 7.742 -11.393 1.00 0.00 C ATOM 0 H TRP A 9 7.518 4.952 -7.342 1.00 0.00 H new ATOM 0 HA TRP A 9 9.994 3.432 -7.478 1.00 0.00 H new ATOM 0 HB2 TRP A 9 9.534 6.386 -6.903 1.00 0.00 H new ATOM 0 HB3 TRP A 9 11.092 5.617 -7.135 1.00 0.00 H new ATOM 0 HD1 TRP A 9 11.715 4.868 -9.738 1.00 0.00 H new ATOM 0 HE1 TRP A 9 10.811 5.679 -12.014 1.00 0.00 H new ATOM 0 HE3 TRP A 9 7.507 7.157 -8.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 8.591 7.109 -12.908 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 6.015 8.245 -9.706 1.00 0.00 H new ATOM 0 HH2 TRP A 9 6.547 8.225 -12.092 1.00 0.00 H new ATOM 131 N ALA A 10 8.404 4.175 -4.776 1.00 0.00 N ATOM 132 CA ALA A 10 8.429 4.134 -3.331 1.00 0.00 C ATOM 133 C ALA A 10 8.477 2.700 -2.883 1.00 0.00 C ATOM 134 O ALA A 10 8.641 2.425 -1.696 1.00 0.00 O ATOM 135 CB ALA A 10 7.197 4.799 -2.687 1.00 0.00 C ATOM 0 H ALA A 10 7.472 4.211 -5.189 1.00 0.00 H new ATOM 0 HA ALA A 10 9.311 4.689 -3.012 1.00 0.00 H new ATOM 0 HB1 ALA A 10 7.275 4.736 -1.602 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.150 5.846 -2.987 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.293 4.286 -3.016 1.00 0.00 H new ATOM 141 N ASN A 11 8.326 1.743 -3.823 1.00 0.00 N ATOM 142 CA ASN A 11 8.362 0.350 -3.458 1.00 0.00 C ATOM 143 C ASN A 11 9.800 -0.082 -3.608 1.00 0.00 C ATOM 144 O ASN A 11 10.331 -0.111 -4.717 1.00 0.00 O ATOM 145 CB ASN A 11 7.492 -0.534 -4.384 1.00 0.00 C ATOM 146 CG ASN A 11 7.411 -1.985 -3.924 1.00 0.00 C ATOM 147 OD1 ASN A 11 8.226 -2.453 -3.137 1.00 0.00 O ATOM 148 ND2 ASN A 11 6.397 -2.726 -4.435 1.00 0.00 N ATOM 0 H ASN A 11 8.182 1.925 -4.816 1.00 0.00 H new ATOM 0 HA ASN A 11 7.973 0.233 -2.447 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.486 -0.118 -4.433 1.00 0.00 H new ATOM 0 HB3 ASN A 11 7.899 -0.502 -5.394 1.00 0.00 H new ATOM 0 HD21 ASN A 11 6.295 -3.705 -4.166 1.00 0.00 H new ATOM 0 HD22 ASN A 11 5.736 -2.305 -5.088 1.00 0.00 H new ATOM 155 N PRO A 12 10.444 -0.430 -2.511 1.00 0.00 N ATOM 156 CA PRO A 12 11.836 -0.852 -2.557 1.00 0.00 C ATOM 157 C PRO A 12 12.028 -2.148 -3.280 1.00 0.00 C ATOM 158 O PRO A 12 13.075 -2.387 -3.877 1.00 0.00 O ATOM 159 CB PRO A 12 12.249 -0.982 -1.087 1.00 0.00 C ATOM 160 CG PRO A 12 10.938 -1.224 -0.347 1.00 0.00 C ATOM 161 CD PRO A 12 9.888 -0.458 -1.151 1.00 0.00 C ATOM 0 HA PRO A 12 12.443 -0.134 -3.109 1.00 0.00 H new ATOM 0 HB2 PRO A 12 12.946 -1.807 -0.941 1.00 0.00 H new ATOM 0 HB3 PRO A 12 12.745 -0.079 -0.732 1.00 0.00 H new ATOM 0 HG2 PRO A 12 10.701 -2.287 -0.299 1.00 0.00 H new ATOM 0 HG3 PRO A 12 10.991 -0.863 0.680 1.00 0.00 H new ATOM 0 HD2 PRO A 12 8.920 -0.958 -1.124 1.00 0.00 H new ATOM 0 HD3 PRO A 12 9.738 0.548 -0.759 1.00 0.00 H new ATOM 169 N LYS A 13 11.003 -3.023 -3.239 1.00 0.00 N ATOM 170 CA LYS A 13 11.093 -4.293 -3.909 1.00 0.00 C ATOM 171 C LYS A 13 11.045 -4.041 -5.390 1.00 0.00 C ATOM 172 O LYS A 13 11.805 -4.632 -6.159 1.00 0.00 O ATOM 173 CB LYS A 13 9.937 -5.246 -3.540 1.00 0.00 C ATOM 174 CG LYS A 13 10.094 -6.644 -4.148 1.00 0.00 C ATOM 175 CD LYS A 13 11.299 -7.395 -3.576 1.00 0.00 C ATOM 176 CE LYS A 13 11.400 -8.829 -4.098 1.00 0.00 C ATOM 177 NZ LYS A 13 12.574 -9.507 -3.508 1.00 0.00 N ATOM 0 H LYS A 13 10.123 -2.858 -2.750 1.00 0.00 H new ATOM 0 HA LYS A 13 12.023 -4.770 -3.600 1.00 0.00 H new ATOM 0 HB2 LYS A 13 9.878 -5.333 -2.455 1.00 0.00 H new ATOM 0 HB3 LYS A 13 8.995 -4.813 -3.877 1.00 0.00 H new ATOM 0 HG2 LYS A 13 9.188 -7.222 -3.964 1.00 0.00 H new ATOM 0 HG3 LYS A 13 10.203 -6.557 -5.229 1.00 0.00 H new ATOM 0 HD2 LYS A 13 12.212 -6.855 -3.828 1.00 0.00 H new ATOM 0 HD3 LYS A 13 11.229 -7.412 -2.488 1.00 0.00 H new ATOM 0 HE2 LYS A 13 10.492 -9.378 -3.851 1.00 0.00 H new ATOM 0 HE3 LYS A 13 11.483 -8.823 -5.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 12.631 -10.480 -3.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 13.439 -8.990 -3.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 12.479 -9.528 -2.473 1.00 0.00 H new ATOM 191 N LYS A 14 10.135 -3.134 -5.830 1.00 0.00 N ATOM 192 CA LYS A 14 10.013 -2.840 -7.237 1.00 0.00 C ATOM 193 C LYS A 14 11.237 -2.089 -7.675 1.00 0.00 C ATOM 194 O LYS A 14 11.757 -2.311 -8.767 1.00 0.00 O ATOM 195 CB LYS A 14 8.779 -1.985 -7.572 1.00 0.00 C ATOM 196 CG LYS A 14 8.527 -1.871 -9.079 1.00 0.00 C ATOM 197 CD LYS A 14 7.304 -1.011 -9.398 1.00 0.00 C ATOM 198 CE LYS A 14 6.001 -1.665 -8.941 1.00 0.00 C ATOM 199 NZ LYS A 14 4.844 -0.824 -9.315 1.00 0.00 N ATOM 0 H LYS A 14 9.498 -2.615 -5.226 1.00 0.00 H new ATOM 0 HA LYS A 14 9.904 -3.792 -7.757 1.00 0.00 H new ATOM 0 HB2 LYS A 14 7.901 -2.419 -7.093 1.00 0.00 H new ATOM 0 HB3 LYS A 14 8.910 -0.987 -7.154 1.00 0.00 H new ATOM 0 HG2 LYS A 14 9.406 -1.442 -9.561 1.00 0.00 H new ATOM 0 HG3 LYS A 14 8.388 -2.867 -9.498 1.00 0.00 H new ATOM 0 HD2 LYS A 14 7.409 -0.040 -8.915 1.00 0.00 H new ATOM 0 HD3 LYS A 14 7.260 -0.830 -10.472 1.00 0.00 H new ATOM 0 HE2 LYS A 14 5.903 -2.652 -9.394 1.00 0.00 H new ATOM 0 HE3 LYS A 14 6.019 -1.811 -7.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 4.066 -1.431 -9.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 4.531 -0.277 -8.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 5.120 -0.172 -10.077 1.00 0.00 H new ATOM 213 N ALA A 15 11.718 -1.164 -6.818 1.00 0.00 N ATOM 214 CA ALA A 15 12.885 -0.378 -7.146 1.00 0.00 C ATOM 215 C ALA A 15 14.062 -1.294 -7.337 1.00 0.00 C ATOM 216 O ALA A 15 14.863 -1.085 -8.238 1.00 0.00 O ATOM 217 CB ALA A 15 13.249 0.644 -6.053 1.00 0.00 C ATOM 0 H ALA A 15 11.308 -0.958 -5.907 1.00 0.00 H new ATOM 0 HA ALA A 15 12.647 0.172 -8.056 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.134 1.203 -6.358 1.00 0.00 H new ATOM 0 HB2 ALA A 15 12.417 1.333 -5.907 1.00 0.00 H new ATOM 0 HB3 ALA A 15 13.455 0.120 -5.119 1.00 0.00 H new ATOM 223 N ASN A 16 14.209 -2.324 -6.473 1.00 0.00 N ATOM 224 CA ASN A 16 15.307 -3.252 -6.598 1.00 0.00 C ATOM 225 C ASN A 16 15.198 -3.990 -7.912 1.00 0.00 C ATOM 226 O ASN A 16 16.188 -4.154 -8.614 1.00 0.00 O ATOM 227 CB ASN A 16 15.329 -4.291 -5.455 1.00 0.00 C ATOM 228 CG ASN A 16 16.594 -5.142 -5.454 1.00 0.00 C ATOM 229 OD1 ASN A 16 17.676 -4.669 -5.780 1.00 0.00 O ATOM 230 ND2 ASN A 16 16.456 -6.435 -5.073 1.00 0.00 N ATOM 0 H ASN A 16 13.577 -2.515 -5.696 1.00 0.00 H new ATOM 0 HA ASN A 16 16.227 -2.670 -6.550 1.00 0.00 H new ATOM 0 HB2 ASN A 16 15.243 -3.774 -4.499 1.00 0.00 H new ATOM 0 HB3 ASN A 16 14.459 -4.942 -5.545 1.00 0.00 H new ATOM 0 HD21 ASN A 16 17.270 -7.050 -5.051 1.00 0.00 H new ATOM 0 HD22 ASN A 16 15.539 -6.794 -4.808 1.00 0.00 H new ATOM 237 N ALA A 17 13.981 -4.456 -8.277 1.00 0.00 N ATOM 238 CA ALA A 17 13.815 -5.190 -9.517 1.00 0.00 C ATOM 239 C ALA A 17 14.130 -4.290 -10.689 1.00 0.00 C ATOM 240 O ALA A 17 14.792 -4.702 -11.641 1.00 0.00 O ATOM 241 CB ALA A 17 12.383 -5.726 -9.704 1.00 0.00 C ATOM 0 H ALA A 17 13.127 -4.332 -7.733 1.00 0.00 H new ATOM 0 HA ALA A 17 14.498 -6.038 -9.469 1.00 0.00 H new ATOM 0 HB1 ALA A 17 12.317 -6.267 -10.648 1.00 0.00 H new ATOM 0 HB2 ALA A 17 12.136 -6.399 -8.883 1.00 0.00 H new ATOM 0 HB3 ALA A 17 11.681 -4.892 -9.714 1.00 0.00 H new ATOM 247 N PHE A 18 13.648 -3.032 -10.634 1.00 0.00 N ATOM 248 CA PHE A 18 13.877 -2.085 -11.705 1.00 0.00 C ATOM 249 C PHE A 18 15.351 -1.780 -11.778 1.00 0.00 C ATOM 250 O PHE A 18 15.944 -1.709 -12.850 1.00 0.00 O ATOM 251 CB PHE A 18 13.116 -0.765 -11.472 1.00 0.00 C ATOM 252 CG PHE A 18 13.159 0.172 -12.629 1.00 0.00 C ATOM 253 CD1 PHE A 18 12.670 -0.225 -13.845 1.00 0.00 C ATOM 254 CD2 PHE A 18 13.673 1.440 -12.492 1.00 0.00 C ATOM 255 CE1 PHE A 18 12.689 0.631 -14.920 1.00 0.00 C ATOM 256 CE2 PHE A 18 13.696 2.297 -13.565 1.00 0.00 C ATOM 257 CZ PHE A 18 13.204 1.893 -14.779 1.00 0.00 C ATOM 0 H PHE A 18 13.101 -2.664 -9.855 1.00 0.00 H new ATOM 0 HA PHE A 18 13.518 -2.531 -12.633 1.00 0.00 H new ATOM 0 HB2 PHE A 18 12.075 -0.993 -11.241 1.00 0.00 H new ATOM 0 HB3 PHE A 18 13.534 -0.266 -10.598 1.00 0.00 H new ATOM 0 HD1 PHE A 18 12.266 -1.220 -13.960 1.00 0.00 H new ATOM 0 HD2 PHE A 18 14.060 1.763 -11.537 1.00 0.00 H new ATOM 0 HE1 PHE A 18 12.299 0.310 -15.874 1.00 0.00 H new ATOM 0 HE2 PHE A 18 14.103 3.291 -13.452 1.00 0.00 H new ATOM 0 HZ PHE A 18 13.222 2.568 -15.622 1.00 0.00 H new ATOM 267 N MET A 19 15.957 -1.585 -10.606 1.00 0.00 N ATOM 268 CA MET A 19 17.363 -1.282 -10.505 1.00 0.00 C ATOM 269 C MET A 19 18.176 -2.403 -11.097 1.00 0.00 C ATOM 270 O MET A 19 19.083 -2.170 -11.893 1.00 0.00 O ATOM 271 CB MET A 19 17.788 -1.101 -9.039 1.00 0.00 C ATOM 272 CG MET A 19 19.293 -0.921 -8.860 1.00 0.00 C ATOM 273 SD MET A 19 19.740 -0.474 -7.160 1.00 0.00 S ATOM 274 CE MET A 19 19.011 -1.964 -6.414 1.00 0.00 C ATOM 0 H MET A 19 15.477 -1.635 -9.708 1.00 0.00 H new ATOM 0 HA MET A 19 17.539 -0.354 -11.049 1.00 0.00 H new ATOM 0 HB2 MET A 19 17.274 -0.234 -8.624 1.00 0.00 H new ATOM 0 HB3 MET A 19 17.463 -1.969 -8.465 1.00 0.00 H new ATOM 0 HG2 MET A 19 19.802 -1.845 -9.135 1.00 0.00 H new ATOM 0 HG3 MET A 19 19.647 -0.147 -9.541 1.00 0.00 H new ATOM 0 HE1 MET A 19 19.517 -2.186 -5.475 1.00 0.00 H new ATOM 0 HE2 MET A 19 17.951 -1.794 -6.224 1.00 0.00 H new ATOM 0 HE3 MET A 19 19.127 -2.806 -7.096 1.00 0.00 H new ATOM 284 N LYS A 20 17.855 -3.659 -10.726 1.00 0.00 N ATOM 285 CA LYS A 20 18.602 -4.798 -11.209 1.00 0.00 C ATOM 286 C LYS A 20 18.473 -4.933 -12.697 1.00 0.00 C ATOM 287 O LYS A 20 19.446 -5.256 -13.370 1.00 0.00 O ATOM 288 CB LYS A 20 18.135 -6.125 -10.588 1.00 0.00 C ATOM 289 CG LYS A 20 18.503 -6.241 -9.111 1.00 0.00 C ATOM 290 CD LYS A 20 20.000 -6.495 -8.895 1.00 0.00 C ATOM 291 CE LYS A 20 20.352 -6.758 -7.429 1.00 0.00 C ATOM 292 NZ LYS A 20 20.219 -5.518 -6.632 1.00 0.00 N ATOM 0 H LYS A 20 17.086 -3.891 -10.097 1.00 0.00 H new ATOM 0 HA LYS A 20 19.636 -4.610 -10.919 1.00 0.00 H new ATOM 0 HB2 LYS A 20 17.054 -6.213 -10.698 1.00 0.00 H new ATOM 0 HB3 LYS A 20 18.580 -6.955 -11.136 1.00 0.00 H new ATOM 0 HG2 LYS A 20 18.216 -5.325 -8.596 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.932 -7.053 -8.661 1.00 0.00 H new ATOM 0 HD2 LYS A 20 20.309 -7.349 -9.497 1.00 0.00 H new ATOM 0 HD3 LYS A 20 20.565 -5.633 -9.251 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.696 -7.529 -7.024 1.00 0.00 H new ATOM 0 HE3 LYS A 20 21.372 -7.136 -7.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 20.766 -5.611 -5.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 20.580 -4.712 -7.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 19.217 -5.359 -6.402 1.00 0.00 H new ATOM 306 N CYS A 21 17.270 -4.695 -13.261 1.00 0.00 N ATOM 307 CA CYS A 21 17.114 -4.871 -14.694 1.00 0.00 C ATOM 308 C CYS A 21 17.911 -3.827 -15.438 1.00 0.00 C ATOM 309 O CYS A 21 18.475 -4.119 -16.490 1.00 0.00 O ATOM 310 CB CYS A 21 15.641 -4.836 -15.193 1.00 0.00 C ATOM 311 SG CYS A 21 14.918 -3.162 -15.225 1.00 0.00 S ATOM 0 H CYS A 21 16.434 -4.394 -12.760 1.00 0.00 H new ATOM 0 HA CYS A 21 17.488 -5.874 -14.902 1.00 0.00 H new ATOM 0 HB2 CYS A 21 15.596 -5.261 -16.196 1.00 0.00 H new ATOM 0 HB3 CYS A 21 15.033 -5.472 -14.550 1.00 0.00 H new ATOM 316 N LEU A 22 17.983 -2.578 -14.918 1.00 0.00 N ATOM 317 CA LEU A 22 18.735 -1.552 -15.613 1.00 0.00 C ATOM 318 C LEU A 22 20.207 -1.826 -15.486 1.00 0.00 C ATOM 319 O LEU A 22 20.953 -1.721 -16.457 1.00 0.00 O ATOM 320 CB LEU A 22 18.482 -0.133 -15.069 1.00 0.00 C ATOM 321 CG LEU A 22 17.082 0.398 -15.410 1.00 0.00 C ATOM 322 CD1 LEU A 22 16.788 1.703 -14.652 1.00 0.00 C ATOM 323 CD2 LEU A 22 16.912 0.583 -16.926 1.00 0.00 C ATOM 0 H LEU A 22 17.540 -2.281 -14.049 1.00 0.00 H new ATOM 0 HA LEU A 22 18.400 -1.587 -16.650 1.00 0.00 H new ATOM 0 HB2 LEU A 22 18.610 -0.136 -13.987 1.00 0.00 H new ATOM 0 HB3 LEU A 22 19.231 0.546 -15.476 1.00 0.00 H new ATOM 0 HG LEU A 22 16.354 -0.346 -15.086 1.00 0.00 H new ATOM 0 HD11 LEU A 22 15.791 2.058 -14.911 1.00 0.00 H new ATOM 0 HD12 LEU A 22 16.840 1.520 -13.579 1.00 0.00 H new ATOM 0 HD13 LEU A 22 17.525 2.458 -14.928 1.00 0.00 H new ATOM 0 HD21 LEU A 22 15.911 0.960 -17.137 1.00 0.00 H new ATOM 0 HD22 LEU A 22 17.652 1.295 -17.291 1.00 0.00 H new ATOM 0 HD23 LEU A 22 17.052 -0.375 -17.427 1.00 0.00 H new ATOM 335 N ILE A 23 20.655 -2.197 -14.271 1.00 0.00 N ATOM 336 CA ILE A 23 22.058 -2.448 -14.037 1.00 0.00 C ATOM 337 C ILE A 23 22.507 -3.646 -14.824 1.00 0.00 C ATOM 338 O ILE A 23 23.578 -3.632 -15.425 1.00 0.00 O ATOM 339 CB ILE A 23 22.361 -2.688 -12.586 1.00 0.00 C ATOM 340 CG1 ILE A 23 22.146 -1.389 -11.797 1.00 0.00 C ATOM 341 CG2 ILE A 23 23.804 -3.206 -12.453 1.00 0.00 C ATOM 342 CD1 ILE A 23 22.229 -1.605 -10.293 1.00 0.00 C ATOM 0 H ILE A 23 20.058 -2.324 -13.454 1.00 0.00 H new ATOM 0 HA ILE A 23 22.595 -1.555 -14.357 1.00 0.00 H new ATOM 0 HB ILE A 23 21.690 -3.442 -12.174 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.894 -0.656 -12.098 1.00 0.00 H new ATOM 0 HG13 ILE A 23 21.171 -0.971 -12.048 1.00 0.00 H new ATOM 0 HG21 ILE A 23 24.032 -3.383 -11.402 1.00 0.00 H new ATOM 0 HG22 ILE A 23 23.909 -4.138 -13.009 1.00 0.00 H new ATOM 0 HG23 ILE A 23 24.495 -2.465 -12.854 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.070 -0.657 -9.780 1.00 0.00 H new ATOM 0 HD12 ILE A 23 21.463 -2.317 -9.985 1.00 0.00 H new ATOM 0 HD13 ILE A 23 23.213 -1.997 -10.035 1.00 0.00 H new ATOM 354 N GLN A 24 21.700 -4.720 -14.827 1.00 0.00 N ATOM 355 CA GLN A 24 22.076 -5.919 -15.537 1.00 0.00 C ATOM 356 C GLN A 24 22.149 -5.629 -17.011 1.00 0.00 C ATOM 357 O GLN A 24 23.032 -6.138 -17.699 1.00 0.00 O ATOM 358 CB GLN A 24 21.094 -7.088 -15.320 1.00 0.00 C ATOM 359 CG GLN A 24 21.567 -8.396 -15.974 1.00 0.00 C ATOM 360 CD GLN A 24 20.569 -9.496 -15.640 1.00 0.00 C ATOM 361 OE1 GLN A 24 19.597 -9.278 -14.923 1.00 0.00 O ATOM 362 NE2 GLN A 24 20.811 -10.718 -16.174 1.00 0.00 N ATOM 0 H GLN A 24 20.800 -4.768 -14.349 1.00 0.00 H new ATOM 0 HA GLN A 24 23.045 -6.222 -15.140 1.00 0.00 H new ATOM 0 HB2 GLN A 24 20.961 -7.250 -14.250 1.00 0.00 H new ATOM 0 HB3 GLN A 24 20.119 -6.817 -15.725 1.00 0.00 H new ATOM 0 HG2 GLN A 24 21.645 -8.272 -17.054 1.00 0.00 H new ATOM 0 HG3 GLN A 24 22.559 -8.663 -15.611 1.00 0.00 H new ATOM 0 HE21 GLN A 24 21.629 -10.863 -16.766 1.00 0.00 H new ATOM 0 HE22 GLN A 24 20.175 -11.493 -15.984 1.00 0.00 H new ATOM 371 N LYS A 25 21.211 -4.812 -17.540 1.00 0.00 N ATOM 372 CA LYS A 25 21.232 -4.496 -18.951 1.00 0.00 C ATOM 373 C LYS A 25 22.526 -3.805 -19.266 1.00 0.00 C ATOM 374 O LYS A 25 23.163 -4.084 -20.279 1.00 0.00 O ATOM 375 CB LYS A 25 20.076 -3.578 -19.394 1.00 0.00 C ATOM 376 CG LYS A 25 20.145 -3.215 -20.884 1.00 0.00 C ATOM 377 CD LYS A 25 20.027 -4.439 -21.799 1.00 0.00 C ATOM 378 CE LYS A 25 19.979 -4.061 -23.279 1.00 0.00 C ATOM 379 NZ LYS A 25 19.875 -5.277 -24.115 1.00 0.00 N ATOM 0 H LYS A 25 20.455 -4.378 -17.011 1.00 0.00 H new ATOM 0 HA LYS A 25 21.122 -5.438 -19.489 1.00 0.00 H new ATOM 0 HB2 LYS A 25 19.126 -4.072 -19.188 1.00 0.00 H new ATOM 0 HB3 LYS A 25 20.095 -2.664 -18.800 1.00 0.00 H new ATOM 0 HG2 LYS A 25 19.346 -2.512 -21.120 1.00 0.00 H new ATOM 0 HG3 LYS A 25 21.087 -2.705 -21.086 1.00 0.00 H new ATOM 0 HD2 LYS A 25 20.874 -5.102 -21.624 1.00 0.00 H new ATOM 0 HD3 LYS A 25 19.127 -4.997 -21.540 1.00 0.00 H new ATOM 0 HE2 LYS A 25 19.127 -3.408 -23.467 1.00 0.00 H new ATOM 0 HE3 LYS A 25 20.875 -3.502 -23.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.843 -5.007 -25.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 20.701 -5.886 -23.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 19.007 -5.795 -23.868 1.00 0.00 H new ATOM 393 N ILE A 26 22.933 -2.860 -18.403 1.00 0.00 N ATOM 394 CA ILE A 26 24.166 -2.149 -18.620 1.00 0.00 C ATOM 395 C ILE A 26 25.312 -3.124 -18.508 1.00 0.00 C ATOM 396 O ILE A 26 26.212 -3.119 -19.334 1.00 0.00 O ATOM 397 CB ILE A 26 24.386 -1.042 -17.621 1.00 0.00 C ATOM 398 CG1 ILE A 26 23.333 0.061 -17.818 1.00 0.00 C ATOM 399 CG2 ILE A 26 25.820 -0.498 -17.801 1.00 0.00 C ATOM 400 CD1 ILE A 26 23.341 1.092 -16.689 1.00 0.00 C ATOM 0 H ILE A 26 22.422 -2.586 -17.564 1.00 0.00 H new ATOM 0 HA ILE A 26 24.111 -1.697 -19.610 1.00 0.00 H new ATOM 0 HB ILE A 26 24.276 -1.418 -16.604 1.00 0.00 H new ATOM 0 HG12 ILE A 26 23.515 0.566 -18.767 1.00 0.00 H new ATOM 0 HG13 ILE A 26 22.344 -0.393 -17.883 1.00 0.00 H new ATOM 0 HG21 ILE A 26 25.997 0.305 -17.085 1.00 0.00 H new ATOM 0 HG22 ILE A 26 26.538 -1.301 -17.631 1.00 0.00 H new ATOM 0 HG23 ILE A 26 25.939 -0.114 -18.814 1.00 0.00 H new ATOM 0 HD11 ILE A 26 22.578 1.847 -16.880 1.00 0.00 H new ATOM 0 HD12 ILE A 26 23.131 0.596 -15.742 1.00 0.00 H new ATOM 0 HD13 ILE A 26 24.319 1.570 -16.639 1.00 0.00 H new ATOM 412 N SER A 27 25.264 -4.017 -17.495 1.00 0.00 N ATOM 413 CA SER A 27 26.346 -4.960 -17.261 1.00 0.00 C ATOM 414 C SER A 27 26.533 -5.877 -18.439 1.00 0.00 C ATOM 415 O SER A 27 27.662 -6.208 -18.795 1.00 0.00 O ATOM 416 CB SER A 27 26.108 -5.851 -16.026 1.00 0.00 C ATOM 417 OG SER A 27 26.091 -5.062 -14.845 1.00 0.00 O ATOM 0 H SER A 27 24.487 -4.094 -16.838 1.00 0.00 H new ATOM 0 HA SER A 27 27.230 -4.344 -17.098 1.00 0.00 H new ATOM 0 HB2 SER A 27 25.162 -6.383 -16.130 1.00 0.00 H new ATOM 0 HB3 SER A 27 26.892 -6.605 -15.957 1.00 0.00 H new ATOM 0 HG SER A 27 25.305 -4.477 -14.854 1.00 0.00 H new ATOM 423 N VAL A 28 25.433 -6.332 -19.061 1.00 0.00 N ATOM 424 CA VAL A 28 25.554 -7.239 -20.183 1.00 0.00 C ATOM 425 C VAL A 28 25.766 -6.445 -21.452 1.00 0.00 C ATOM 426 O VAL A 28 25.819 -7.011 -22.543 1.00 0.00 O ATOM 427 CB VAL A 28 24.342 -8.135 -20.343 1.00 0.00 C ATOM 428 CG1 VAL A 28 23.206 -7.356 -21.037 1.00 0.00 C ATOM 429 CG2 VAL A 28 24.758 -9.395 -21.125 1.00 0.00 C ATOM 0 H VAL A 28 24.477 -6.086 -18.804 1.00 0.00 H new ATOM 0 HA VAL A 28 26.410 -7.885 -19.987 1.00 0.00 H new ATOM 0 HB VAL A 28 23.962 -8.452 -19.372 1.00 0.00 H new ATOM 0 HG11 VAL A 28 22.337 -8.004 -21.150 1.00 0.00 H new ATOM 0 HG12 VAL A 28 22.937 -6.490 -20.433 1.00 0.00 H new ATOM 0 HG13 VAL A 28 23.541 -7.023 -22.020 1.00 0.00 H new ATOM 0 HG21 VAL A 28 23.895 -10.049 -21.247 1.00 0.00 H new ATOM 0 HG22 VAL A 28 25.136 -9.106 -22.106 1.00 0.00 H new ATOM 0 HG23 VAL A 28 25.538 -9.923 -20.576 1.00 0.00 H new ATOM 439 N SER A 29 25.926 -5.106 -21.342 1.00 0.00 N ATOM 440 CA SER A 29 26.107 -4.301 -22.524 1.00 0.00 C ATOM 441 C SER A 29 27.586 -4.095 -22.716 1.00 0.00 C ATOM 442 O SER A 29 28.299 -3.733 -21.794 1.00 0.00 O ATOM 443 CB SER A 29 25.440 -2.915 -22.414 1.00 0.00 C ATOM 444 OG SER A 29 25.594 -2.190 -23.630 1.00 0.00 O ATOM 0 H SER A 29 25.931 -4.591 -20.462 1.00 0.00 H new ATOM 0 HA SER A 29 25.642 -4.823 -23.360 1.00 0.00 H new ATOM 0 HB2 SER A 29 24.381 -3.032 -22.185 1.00 0.00 H new ATOM 0 HB3 SER A 29 25.884 -2.355 -21.591 1.00 0.00 H new ATOM 0 HG SER A 29 25.309 -1.262 -23.496 1.00 0.00 H new ATOM 450 N PRO A 30 28.076 -4.354 -23.906 1.00 0.00 N ATOM 451 CA PRO A 30 29.482 -4.152 -24.208 1.00 0.00 C ATOM 452 C PRO A 30 29.793 -2.712 -24.501 1.00 0.00 C ATOM 453 O PRO A 30 30.949 -2.336 -24.684 1.00 0.00 O ATOM 454 CB PRO A 30 29.713 -5.022 -25.442 1.00 0.00 C ATOM 455 CG PRO A 30 28.371 -4.986 -26.168 1.00 0.00 C ATOM 456 CD PRO A 30 27.320 -4.872 -25.057 1.00 0.00 C ATOM 0 HA PRO A 30 30.126 -4.416 -23.369 1.00 0.00 H new ATOM 0 HB2 PRO A 30 30.516 -4.628 -26.065 1.00 0.00 H new ATOM 0 HB3 PRO A 30 29.993 -6.039 -25.168 1.00 0.00 H new ATOM 0 HG2 PRO A 30 28.315 -4.139 -26.852 1.00 0.00 H new ATOM 0 HG3 PRO A 30 28.220 -5.887 -26.763 1.00 0.00 H new ATOM 0 HD2 PRO A 30 26.511 -4.198 -25.340 1.00 0.00 H new ATOM 0 HD3 PRO A 30 26.867 -5.838 -24.835 1.00 0.00 H new ATOM 464 N VAL A 31 28.730 -1.879 -24.567 1.00 0.00 N ATOM 465 CA VAL A 31 28.880 -0.474 -24.867 1.00 0.00 C ATOM 466 C VAL A 31 29.610 0.223 -23.746 1.00 0.00 C ATOM 467 O VAL A 31 30.487 1.052 -23.994 1.00 0.00 O ATOM 468 CB VAL A 31 27.547 0.211 -25.066 1.00 0.00 C ATOM 469 CG1 VAL A 31 27.770 1.731 -25.199 1.00 0.00 C ATOM 470 CG2 VAL A 31 26.873 -0.393 -26.311 1.00 0.00 C ATOM 0 H VAL A 31 27.766 -2.175 -24.413 1.00 0.00 H new ATOM 0 HA VAL A 31 29.448 -0.409 -25.795 1.00 0.00 H new ATOM 0 HB VAL A 31 26.889 0.054 -24.212 1.00 0.00 H new ATOM 0 HG11 VAL A 31 26.811 2.228 -25.343 1.00 0.00 H new ATOM 0 HG12 VAL A 31 28.243 2.110 -24.293 1.00 0.00 H new ATOM 0 HG13 VAL A 31 28.414 1.931 -26.055 1.00 0.00 H new ATOM 0 HG21 VAL A 31 25.908 0.088 -26.472 1.00 0.00 H new ATOM 0 HG22 VAL A 31 27.508 -0.233 -27.182 1.00 0.00 H new ATOM 0 HG23 VAL A 31 26.724 -1.462 -26.162 1.00 0.00 H new ATOM 480 N PHE A 32 29.266 -0.092 -22.477 1.00 0.00 N ATOM 481 CA PHE A 32 29.905 0.588 -21.366 1.00 0.00 C ATOM 482 C PHE A 32 31.277 -0.018 -21.152 1.00 0.00 C ATOM 483 O PHE A 32 31.502 -1.207 -21.382 1.00 0.00 O ATOM 484 CB PHE A 32 29.088 0.495 -20.045 1.00 0.00 C ATOM 485 CG PHE A 32 29.323 -0.742 -19.240 1.00 0.00 C ATOM 486 CD1 PHE A 32 30.093 -0.710 -18.097 1.00 0.00 C ATOM 487 CD2 PHE A 32 28.782 -1.931 -19.640 1.00 0.00 C ATOM 488 CE1 PHE A 32 30.311 -1.857 -17.372 1.00 0.00 C ATOM 489 CE2 PHE A 32 28.997 -3.076 -18.918 1.00 0.00 C ATOM 490 CZ PHE A 32 29.761 -3.043 -17.787 1.00 0.00 C ATOM 0 H PHE A 32 28.571 -0.792 -22.218 1.00 0.00 H new ATOM 0 HA PHE A 32 29.973 1.645 -21.622 1.00 0.00 H new ATOM 0 HB2 PHE A 32 29.325 1.362 -19.428 1.00 0.00 H new ATOM 0 HB3 PHE A 32 28.027 0.556 -20.287 1.00 0.00 H new ATOM 0 HD1 PHE A 32 30.528 0.223 -17.769 1.00 0.00 H new ATOM 0 HD2 PHE A 32 28.178 -1.969 -20.535 1.00 0.00 H new ATOM 0 HE1 PHE A 32 30.914 -1.825 -16.477 1.00 0.00 H new ATOM 0 HE2 PHE A 32 28.560 -4.008 -19.245 1.00 0.00 H new ATOM 0 HZ PHE A 32 29.932 -3.947 -17.221 1.00 0.00 H new ATOM 500 N PRO A 33 32.207 0.808 -20.714 1.00 0.00 N ATOM 501 CA PRO A 33 33.569 0.378 -20.445 1.00 0.00 C ATOM 502 C PRO A 33 33.727 -0.298 -19.112 1.00 0.00 C ATOM 503 O PRO A 33 32.931 -0.100 -18.197 1.00 0.00 O ATOM 504 CB PRO A 33 34.372 1.675 -20.502 1.00 0.00 C ATOM 505 CG PRO A 33 33.395 2.718 -19.981 1.00 0.00 C ATOM 506 CD PRO A 33 32.017 2.242 -20.452 1.00 0.00 C ATOM 0 HA PRO A 33 33.899 -0.373 -21.162 1.00 0.00 H new ATOM 0 HB2 PRO A 33 35.268 1.620 -19.884 1.00 0.00 H new ATOM 0 HB3 PRO A 33 34.698 1.901 -21.517 1.00 0.00 H new ATOM 0 HG2 PRO A 33 33.437 2.790 -18.894 1.00 0.00 H new ATOM 0 HG3 PRO A 33 33.627 3.707 -20.375 1.00 0.00 H new ATOM 0 HD2 PRO A 33 31.255 2.411 -19.691 1.00 0.00 H new ATOM 0 HD3 PRO A 33 31.696 2.773 -21.348 1.00 0.00 H new ATOM 514 N GLN A 34 34.811 -1.089 -18.975 1.00 0.00 N ATOM 515 CA GLN A 34 35.078 -1.820 -17.752 1.00 0.00 C ATOM 516 C GLN A 34 35.317 -0.861 -16.611 1.00 0.00 C ATOM 517 O GLN A 34 34.962 -1.145 -15.470 1.00 0.00 O ATOM 518 CB GLN A 34 36.313 -2.735 -17.875 1.00 0.00 C ATOM 519 CG GLN A 34 36.506 -3.649 -16.656 1.00 0.00 C ATOM 520 CD GLN A 34 37.684 -4.576 -16.924 1.00 0.00 C ATOM 521 OE1 GLN A 34 38.277 -4.554 -17.999 1.00 0.00 O ATOM 522 NE2 GLN A 34 38.037 -5.417 -15.923 1.00 0.00 N ATOM 0 H GLN A 34 35.508 -1.228 -19.707 1.00 0.00 H new ATOM 0 HA GLN A 34 34.201 -2.438 -17.562 1.00 0.00 H new ATOM 0 HB2 GLN A 34 36.216 -3.349 -18.771 1.00 0.00 H new ATOM 0 HB3 GLN A 34 37.203 -2.119 -18.005 1.00 0.00 H new ATOM 0 HG2 GLN A 34 36.690 -3.053 -15.762 1.00 0.00 H new ATOM 0 HG3 GLN A 34 35.602 -4.230 -16.472 1.00 0.00 H new ATOM 0 HE21 GLN A 34 37.521 -5.407 -15.043 1.00 0.00 H new ATOM 0 HE22 GLN A 34 38.819 -6.060 -16.049 1.00 0.00 H new ATOM 531 N GLN A 35 35.933 0.301 -16.898 1.00 0.00 N ATOM 532 CA GLN A 35 36.249 1.264 -15.859 1.00 0.00 C ATOM 533 C GLN A 35 34.992 1.739 -15.167 1.00 0.00 C ATOM 534 O GLN A 35 34.993 1.952 -13.955 1.00 0.00 O ATOM 535 CB GLN A 35 36.985 2.507 -16.399 1.00 0.00 C ATOM 536 CG GLN A 35 38.420 2.199 -16.856 1.00 0.00 C ATOM 537 CD GLN A 35 39.217 1.674 -15.669 1.00 0.00 C ATOM 538 OE1 GLN A 35 39.654 0.527 -15.658 1.00 0.00 O ATOM 539 NE2 GLN A 35 39.418 2.532 -14.638 1.00 0.00 N ATOM 0 H GLN A 35 36.215 0.583 -17.837 1.00 0.00 H new ATOM 0 HA GLN A 35 36.904 0.741 -15.163 1.00 0.00 H new ATOM 0 HB2 GLN A 35 36.423 2.921 -17.236 1.00 0.00 H new ATOM 0 HB3 GLN A 35 37.012 3.273 -15.624 1.00 0.00 H new ATOM 0 HG2 GLN A 35 38.409 1.461 -17.658 1.00 0.00 H new ATOM 0 HG3 GLN A 35 38.889 3.098 -17.256 1.00 0.00 H new ATOM 0 HE21 GLN A 35 39.040 3.478 -14.681 1.00 0.00 H new ATOM 0 HE22 GLN A 35 39.947 2.231 -13.820 1.00 0.00 H new ATOM 548 N GLU A 36 33.882 1.917 -15.916 1.00 0.00 N ATOM 549 CA GLU A 36 32.661 2.408 -15.308 1.00 0.00 C ATOM 550 C GLU A 36 32.007 1.329 -14.480 1.00 0.00 C ATOM 551 O GLU A 36 31.027 1.596 -13.791 1.00 0.00 O ATOM 552 CB GLU A 36 31.628 2.936 -16.326 1.00 0.00 C ATOM 553 CG GLU A 36 32.071 4.262 -16.971 1.00 0.00 C ATOM 554 CD GLU A 36 31.032 4.693 -18.001 1.00 0.00 C ATOM 555 OE1 GLU A 36 30.085 3.906 -18.261 1.00 0.00 O ATOM 556 OE2 GLU A 36 31.181 5.818 -18.546 1.00 0.00 O ATOM 0 H GLU A 36 33.821 1.729 -16.917 1.00 0.00 H new ATOM 0 HA GLU A 36 32.968 3.247 -14.683 1.00 0.00 H new ATOM 0 HB2 GLU A 36 31.474 2.189 -17.105 1.00 0.00 H new ATOM 0 HB3 GLU A 36 30.669 3.079 -15.827 1.00 0.00 H new ATOM 0 HG2 GLU A 36 32.184 5.031 -16.207 1.00 0.00 H new ATOM 0 HG3 GLU A 36 33.044 4.141 -17.447 1.00 0.00 H new ATOM 563 N LYS A 37 32.524 0.079 -14.524 1.00 0.00 N ATOM 564 CA LYS A 37 31.933 -0.991 -13.738 1.00 0.00 C ATOM 565 C LYS A 37 32.036 -0.624 -12.276 1.00 0.00 C ATOM 566 O LYS A 37 31.113 -0.861 -11.496 1.00 0.00 O ATOM 567 CB LYS A 37 32.628 -2.353 -13.945 1.00 0.00 C ATOM 568 CG LYS A 37 31.967 -3.486 -13.154 1.00 0.00 C ATOM 569 CD LYS A 37 32.645 -4.838 -13.391 1.00 0.00 C ATOM 570 CE LYS A 37 31.988 -5.970 -12.598 1.00 0.00 C ATOM 571 NZ LYS A 37 32.671 -7.253 -12.870 1.00 0.00 N ATOM 0 H LYS A 37 33.330 -0.194 -15.086 1.00 0.00 H new ATOM 0 HA LYS A 37 30.899 -1.099 -14.065 1.00 0.00 H new ATOM 0 HB2 LYS A 37 32.617 -2.603 -15.006 1.00 0.00 H new ATOM 0 HB3 LYS A 37 33.673 -2.271 -13.647 1.00 0.00 H new ATOM 0 HG2 LYS A 37 31.998 -3.249 -12.091 1.00 0.00 H new ATOM 0 HG3 LYS A 37 30.916 -3.556 -13.434 1.00 0.00 H new ATOM 0 HD2 LYS A 37 32.611 -5.076 -14.454 1.00 0.00 H new ATOM 0 HD3 LYS A 37 33.697 -4.767 -13.113 1.00 0.00 H new ATOM 0 HE2 LYS A 37 32.029 -5.747 -11.532 1.00 0.00 H new ATOM 0 HE3 LYS A 37 30.934 -6.047 -12.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 32.214 -8.012 -12.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 32.610 -7.471 -13.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 33.670 -7.180 -12.591 1.00 0.00 H new ATOM 585 N GLU A 38 33.185 -0.036 -11.869 1.00 0.00 N ATOM 586 CA GLU A 38 33.371 0.351 -10.487 1.00 0.00 C ATOM 587 C GLU A 38 32.363 1.420 -10.148 1.00 0.00 C ATOM 588 O GLU A 38 31.821 1.451 -9.043 1.00 0.00 O ATOM 589 CB GLU A 38 34.779 0.912 -10.201 1.00 0.00 C ATOM 590 CG GLU A 38 35.868 -0.171 -10.274 1.00 0.00 C ATOM 591 CD GLU A 38 37.235 0.478 -10.086 1.00 0.00 C ATOM 592 OE1 GLU A 38 37.306 1.737 -10.103 1.00 0.00 O ATOM 593 OE2 GLU A 38 38.227 -0.279 -9.923 1.00 0.00 O ATOM 0 H GLU A 38 33.974 0.170 -12.481 1.00 0.00 H new ATOM 0 HA GLU A 38 33.242 -0.545 -9.881 1.00 0.00 H new ATOM 0 HB2 GLU A 38 35.006 1.700 -10.919 1.00 0.00 H new ATOM 0 HB3 GLU A 38 34.791 1.369 -9.212 1.00 0.00 H new ATOM 0 HG2 GLU A 38 35.701 -0.924 -9.504 1.00 0.00 H new ATOM 0 HG3 GLU A 38 35.824 -0.683 -11.235 1.00 0.00 H new ATOM 600 N ASP A 39 32.098 2.333 -11.110 1.00 0.00 N ATOM 601 CA ASP A 39 31.152 3.402 -10.891 1.00 0.00 C ATOM 602 C ASP A 39 29.779 2.804 -10.694 1.00 0.00 C ATOM 603 O ASP A 39 28.992 3.302 -9.897 1.00 0.00 O ATOM 604 CB ASP A 39 31.090 4.402 -12.065 1.00 0.00 C ATOM 605 CG ASP A 39 30.302 5.657 -11.717 1.00 0.00 C ATOM 606 OD1 ASP A 39 30.711 6.363 -10.759 1.00 0.00 O ATOM 607 OD2 ASP A 39 29.286 5.927 -12.408 1.00 0.00 O ATOM 0 H ASP A 39 32.533 2.334 -12.033 1.00 0.00 H new ATOM 0 HA ASP A 39 31.483 3.952 -10.010 1.00 0.00 H new ATOM 0 HB2 ASP A 39 32.103 4.681 -12.355 1.00 0.00 H new ATOM 0 HB3 ASP A 39 30.634 3.917 -12.928 1.00 0.00 H new ATOM 612 N MET A 40 29.463 1.714 -11.433 1.00 0.00 N ATOM 613 CA MET A 40 28.161 1.082 -11.320 1.00 0.00 C ATOM 614 C MET A 40 27.972 0.592 -9.909 1.00 0.00 C ATOM 615 O MET A 40 26.876 0.683 -9.357 1.00 0.00 O ATOM 616 CB MET A 40 27.995 -0.127 -12.267 1.00 0.00 C ATOM 617 CG MET A 40 27.904 0.283 -13.741 1.00 0.00 C ATOM 618 SD MET A 40 28.027 -1.128 -14.883 1.00 0.00 S ATOM 619 CE MET A 40 26.424 -1.861 -14.451 1.00 0.00 C ATOM 0 H MET A 40 30.094 1.271 -12.101 1.00 0.00 H new ATOM 0 HA MET A 40 27.420 1.833 -11.595 1.00 0.00 H new ATOM 0 HB2 MET A 40 28.838 -0.805 -12.134 1.00 0.00 H new ATOM 0 HB3 MET A 40 27.096 -0.678 -11.991 1.00 0.00 H new ATOM 0 HG2 MET A 40 26.959 0.799 -13.911 1.00 0.00 H new ATOM 0 HG3 MET A 40 28.700 0.994 -13.964 1.00 0.00 H new ATOM 0 HE1 MET A 40 25.986 -2.325 -15.335 1.00 0.00 H new ATOM 0 HE2 MET A 40 26.566 -2.616 -13.677 1.00 0.00 H new ATOM 0 HE3 MET A 40 25.756 -1.083 -14.081 1.00 0.00 H new ATOM 629 N GLU A 41 29.042 0.045 -9.289 1.00 0.00 N ATOM 630 CA GLU A 41 28.933 -0.444 -7.929 1.00 0.00 C ATOM 631 C GLU A 41 28.626 0.718 -7.017 1.00 0.00 C ATOM 632 O GLU A 41 27.840 0.597 -6.079 1.00 0.00 O ATOM 633 CB GLU A 41 30.226 -1.121 -7.424 1.00 0.00 C ATOM 634 CG GLU A 41 30.515 -2.460 -8.124 1.00 0.00 C ATOM 635 CD GLU A 41 29.361 -3.420 -7.864 1.00 0.00 C ATOM 636 OE1 GLU A 41 28.977 -3.577 -6.674 1.00 0.00 O ATOM 637 OE2 GLU A 41 28.851 -4.010 -8.852 1.00 0.00 O ATOM 0 H GLU A 41 29.964 -0.060 -9.712 1.00 0.00 H new ATOM 0 HA GLU A 41 28.140 -1.192 -7.921 1.00 0.00 H new ATOM 0 HB2 GLU A 41 31.068 -0.446 -7.580 1.00 0.00 H new ATOM 0 HB3 GLU A 41 30.147 -1.288 -6.350 1.00 0.00 H new ATOM 0 HG2 GLU A 41 30.640 -2.304 -9.196 1.00 0.00 H new ATOM 0 HG3 GLU A 41 31.448 -2.884 -7.753 1.00 0.00 H new ATOM 644 N SER A 42 29.264 1.880 -7.278 1.00 0.00 N ATOM 645 CA SER A 42 29.042 3.062 -6.467 1.00 0.00 C ATOM 646 C SER A 42 27.603 3.494 -6.621 1.00 0.00 C ATOM 647 O SER A 42 26.964 3.914 -5.657 1.00 0.00 O ATOM 648 CB SER A 42 29.947 4.248 -6.861 1.00 0.00 C ATOM 649 OG SER A 42 29.713 5.365 -6.007 1.00 0.00 O ATOM 0 H SER A 42 29.929 2.008 -8.041 1.00 0.00 H new ATOM 0 HA SER A 42 29.281 2.793 -5.438 1.00 0.00 H new ATOM 0 HB2 SER A 42 30.994 3.950 -6.799 1.00 0.00 H new ATOM 0 HB3 SER A 42 29.756 4.529 -7.897 1.00 0.00 H new ATOM 0 HG SER A 42 30.297 6.107 -6.271 1.00 0.00 H new ATOM 655 N ILE A 43 27.075 3.422 -7.865 1.00 0.00 N ATOM 656 CA ILE A 43 25.708 3.818 -8.136 1.00 0.00 C ATOM 657 C ILE A 43 24.765 2.947 -7.346 1.00 0.00 C ATOM 658 O ILE A 43 23.775 3.434 -6.806 1.00 0.00 O ATOM 659 CB ILE A 43 25.352 3.706 -9.600 1.00 0.00 C ATOM 660 CG1 ILE A 43 26.120 4.767 -10.410 1.00 0.00 C ATOM 661 CG2 ILE A 43 23.825 3.860 -9.753 1.00 0.00 C ATOM 662 CD1 ILE A 43 26.023 4.544 -11.919 1.00 0.00 C ATOM 0 H ILE A 43 27.588 3.092 -8.683 1.00 0.00 H new ATOM 0 HA ILE A 43 25.615 4.864 -7.844 1.00 0.00 H new ATOM 0 HB ILE A 43 25.641 2.730 -9.989 1.00 0.00 H new ATOM 0 HG12 ILE A 43 25.730 5.755 -10.167 1.00 0.00 H new ATOM 0 HG13 ILE A 43 27.168 4.756 -10.112 1.00 0.00 H new ATOM 0 HG21 ILE A 43 23.555 3.781 -10.806 1.00 0.00 H new ATOM 0 HG22 ILE A 43 23.322 3.074 -9.189 1.00 0.00 H new ATOM 0 HG23 ILE A 43 23.517 4.834 -9.372 1.00 0.00 H new ATOM 0 HD11 ILE A 43 26.583 5.322 -12.438 1.00 0.00 H new ATOM 0 HD12 ILE A 43 26.439 3.568 -12.170 1.00 0.00 H new ATOM 0 HD13 ILE A 43 24.978 4.583 -12.226 1.00 0.00 H new ATOM 674 N VAL A 44 25.051 1.628 -7.261 1.00 0.00 N ATOM 675 CA VAL A 44 24.175 0.726 -6.539 1.00 0.00 C ATOM 676 C VAL A 44 24.093 1.165 -5.099 1.00 0.00 C ATOM 677 O VAL A 44 23.006 1.253 -4.527 1.00 0.00 O ATOM 678 CB VAL A 44 24.671 -0.700 -6.549 1.00 0.00 C ATOM 679 CG1 VAL A 44 23.791 -1.546 -5.606 1.00 0.00 C ATOM 680 CG2 VAL A 44 24.652 -1.215 -7.996 1.00 0.00 C ATOM 0 H VAL A 44 25.870 1.187 -7.680 1.00 0.00 H new ATOM 0 HA VAL A 44 23.206 0.760 -7.036 1.00 0.00 H new ATOM 0 HB VAL A 44 25.696 -0.768 -6.185 1.00 0.00 H new ATOM 0 HG11 VAL A 44 24.143 -2.578 -5.608 1.00 0.00 H new ATOM 0 HG12 VAL A 44 23.851 -1.144 -4.595 1.00 0.00 H new ATOM 0 HG13 VAL A 44 22.757 -1.515 -5.948 1.00 0.00 H new ATOM 0 HG21 VAL A 44 25.008 -2.245 -8.020 1.00 0.00 H new ATOM 0 HG22 VAL A 44 23.634 -1.174 -8.384 1.00 0.00 H new ATOM 0 HG23 VAL A 44 25.301 -0.592 -8.612 1.00 0.00 H new ATOM 690 N GLU A 45 25.256 1.464 -4.483 1.00 0.00 N ATOM 691 CA GLU A 45 25.278 1.875 -3.098 1.00 0.00 C ATOM 692 C GLU A 45 24.575 3.199 -2.952 1.00 0.00 C ATOM 693 O GLU A 45 23.866 3.425 -1.978 1.00 0.00 O ATOM 694 CB GLU A 45 26.709 2.036 -2.543 1.00 0.00 C ATOM 695 CG GLU A 45 27.452 0.696 -2.398 1.00 0.00 C ATOM 696 CD GLU A 45 26.681 -0.201 -1.437 1.00 0.00 C ATOM 697 OE1 GLU A 45 26.340 0.278 -0.324 1.00 0.00 O ATOM 698 OE2 GLU A 45 26.424 -1.378 -1.806 1.00 0.00 O ATOM 0 H GLU A 45 26.171 1.424 -4.931 1.00 0.00 H new ATOM 0 HA GLU A 45 24.777 1.089 -2.533 1.00 0.00 H new ATOM 0 HB2 GLU A 45 27.277 2.691 -3.204 1.00 0.00 H new ATOM 0 HB3 GLU A 45 26.663 2.527 -1.571 1.00 0.00 H new ATOM 0 HG2 GLU A 45 27.547 0.212 -3.370 1.00 0.00 H new ATOM 0 HG3 GLU A 45 28.463 0.865 -2.026 1.00 0.00 H new ATOM 705 N THR A 46 24.769 4.107 -3.926 1.00 0.00 N ATOM 706 CA THR A 46 24.163 5.423 -3.857 1.00 0.00 C ATOM 707 C THR A 46 22.665 5.313 -3.966 1.00 0.00 C ATOM 708 O THR A 46 21.941 6.005 -3.254 1.00 0.00 O ATOM 709 CB THR A 46 24.642 6.348 -4.949 1.00 0.00 C ATOM 710 OG1 THR A 46 26.052 6.513 -4.858 1.00 0.00 O ATOM 711 CG2 THR A 46 23.948 7.715 -4.802 1.00 0.00 C ATOM 0 H THR A 46 25.337 3.944 -4.757 1.00 0.00 H new ATOM 0 HA THR A 46 24.459 5.842 -2.895 1.00 0.00 H new ATOM 0 HB THR A 46 24.397 5.918 -5.920 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.497 5.681 -5.125 1.00 0.00 H new ATOM 0 HG21 THR A 46 24.293 8.385 -5.590 1.00 0.00 H new ATOM 0 HG22 THR A 46 22.869 7.586 -4.882 1.00 0.00 H new ATOM 0 HG23 THR A 46 24.191 8.144 -3.830 1.00 0.00 H new ATOM 719 N MET A 47 22.162 4.447 -4.868 1.00 0.00 N ATOM 720 CA MET A 47 20.730 4.309 -5.036 1.00 0.00 C ATOM 721 C MET A 47 20.130 3.827 -3.740 1.00 0.00 C ATOM 722 O MET A 47 19.097 4.327 -3.297 1.00 0.00 O ATOM 723 CB MET A 47 20.357 3.305 -6.147 1.00 0.00 C ATOM 724 CG MET A 47 18.851 3.263 -6.436 1.00 0.00 C ATOM 725 SD MET A 47 18.219 4.820 -7.129 1.00 0.00 S ATOM 726 CE MET A 47 16.498 4.256 -7.244 1.00 0.00 C ATOM 0 H MET A 47 22.726 3.850 -5.473 1.00 0.00 H new ATOM 0 HA MET A 47 20.340 5.286 -5.322 1.00 0.00 H new ATOM 0 HB2 MET A 47 20.890 3.568 -7.061 1.00 0.00 H new ATOM 0 HB3 MET A 47 20.694 2.310 -5.858 1.00 0.00 H new ATOM 0 HG2 MET A 47 18.642 2.450 -7.132 1.00 0.00 H new ATOM 0 HG3 MET A 47 18.315 3.038 -5.514 1.00 0.00 H new ATOM 0 HE1 MET A 47 15.868 5.077 -7.587 1.00 0.00 H new ATOM 0 HE2 MET A 47 16.433 3.428 -7.950 1.00 0.00 H new ATOM 0 HE3 MET A 47 16.158 3.924 -6.263 1.00 0.00 H new ATOM 736 N MET A 48 20.782 2.835 -3.101 1.00 0.00 N ATOM 737 CA MET A 48 20.283 2.305 -1.852 1.00 0.00 C ATOM 738 C MET A 48 20.438 3.351 -0.783 1.00 0.00 C ATOM 739 O MET A 48 19.610 3.452 0.124 1.00 0.00 O ATOM 740 CB MET A 48 21.026 1.040 -1.406 1.00 0.00 C ATOM 741 CG MET A 48 20.768 -0.142 -2.346 1.00 0.00 C ATOM 742 SD MET A 48 19.012 -0.629 -2.426 1.00 0.00 S ATOM 743 CE MET A 48 18.647 0.197 -4.008 1.00 0.00 C ATOM 0 H MET A 48 21.642 2.401 -3.437 1.00 0.00 H new ATOM 0 HA MET A 48 19.237 2.039 -2.007 1.00 0.00 H new ATOM 0 HB2 MET A 48 22.096 1.244 -1.366 1.00 0.00 H new ATOM 0 HB3 MET A 48 20.714 0.774 -0.396 1.00 0.00 H new ATOM 0 HG2 MET A 48 21.112 0.117 -3.347 1.00 0.00 H new ATOM 0 HG3 MET A 48 21.360 -0.996 -2.016 1.00 0.00 H new ATOM 0 HE1 MET A 48 17.838 -0.329 -4.515 1.00 0.00 H new ATOM 0 HE2 MET A 48 18.348 1.228 -3.820 1.00 0.00 H new ATOM 0 HE3 MET A 48 19.537 0.187 -4.638 1.00 0.00 H new ATOM 753 N SER A 49 21.530 4.143 -0.853 1.00 0.00 N ATOM 754 CA SER A 49 21.761 5.181 0.131 1.00 0.00 C ATOM 755 C SER A 49 20.624 6.162 0.064 1.00 0.00 C ATOM 756 O SER A 49 20.159 6.651 1.090 1.00 0.00 O ATOM 757 CB SER A 49 23.079 5.954 -0.091 1.00 0.00 C ATOM 758 OG SER A 49 23.258 6.939 0.923 1.00 0.00 O ATOM 0 H SER A 49 22.246 4.073 -1.576 1.00 0.00 H new ATOM 0 HA SER A 49 21.831 4.692 1.103 1.00 0.00 H new ATOM 0 HB2 SER A 49 23.920 5.260 -0.084 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.067 6.431 -1.071 1.00 0.00 H new ATOM 0 HG SER A 49 24.099 7.419 0.768 1.00 0.00 H new ATOM 764 N ALA A 50 20.168 6.493 -1.163 1.00 0.00 N ATOM 765 CA ALA A 50 19.077 7.428 -1.329 1.00 0.00 C ATOM 766 C ALA A 50 17.839 6.864 -0.680 1.00 0.00 C ATOM 767 O ALA A 50 17.089 7.589 -0.033 1.00 0.00 O ATOM 768 CB ALA A 50 18.748 7.712 -2.808 1.00 0.00 C ATOM 0 H ALA A 50 20.546 6.121 -2.034 1.00 0.00 H new ATOM 0 HA ALA A 50 19.391 8.364 -0.866 1.00 0.00 H new ATOM 0 HB1 ALA A 50 17.922 8.420 -2.867 1.00 0.00 H new ATOM 0 HB2 ALA A 50 19.624 8.134 -3.301 1.00 0.00 H new ATOM 0 HB3 ALA A 50 18.466 6.783 -3.303 1.00 0.00 H new ATOM 774 N ILE A 51 17.603 5.541 -0.838 1.00 0.00 N ATOM 775 CA ILE A 51 16.430 4.921 -0.255 1.00 0.00 C ATOM 776 C ILE A 51 16.498 5.055 1.242 1.00 0.00 C ATOM 777 O ILE A 51 15.522 5.433 1.888 1.00 0.00 O ATOM 778 CB ILE A 51 16.323 3.446 -0.582 1.00 0.00 C ATOM 779 CG1 ILE A 51 16.033 3.230 -2.082 1.00 0.00 C ATOM 780 CG2 ILE A 51 15.222 2.822 0.301 1.00 0.00 C ATOM 781 CD1 ILE A 51 14.618 3.649 -2.482 1.00 0.00 C ATOM 0 H ILE A 51 18.209 4.906 -1.358 1.00 0.00 H new ATOM 0 HA ILE A 51 15.560 5.428 -0.673 1.00 0.00 H new ATOM 0 HB ILE A 51 17.273 2.955 -0.372 1.00 0.00 H new ATOM 0 HG12 ILE A 51 16.754 3.796 -2.671 1.00 0.00 H new ATOM 0 HG13 ILE A 51 16.178 2.178 -2.327 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.134 1.759 0.076 1.00 0.00 H new ATOM 0 HG22 ILE A 51 15.482 2.950 1.352 1.00 0.00 H new ATOM 0 HG23 ILE A 51 14.271 3.315 0.100 1.00 0.00 H new ATOM 0 HD11 ILE A 51 14.474 3.473 -3.548 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.892 3.065 -1.917 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.478 4.708 -2.267 1.00 0.00 H new ATOM 793 N SER A 52 17.673 4.751 1.825 1.00 0.00 N ATOM 794 CA SER A 52 17.833 4.820 3.264 1.00 0.00 C ATOM 795 C SER A 52 17.697 6.245 3.732 1.00 0.00 C ATOM 796 O SER A 52 17.077 6.507 4.759 1.00 0.00 O ATOM 797 CB SER A 52 19.205 4.304 3.738 1.00 0.00 C ATOM 798 OG SER A 52 19.332 2.916 3.456 1.00 0.00 O ATOM 0 H SER A 52 18.508 4.460 1.317 1.00 0.00 H new ATOM 0 HA SER A 52 17.055 4.184 3.686 1.00 0.00 H new ATOM 0 HB2 SER A 52 20.001 4.858 3.241 1.00 0.00 H new ATOM 0 HB3 SER A 52 19.317 4.477 4.808 1.00 0.00 H new ATOM 0 HG SER A 52 20.208 2.599 3.760 1.00 0.00 H new ATOM 804 N GLY A 53 18.297 7.202 2.987 1.00 0.00 N ATOM 805 CA GLY A 53 18.243 8.594 3.378 1.00 0.00 C ATOM 806 C GLY A 53 16.828 9.094 3.336 1.00 0.00 C ATOM 807 O GLY A 53 16.393 9.814 4.234 1.00 0.00 O ATOM 0 H GLY A 53 18.813 7.021 2.126 1.00 0.00 H new ATOM 0 HA2 GLY A 53 18.648 8.712 4.383 1.00 0.00 H new ATOM 0 HA3 GLY A 53 18.866 9.190 2.711 1.00 0.00 H new ATOM 811 N VAL A 54 16.073 8.737 2.275 1.00 0.00 N ATOM 812 CA VAL A 54 14.708 9.197 2.158 1.00 0.00 C ATOM 813 C VAL A 54 13.878 8.523 3.217 1.00 0.00 C ATOM 814 O VAL A 54 13.019 9.154 3.832 1.00 0.00 O ATOM 815 CB VAL A 54 14.102 8.912 0.806 1.00 0.00 C ATOM 816 CG1 VAL A 54 12.606 9.278 0.837 1.00 0.00 C ATOM 817 CG2 VAL A 54 14.875 9.722 -0.254 1.00 0.00 C ATOM 0 H VAL A 54 16.394 8.143 1.511 1.00 0.00 H new ATOM 0 HA VAL A 54 14.718 10.280 2.284 1.00 0.00 H new ATOM 0 HB VAL A 54 14.178 7.855 0.552 1.00 0.00 H new ATOM 0 HG11 VAL A 54 12.161 9.075 -0.137 1.00 0.00 H new ATOM 0 HG12 VAL A 54 12.101 8.682 1.598 1.00 0.00 H new ATOM 0 HG13 VAL A 54 12.495 10.336 1.072 1.00 0.00 H new ATOM 0 HG21 VAL A 54 14.451 9.529 -1.240 1.00 0.00 H new ATOM 0 HG22 VAL A 54 14.797 10.785 -0.027 1.00 0.00 H new ATOM 0 HG23 VAL A 54 15.924 9.425 -0.245 1.00 0.00 H new ATOM 827 N SER A 55 14.113 7.203 3.422 1.00 0.00 N ATOM 828 CA SER A 55 13.386 6.432 4.416 1.00 0.00 C ATOM 829 C SER A 55 12.074 6.011 3.814 1.00 0.00 C ATOM 830 O SER A 55 11.721 4.835 3.857 1.00 0.00 O ATOM 831 CB SER A 55 13.104 7.176 5.742 1.00 0.00 C ATOM 832 OG SER A 55 12.870 6.243 6.790 1.00 0.00 O ATOM 0 H SER A 55 14.806 6.665 2.902 1.00 0.00 H new ATOM 0 HA SER A 55 14.025 5.589 4.678 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.950 7.814 5.996 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.238 7.827 5.625 1.00 0.00 H new ATOM 0 HG SER A 55 12.694 6.726 7.625 1.00 0.00 H new ATOM 916 N GLU A 62 5.083 12.850 -2.965 1.00 0.00 N ATOM 917 CA GLU A 62 5.535 13.110 -4.314 1.00 0.00 C ATOM 918 C GLU A 62 7.024 13.325 -4.311 1.00 0.00 C ATOM 919 O GLU A 62 7.726 12.874 -5.215 1.00 0.00 O ATOM 920 CB GLU A 62 4.871 14.356 -4.933 1.00 0.00 C ATOM 921 CG GLU A 62 5.292 14.599 -6.393 1.00 0.00 C ATOM 922 CD GLU A 62 4.548 15.816 -6.932 1.00 0.00 C ATOM 923 OE1 GLU A 62 3.754 16.420 -6.162 1.00 0.00 O ATOM 924 OE2 GLU A 62 4.768 16.157 -8.123 1.00 0.00 O ATOM 0 HA GLU A 62 5.258 12.243 -4.913 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.788 14.244 -4.887 1.00 0.00 H new ATOM 0 HB3 GLU A 62 5.127 15.232 -4.336 1.00 0.00 H new ATOM 0 HG2 GLU A 62 6.368 14.760 -6.452 1.00 0.00 H new ATOM 0 HG3 GLU A 62 5.067 13.722 -7.000 1.00 0.00 H new ATOM 931 N ALA A 63 7.542 14.036 -3.284 1.00 0.00 N ATOM 932 CA ALA A 63 8.959 14.320 -3.212 1.00 0.00 C ATOM 933 C ALA A 63 9.732 13.032 -3.129 1.00 0.00 C ATOM 934 O ALA A 63 10.787 12.894 -3.741 1.00 0.00 O ATOM 935 CB ALA A 63 9.334 15.178 -1.991 1.00 0.00 C ATOM 0 H ALA A 63 6.992 14.412 -2.511 1.00 0.00 H new ATOM 0 HA ALA A 63 9.209 14.879 -4.114 1.00 0.00 H new ATOM 0 HB1 ALA A 63 10.409 15.359 -1.990 1.00 0.00 H new ATOM 0 HB2 ALA A 63 8.806 16.130 -2.040 1.00 0.00 H new ATOM 0 HB3 ALA A 63 9.053 14.654 -1.078 1.00 0.00 H new ATOM 941 N THR A 64 9.218 12.054 -2.357 1.00 0.00 N ATOM 942 CA THR A 64 9.902 10.786 -2.207 1.00 0.00 C ATOM 943 C THR A 64 9.943 10.075 -3.530 1.00 0.00 C ATOM 944 O THR A 64 10.974 9.530 -3.922 1.00 0.00 O ATOM 945 CB THR A 64 9.229 9.872 -1.214 1.00 0.00 C ATOM 946 OG1 THR A 64 9.221 10.476 0.073 1.00 0.00 O ATOM 947 CG2 THR A 64 9.978 8.529 -1.164 1.00 0.00 C ATOM 0 H THR A 64 8.342 12.130 -1.840 1.00 0.00 H new ATOM 0 HA THR A 64 10.903 11.015 -1.841 1.00 0.00 H new ATOM 0 HB THR A 64 8.199 9.697 -1.524 1.00 0.00 H new ATOM 0 HG1 THR A 64 8.781 9.878 0.712 1.00 0.00 H new ATOM 0 HG21 THR A 64 9.492 7.868 -0.446 1.00 0.00 H new ATOM 0 HG22 THR A 64 9.963 8.067 -2.151 1.00 0.00 H new ATOM 0 HG23 THR A 64 11.010 8.699 -0.859 1.00 0.00 H new ATOM 955 N LEU A 65 8.806 10.070 -4.252 1.00 0.00 N ATOM 956 CA LEU A 65 8.739 9.380 -5.521 1.00 0.00 C ATOM 957 C LEU A 65 9.669 10.037 -6.506 1.00 0.00 C ATOM 958 O LEU A 65 10.373 9.361 -7.258 1.00 0.00 O ATOM 959 CB LEU A 65 7.324 9.396 -6.130 1.00 0.00 C ATOM 960 CG LEU A 65 6.304 8.593 -5.300 1.00 0.00 C ATOM 961 CD1 LEU A 65 4.886 8.725 -5.877 1.00 0.00 C ATOM 962 CD2 LEU A 65 6.715 7.119 -5.165 1.00 0.00 C ATOM 0 H LEU A 65 7.942 10.533 -3.970 1.00 0.00 H new ATOM 0 HA LEU A 65 9.024 8.346 -5.328 1.00 0.00 H new ATOM 0 HB2 LEU A 65 6.983 10.428 -6.216 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.364 8.988 -7.140 1.00 0.00 H new ATOM 0 HG LEU A 65 6.296 9.021 -4.297 1.00 0.00 H new ATOM 0 HD11 LEU A 65 4.190 8.147 -5.269 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.587 9.773 -5.872 1.00 0.00 H new ATOM 0 HD13 LEU A 65 4.873 8.349 -6.900 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.971 6.586 -4.573 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.782 6.668 -6.155 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.684 7.055 -4.671 1.00 0.00 H new ATOM 974 N GLN A 66 9.692 11.382 -6.515 1.00 0.00 N ATOM 975 CA GLN A 66 10.537 12.105 -7.438 1.00 0.00 C ATOM 976 C GLN A 66 11.983 11.927 -7.088 1.00 0.00 C ATOM 977 O GLN A 66 12.821 11.829 -7.976 1.00 0.00 O ATOM 978 CB GLN A 66 10.225 13.614 -7.495 1.00 0.00 C ATOM 979 CG GLN A 66 8.967 13.902 -8.319 1.00 0.00 C ATOM 980 CD GLN A 66 9.317 13.657 -9.781 1.00 0.00 C ATOM 981 OE1 GLN A 66 9.960 14.482 -10.422 1.00 0.00 O ATOM 982 NE2 GLN A 66 8.918 12.478 -10.318 1.00 0.00 N ATOM 0 H GLN A 66 9.136 11.971 -5.895 1.00 0.00 H new ATOM 0 HA GLN A 66 10.328 11.682 -8.421 1.00 0.00 H new ATOM 0 HB2 GLN A 66 10.093 13.997 -6.483 1.00 0.00 H new ATOM 0 HB3 GLN A 66 11.073 14.145 -7.928 1.00 0.00 H new ATOM 0 HG2 GLN A 66 8.147 13.256 -8.007 1.00 0.00 H new ATOM 0 HG3 GLN A 66 8.637 14.930 -8.170 1.00 0.00 H new ATOM 0 HE21 GLN A 66 8.384 11.816 -9.755 1.00 0.00 H new ATOM 0 HE22 GLN A 66 9.151 12.253 -11.285 1.00 0.00 H new ATOM 991 N ALA A 67 12.318 11.894 -5.789 1.00 0.00 N ATOM 992 CA ALA A 67 13.701 11.758 -5.398 1.00 0.00 C ATOM 993 C ALA A 67 14.261 10.457 -5.906 1.00 0.00 C ATOM 994 O ALA A 67 15.394 10.417 -6.365 1.00 0.00 O ATOM 995 CB ALA A 67 13.901 11.800 -3.872 1.00 0.00 C ATOM 0 H ALA A 67 11.655 11.959 -5.017 1.00 0.00 H new ATOM 0 HA ALA A 67 14.223 12.609 -5.836 1.00 0.00 H new ATOM 0 HB1 ALA A 67 14.961 11.693 -3.641 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.539 12.752 -3.484 1.00 0.00 H new ATOM 0 HB3 ALA A 67 13.345 10.985 -3.410 1.00 0.00 H new ATOM 1001 N MET A 68 13.485 9.354 -5.839 1.00 0.00 N ATOM 1002 CA MET A 68 14.001 8.083 -6.295 1.00 0.00 C ATOM 1003 C MET A 68 14.014 8.045 -7.799 1.00 0.00 C ATOM 1004 O MET A 68 14.969 7.552 -8.397 1.00 0.00 O ATOM 1005 CB MET A 68 13.194 6.880 -5.774 1.00 0.00 C ATOM 1006 CG MET A 68 13.963 6.066 -4.730 1.00 0.00 C ATOM 1007 SD MET A 68 14.811 7.100 -3.492 1.00 0.00 S ATOM 1008 CE MET A 68 13.344 7.363 -2.459 1.00 0.00 C ATOM 0 H MET A 68 12.530 9.333 -5.482 1.00 0.00 H new ATOM 0 HA MET A 68 15.011 7.999 -5.895 1.00 0.00 H new ATOM 0 HB2 MET A 68 12.260 7.235 -5.338 1.00 0.00 H new ATOM 0 HB3 MET A 68 12.930 6.234 -6.611 1.00 0.00 H new ATOM 0 HG2 MET A 68 13.271 5.395 -4.221 1.00 0.00 H new ATOM 0 HG3 MET A 68 14.698 5.441 -5.236 1.00 0.00 H new ATOM 0 HE1 MET A 68 13.022 8.401 -2.541 1.00 0.00 H new ATOM 0 HE2 MET A 68 12.541 6.707 -2.794 1.00 0.00 H new ATOM 0 HE3 MET A 68 13.586 7.139 -1.420 1.00 0.00 H new ATOM 1018 N ASN A 69 12.944 8.551 -8.454 1.00 0.00 N ATOM 1019 CA ASN A 69 12.896 8.551 -9.895 1.00 0.00 C ATOM 1020 C ASN A 69 14.060 9.356 -10.427 1.00 0.00 C ATOM 1021 O ASN A 69 14.766 8.918 -11.336 1.00 0.00 O ATOM 1022 CB ASN A 69 11.572 9.153 -10.429 1.00 0.00 C ATOM 1023 CG ASN A 69 11.582 9.387 -11.938 1.00 0.00 C ATOM 1024 OD1 ASN A 69 11.825 10.495 -12.402 1.00 0.00 O ATOM 1025 ND2 ASN A 69 11.304 8.322 -12.722 1.00 0.00 N ATOM 0 H ASN A 69 12.125 8.953 -7.998 1.00 0.00 H new ATOM 0 HA ASN A 69 12.954 7.517 -10.235 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.749 8.484 -10.177 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.380 10.099 -9.923 1.00 0.00 H new ATOM 0 HD21 ASN A 69 11.292 8.425 -13.737 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.107 7.415 -12.299 1.00 0.00 H new ATOM 1032 N MET A 70 14.292 10.556 -9.861 1.00 0.00 N ATOM 1033 CA MET A 70 15.376 11.387 -10.322 1.00 0.00 C ATOM 1034 C MET A 70 16.700 10.794 -9.900 1.00 0.00 C ATOM 1035 O MET A 70 17.702 10.982 -10.581 1.00 0.00 O ATOM 1036 CB MET A 70 15.306 12.826 -9.775 1.00 0.00 C ATOM 1037 CG MET A 70 14.133 13.617 -10.366 1.00 0.00 C ATOM 1038 SD MET A 70 13.940 15.267 -9.623 1.00 0.00 S ATOM 1039 CE MET A 70 15.424 15.971 -10.399 1.00 0.00 C ATOM 0 H MET A 70 13.743 10.950 -9.097 1.00 0.00 H new ATOM 0 HA MET A 70 15.286 11.427 -11.408 1.00 0.00 H new ATOM 0 HB2 MET A 70 15.210 12.795 -8.690 1.00 0.00 H new ATOM 0 HB3 MET A 70 16.239 13.343 -9.998 1.00 0.00 H new ATOM 0 HG2 MET A 70 14.279 13.724 -11.441 1.00 0.00 H new ATOM 0 HG3 MET A 70 13.212 13.051 -10.224 1.00 0.00 H new ATOM 0 HE1 MET A 70 15.179 16.935 -10.845 1.00 0.00 H new ATOM 0 HE2 MET A 70 16.199 16.107 -9.645 1.00 0.00 H new ATOM 0 HE3 MET A 70 15.786 15.294 -11.173 1.00 0.00 H new ATOM 1049 N ALA A 71 16.742 10.070 -8.756 1.00 0.00 N ATOM 1050 CA ALA A 71 17.995 9.524 -8.274 1.00 0.00 C ATOM 1051 C ALA A 71 18.581 8.533 -9.251 1.00 0.00 C ATOM 1052 O ALA A 71 19.782 8.579 -9.529 1.00 0.00 O ATOM 1053 CB ALA A 71 17.856 8.808 -6.919 1.00 0.00 C ATOM 0 H ALA A 71 15.931 9.863 -8.173 1.00 0.00 H new ATOM 0 HA ALA A 71 18.651 10.387 -8.159 1.00 0.00 H new ATOM 0 HB1 ALA A 71 18.827 8.421 -6.611 1.00 0.00 H new ATOM 0 HB2 ALA A 71 17.492 9.512 -6.171 1.00 0.00 H new ATOM 0 HB3 ALA A 71 17.150 7.983 -7.014 1.00 0.00 H new ATOM 1059 N PHE A 72 17.764 7.611 -9.814 1.00 0.00 N ATOM 1060 CA PHE A 72 18.328 6.633 -10.718 1.00 0.00 C ATOM 1061 C PHE A 72 18.574 7.280 -12.053 1.00 0.00 C ATOM 1062 O PHE A 72 19.571 6.992 -12.710 1.00 0.00 O ATOM 1063 CB PHE A 72 17.456 5.364 -10.923 1.00 0.00 C ATOM 1064 CG PHE A 72 16.280 5.528 -11.836 1.00 0.00 C ATOM 1065 CD1 PHE A 72 16.423 5.333 -13.196 1.00 0.00 C ATOM 1066 CD2 PHE A 72 15.041 5.864 -11.338 1.00 0.00 C ATOM 1067 CE1 PHE A 72 15.348 5.475 -14.037 1.00 0.00 C ATOM 1068 CE2 PHE A 72 13.967 6.004 -12.184 1.00 0.00 C ATOM 1069 CZ PHE A 72 14.120 5.812 -13.531 1.00 0.00 C ATOM 0 H PHE A 72 16.759 7.539 -9.656 1.00 0.00 H new ATOM 0 HA PHE A 72 19.254 6.293 -10.254 1.00 0.00 H new ATOM 0 HB2 PHE A 72 18.090 4.569 -11.315 1.00 0.00 H new ATOM 0 HB3 PHE A 72 17.094 5.032 -9.950 1.00 0.00 H new ATOM 0 HD1 PHE A 72 17.388 5.067 -13.601 1.00 0.00 H new ATOM 0 HD2 PHE A 72 14.912 6.018 -10.277 1.00 0.00 H new ATOM 0 HE1 PHE A 72 15.470 5.321 -15.099 1.00 0.00 H new ATOM 0 HE2 PHE A 72 12.998 6.267 -11.785 1.00 0.00 H new ATOM 0 HZ PHE A 72 13.275 5.926 -14.193 1.00 0.00 H new ATOM 1079 N ALA A 73 17.670 8.188 -12.480 1.00 0.00 N ATOM 1080 CA ALA A 73 17.834 8.830 -13.761 1.00 0.00 C ATOM 1081 C ALA A 73 19.096 9.652 -13.745 1.00 0.00 C ATOM 1082 O ALA A 73 19.827 9.688 -14.728 1.00 0.00 O ATOM 1083 CB ALA A 73 16.659 9.756 -14.124 1.00 0.00 C ATOM 0 H ALA A 73 16.844 8.475 -11.955 1.00 0.00 H new ATOM 0 HA ALA A 73 17.878 8.038 -14.509 1.00 0.00 H new ATOM 0 HB1 ALA A 73 16.841 10.210 -15.098 1.00 0.00 H new ATOM 0 HB2 ALA A 73 15.737 9.176 -14.160 1.00 0.00 H new ATOM 0 HB3 ALA A 73 16.566 10.539 -13.371 1.00 0.00 H new ATOM 1089 N SER A 74 19.370 10.343 -12.618 1.00 0.00 N ATOM 1090 CA SER A 74 20.556 11.168 -12.514 1.00 0.00 C ATOM 1091 C SER A 74 21.782 10.294 -12.601 1.00 0.00 C ATOM 1092 O SER A 74 22.760 10.654 -13.252 1.00 0.00 O ATOM 1093 CB SER A 74 20.625 11.958 -11.191 1.00 0.00 C ATOM 1094 OG SER A 74 21.796 12.770 -11.150 1.00 0.00 O ATOM 0 H SER A 74 18.783 10.336 -11.784 1.00 0.00 H new ATOM 0 HA SER A 74 20.512 11.885 -13.334 1.00 0.00 H new ATOM 0 HB2 SER A 74 19.739 12.584 -11.089 1.00 0.00 H new ATOM 0 HB3 SER A 74 20.626 11.267 -10.348 1.00 0.00 H new ATOM 0 HG SER A 74 21.822 13.265 -10.304 1.00 0.00 H new ATOM 1100 N SER A 75 21.763 9.129 -11.917 1.00 0.00 N ATOM 1101 CA SER A 75 22.915 8.247 -11.925 1.00 0.00 C ATOM 1102 C SER A 75 23.162 7.746 -13.326 1.00 0.00 C ATOM 1103 O SER A 75 24.305 7.715 -13.795 1.00 0.00 O ATOM 1104 CB SER A 75 22.732 7.018 -11.016 1.00 0.00 C ATOM 1105 OG SER A 75 22.632 7.423 -9.657 1.00 0.00 O ATOM 0 H SER A 75 20.971 8.796 -11.367 1.00 0.00 H new ATOM 0 HA SER A 75 23.755 8.833 -11.552 1.00 0.00 H new ATOM 0 HB2 SER A 75 21.835 6.472 -11.307 1.00 0.00 H new ATOM 0 HB3 SER A 75 23.574 6.337 -11.139 1.00 0.00 H new ATOM 0 HG SER A 75 21.749 7.816 -9.497 1.00 0.00 H new ATOM 1111 N MET A 76 22.088 7.345 -14.039 1.00 0.00 N ATOM 1112 CA MET A 76 22.246 6.845 -15.384 1.00 0.00 C ATOM 1113 C MET A 76 22.663 7.983 -16.275 1.00 0.00 C ATOM 1114 O MET A 76 23.447 7.798 -17.201 1.00 0.00 O ATOM 1115 CB MET A 76 20.953 6.223 -15.953 1.00 0.00 C ATOM 1116 CG MET A 76 20.877 4.710 -15.713 1.00 0.00 C ATOM 1117 SD MET A 76 20.164 4.280 -14.096 1.00 0.00 S ATOM 1118 CE MET A 76 21.051 2.703 -13.934 1.00 0.00 C ATOM 0 H MET A 76 21.127 7.364 -13.697 1.00 0.00 H new ATOM 0 HA MET A 76 22.999 6.058 -15.351 1.00 0.00 H new ATOM 0 HB2 MET A 76 20.089 6.705 -15.495 1.00 0.00 H new ATOM 0 HB3 MET A 76 20.898 6.422 -17.023 1.00 0.00 H new ATOM 0 HG2 MET A 76 20.278 4.253 -16.501 1.00 0.00 H new ATOM 0 HG3 MET A 76 21.878 4.286 -15.787 1.00 0.00 H new ATOM 0 HE1 MET A 76 20.711 2.185 -13.037 1.00 0.00 H new ATOM 0 HE2 MET A 76 20.853 2.083 -14.808 1.00 0.00 H new ATOM 0 HE3 MET A 76 22.122 2.894 -13.859 1.00 0.00 H new ATOM 1128 N ALA A 77 22.138 9.198 -16.004 1.00 0.00 N ATOM 1129 CA ALA A 77 22.469 10.355 -16.800 1.00 0.00 C ATOM 1130 C ALA A 77 23.945 10.624 -16.698 1.00 0.00 C ATOM 1131 O ALA A 77 24.574 11.006 -17.678 1.00 0.00 O ATOM 1132 CB ALA A 77 21.723 11.628 -16.359 1.00 0.00 C ATOM 0 H ALA A 77 21.488 9.382 -15.240 1.00 0.00 H new ATOM 0 HA ALA A 77 22.167 10.125 -17.822 1.00 0.00 H new ATOM 0 HB1 ALA A 77 22.016 12.461 -16.997 1.00 0.00 H new ATOM 0 HB2 ALA A 77 20.648 11.467 -16.443 1.00 0.00 H new ATOM 0 HB3 ALA A 77 21.976 11.858 -15.324 1.00 0.00 H new ATOM 1138 N GLU A 78 24.538 10.439 -15.497 1.00 0.00 N ATOM 1139 CA GLU A 78 25.954 10.691 -15.325 1.00 0.00 C ATOM 1140 C GLU A 78 26.729 9.770 -16.231 1.00 0.00 C ATOM 1141 O GLU A 78 27.691 10.186 -16.881 1.00 0.00 O ATOM 1142 CB GLU A 78 26.433 10.464 -13.877 1.00 0.00 C ATOM 1143 CG GLU A 78 27.926 10.787 -13.684 1.00 0.00 C ATOM 1144 CD GLU A 78 28.292 10.600 -12.216 1.00 0.00 C ATOM 1145 OE1 GLU A 78 27.390 10.231 -11.415 1.00 0.00 O ATOM 1146 OE2 GLU A 78 29.483 10.825 -11.876 1.00 0.00 O ATOM 0 H GLU A 78 24.054 10.122 -14.657 1.00 0.00 H new ATOM 0 HA GLU A 78 26.125 11.739 -15.571 1.00 0.00 H new ATOM 0 HB2 GLU A 78 25.842 11.084 -13.202 1.00 0.00 H new ATOM 0 HB3 GLU A 78 26.252 9.426 -13.598 1.00 0.00 H new ATOM 0 HG2 GLU A 78 28.536 10.135 -14.309 1.00 0.00 H new ATOM 0 HG3 GLU A 78 28.132 11.811 -13.995 1.00 0.00 H new ATOM 1153 N LEU A 79 26.322 8.484 -16.291 1.00 0.00 N ATOM 1154 CA LEU A 79 27.009 7.529 -17.139 1.00 0.00 C ATOM 1155 C LEU A 79 26.821 7.938 -18.579 1.00 0.00 C ATOM 1156 O LEU A 79 27.738 7.840 -19.394 1.00 0.00 O ATOM 1157 CB LEU A 79 26.467 6.092 -16.987 1.00 0.00 C ATOM 1158 CG LEU A 79 26.792 5.466 -15.620 1.00 0.00 C ATOM 1159 CD1 LEU A 79 26.048 4.135 -15.427 1.00 0.00 C ATOM 1160 CD2 LEU A 79 28.307 5.287 -15.429 1.00 0.00 C ATOM 0 H LEU A 79 25.534 8.103 -15.767 1.00 0.00 H new ATOM 0 HA LEU A 79 28.057 7.531 -16.840 1.00 0.00 H new ATOM 0 HB2 LEU A 79 25.386 6.101 -17.128 1.00 0.00 H new ATOM 0 HB3 LEU A 79 26.886 5.467 -17.775 1.00 0.00 H new ATOM 0 HG LEU A 79 26.444 6.157 -14.853 1.00 0.00 H new ATOM 0 HD11 LEU A 79 26.298 3.717 -14.452 1.00 0.00 H new ATOM 0 HD12 LEU A 79 24.973 4.307 -15.483 1.00 0.00 H new ATOM 0 HD13 LEU A 79 26.345 3.436 -16.209 1.00 0.00 H new ATOM 0 HD21 LEU A 79 28.501 4.842 -14.453 1.00 0.00 H new ATOM 0 HD22 LEU A 79 28.697 4.634 -16.209 1.00 0.00 H new ATOM 0 HD23 LEU A 79 28.799 6.258 -15.489 1.00 0.00 H new ATOM 1172 N VAL A 80 25.602 8.408 -18.909 1.00 0.00 N ATOM 1173 CA VAL A 80 25.279 8.819 -20.258 1.00 0.00 C ATOM 1174 C VAL A 80 26.120 10.006 -20.653 1.00 0.00 C ATOM 1175 O VAL A 80 26.596 10.081 -21.779 1.00 0.00 O ATOM 1176 CB VAL A 80 23.821 9.181 -20.412 1.00 0.00 C ATOM 1177 CG1 VAL A 80 23.596 9.840 -21.786 1.00 0.00 C ATOM 1178 CG2 VAL A 80 22.997 7.893 -20.241 1.00 0.00 C ATOM 0 H VAL A 80 24.833 8.506 -18.246 1.00 0.00 H new ATOM 0 HA VAL A 80 25.490 7.970 -20.908 1.00 0.00 H new ATOM 0 HB VAL A 80 23.506 9.902 -19.658 1.00 0.00 H new ATOM 0 HG11 VAL A 80 22.543 10.101 -21.896 1.00 0.00 H new ATOM 0 HG12 VAL A 80 24.203 10.742 -21.861 1.00 0.00 H new ATOM 0 HG13 VAL A 80 23.882 9.144 -22.575 1.00 0.00 H new ATOM 0 HG21 VAL A 80 21.937 8.123 -20.347 1.00 0.00 H new ATOM 0 HG22 VAL A 80 23.290 7.170 -21.002 1.00 0.00 H new ATOM 0 HG23 VAL A 80 23.180 7.473 -19.252 1.00 0.00 H new ATOM 1188 N ILE A 81 26.329 10.971 -19.731 1.00 0.00 N ATOM 1189 CA ILE A 81 27.106 12.151 -20.061 1.00 0.00 C ATOM 1190 C ILE A 81 28.496 11.750 -20.456 1.00 0.00 C ATOM 1191 O ILE A 81 29.023 12.223 -21.466 1.00 0.00 O ATOM 1192 CB ILE A 81 27.241 13.113 -18.912 1.00 0.00 C ATOM 1193 CG1 ILE A 81 25.891 13.779 -18.612 1.00 0.00 C ATOM 1194 CG2 ILE A 81 28.326 14.145 -19.285 1.00 0.00 C ATOM 1195 CD1 ILE A 81 25.872 14.498 -17.262 1.00 0.00 C ATOM 0 H ILE A 81 25.972 10.944 -18.776 1.00 0.00 H new ATOM 0 HA ILE A 81 26.570 12.643 -20.872 1.00 0.00 H new ATOM 0 HB ILE A 81 27.540 12.593 -18.002 1.00 0.00 H new ATOM 0 HG12 ILE A 81 25.660 14.493 -19.402 1.00 0.00 H new ATOM 0 HG13 ILE A 81 25.106 13.022 -18.627 1.00 0.00 H new ATOM 0 HG21 ILE A 81 28.446 14.857 -18.469 1.00 0.00 H new ATOM 0 HG22 ILE A 81 29.271 13.632 -19.461 1.00 0.00 H new ATOM 0 HG23 ILE A 81 28.028 14.676 -20.189 1.00 0.00 H new ATOM 0 HD11 ILE A 81 24.893 14.950 -17.104 1.00 0.00 H new ATOM 0 HD12 ILE A 81 26.074 13.782 -16.465 1.00 0.00 H new ATOM 0 HD13 ILE A 81 26.636 15.276 -17.253 1.00 0.00 H new ATOM 1207 N ALA A 82 29.128 10.858 -19.669 1.00 0.00 N ATOM 1208 CA ALA A 82 30.481 10.456 -19.966 1.00 0.00 C ATOM 1209 C ALA A 82 30.523 9.810 -21.323 1.00 0.00 C ATOM 1210 O ALA A 82 31.399 10.101 -22.130 1.00 0.00 O ATOM 1211 CB ALA A 82 31.045 9.453 -18.943 1.00 0.00 C ATOM 0 H ALA A 82 28.719 10.420 -18.844 1.00 0.00 H new ATOM 0 HA ALA A 82 31.092 11.358 -19.930 1.00 0.00 H new ATOM 0 HB1 ALA A 82 32.066 9.187 -19.219 1.00 0.00 H new ATOM 0 HB2 ALA A 82 31.043 9.905 -17.951 1.00 0.00 H new ATOM 0 HB3 ALA A 82 30.426 8.556 -18.934 1.00 0.00 H new ATOM 1217 N GLU A 83 29.549 8.935 -21.617 1.00 0.00 N ATOM 1218 CA GLU A 83 29.536 8.260 -22.891 1.00 0.00 C ATOM 1219 C GLU A 83 29.256 9.246 -23.999 1.00 0.00 C ATOM 1220 O GLU A 83 29.851 9.165 -25.064 1.00 0.00 O ATOM 1221 CB GLU A 83 28.478 7.142 -22.964 1.00 0.00 C ATOM 1222 CG GLU A 83 28.839 5.936 -22.080 1.00 0.00 C ATOM 1223 CD GLU A 83 27.684 4.940 -22.096 1.00 0.00 C ATOM 1224 OE1 GLU A 83 26.582 5.308 -22.586 1.00 0.00 O ATOM 1225 OE2 GLU A 83 27.893 3.792 -21.622 1.00 0.00 O ATOM 0 H GLU A 83 28.780 8.692 -20.992 1.00 0.00 H new ATOM 0 HA GLU A 83 30.521 7.808 -23.008 1.00 0.00 H new ATOM 0 HB2 GLU A 83 27.511 7.539 -22.655 1.00 0.00 H new ATOM 0 HB3 GLU A 83 28.372 6.813 -23.998 1.00 0.00 H new ATOM 0 HG2 GLU A 83 29.750 5.461 -22.446 1.00 0.00 H new ATOM 0 HG3 GLU A 83 29.038 6.264 -21.060 1.00 0.00 H new ATOM 1232 N ASP A 84 28.347 10.211 -23.758 1.00 0.00 N ATOM 1233 CA ASP A 84 27.971 11.170 -24.780 1.00 0.00 C ATOM 1234 C ASP A 84 29.144 12.025 -25.188 1.00 0.00 C ATOM 1235 O ASP A 84 29.394 12.204 -26.378 1.00 0.00 O ATOM 1236 CB ASP A 84 26.836 12.110 -24.311 1.00 0.00 C ATOM 1237 CG ASP A 84 26.322 13.016 -25.423 1.00 0.00 C ATOM 1238 OD1 ASP A 84 26.858 14.148 -25.559 1.00 0.00 O ATOM 1239 OD2 ASP A 84 25.384 12.589 -26.146 1.00 0.00 O ATOM 0 H ASP A 84 27.870 10.335 -22.865 1.00 0.00 H new ATOM 0 HA ASP A 84 27.622 10.579 -25.627 1.00 0.00 H new ATOM 0 HB2 ASP A 84 26.011 11.511 -23.926 1.00 0.00 H new ATOM 0 HB3 ASP A 84 27.197 12.724 -23.486 1.00 0.00 H new ATOM 1244 N VAL A 85 29.883 12.586 -24.214 1.00 0.00 N ATOM 1245 CA VAL A 85 30.994 13.450 -24.549 1.00 0.00 C ATOM 1246 C VAL A 85 32.073 12.651 -25.232 1.00 0.00 C ATOM 1247 O VAL A 85 32.643 13.084 -26.233 1.00 0.00 O ATOM 1248 CB VAL A 85 31.594 14.128 -23.341 1.00 0.00 C ATOM 1249 CG1 VAL A 85 32.881 14.864 -23.762 1.00 0.00 C ATOM 1250 CG2 VAL A 85 30.541 15.087 -22.755 1.00 0.00 C ATOM 0 H VAL A 85 29.725 12.452 -23.215 1.00 0.00 H new ATOM 0 HA VAL A 85 30.600 14.223 -25.208 1.00 0.00 H new ATOM 0 HB VAL A 85 31.867 13.405 -22.572 1.00 0.00 H new ATOM 0 HG11 VAL A 85 33.319 15.356 -22.894 1.00 0.00 H new ATOM 0 HG12 VAL A 85 33.593 14.147 -24.171 1.00 0.00 H new ATOM 0 HG13 VAL A 85 32.642 15.610 -24.520 1.00 0.00 H new ATOM 0 HG21 VAL A 85 30.953 15.589 -21.880 1.00 0.00 H new ATOM 0 HG22 VAL A 85 30.268 15.830 -23.505 1.00 0.00 H new ATOM 0 HG23 VAL A 85 29.655 14.522 -22.466 1.00 0.00 H new ATOM 1260 N ASN A 86 32.374 11.454 -24.697 1.00 0.00 N ATOM 1261 CA ASN A 86 33.429 10.639 -25.253 1.00 0.00 C ATOM 1262 C ASN A 86 33.048 10.096 -26.612 1.00 0.00 C ATOM 1263 O ASN A 86 33.889 10.041 -27.508 1.00 0.00 O ATOM 1264 CB ASN A 86 33.808 9.473 -24.320 1.00 0.00 C ATOM 1265 CG ASN A 86 34.655 9.960 -23.146 1.00 0.00 C ATOM 1266 OD1 ASN A 86 35.875 10.034 -23.237 1.00 0.00 O ATOM 1267 ND2 ASN A 86 33.989 10.344 -22.024 1.00 0.00 N ATOM 0 H ASN A 86 31.899 11.048 -23.891 1.00 0.00 H new ATOM 0 HA ASN A 86 34.297 11.289 -25.361 1.00 0.00 H new ATOM 0 HB2 ASN A 86 32.903 8.994 -23.946 1.00 0.00 H new ATOM 0 HB3 ASN A 86 34.359 8.718 -24.881 1.00 0.00 H new ATOM 0 HD21 ASN A 86 34.506 10.708 -21.223 1.00 0.00 H new ATOM 0 HD22 ASN A 86 32.973 10.268 -21.983 1.00 0.00 H new ATOM 1274 N ASN A 87 31.781 9.674 -26.809 1.00 0.00 N ATOM 1275 CA ASN A 87 31.394 9.140 -28.094 1.00 0.00 C ATOM 1276 C ASN A 87 29.885 9.181 -28.179 1.00 0.00 C ATOM 1277 O ASN A 87 29.194 8.324 -27.622 1.00 0.00 O ATOM 1278 CB ASN A 87 31.851 7.678 -28.297 1.00 0.00 C ATOM 1279 CG ASN A 87 31.708 7.221 -29.744 1.00 0.00 C ATOM 1280 OD1 ASN A 87 30.970 7.814 -30.527 1.00 0.00 O ATOM 1281 ND2 ASN A 87 32.429 6.135 -30.112 1.00 0.00 N ATOM 0 H ASN A 87 31.042 9.698 -26.107 1.00 0.00 H new ATOM 0 HA ASN A 87 31.871 9.744 -28.866 1.00 0.00 H new ATOM 0 HB2 ASN A 87 32.892 7.579 -27.989 1.00 0.00 H new ATOM 0 HB3 ASN A 87 31.264 7.024 -27.652 1.00 0.00 H new ATOM 0 HD21 ASN A 87 32.370 5.783 -31.068 1.00 0.00 H new ATOM 0 HD22 ASN A 87 33.031 5.669 -29.433 1.00 0.00 H new ATOM 1288 N PRO A 88 29.353 10.150 -28.897 1.00 0.00 N ATOM 1289 CA PRO A 88 27.909 10.293 -29.045 1.00 0.00 C ATOM 1290 C PRO A 88 27.273 9.207 -29.864 1.00 0.00 C ATOM 1291 O PRO A 88 26.066 8.992 -29.790 1.00 0.00 O ATOM 1292 CB PRO A 88 27.731 11.658 -29.719 1.00 0.00 C ATOM 1293 CG PRO A 88 29.034 11.871 -30.479 1.00 0.00 C ATOM 1294 CD PRO A 88 30.102 11.184 -29.628 1.00 0.00 C ATOM 0 HA PRO A 88 27.415 10.217 -28.076 1.00 0.00 H new ATOM 0 HB2 PRO A 88 26.873 11.662 -30.391 1.00 0.00 H new ATOM 0 HB3 PRO A 88 27.565 12.446 -28.985 1.00 0.00 H new ATOM 0 HG2 PRO A 88 28.985 11.437 -31.477 1.00 0.00 H new ATOM 0 HG3 PRO A 88 29.250 12.932 -30.603 1.00 0.00 H new ATOM 0 HD2 PRO A 88 30.887 10.748 -30.246 1.00 0.00 H new ATOM 0 HD3 PRO A 88 30.584 11.886 -28.947 1.00 0.00 H new ATOM 1302 N ASP A 89 28.081 8.492 -30.678 1.00 0.00 N ATOM 1303 CA ASP A 89 27.546 7.427 -31.503 1.00 0.00 C ATOM 1304 C ASP A 89 27.077 6.320 -30.598 1.00 0.00 C ATOM 1305 O ASP A 89 26.056 5.672 -30.847 1.00 0.00 O ATOM 1306 CB ASP A 89 28.579 6.839 -32.489 1.00 0.00 C ATOM 1307 CG ASP A 89 28.923 7.802 -33.616 1.00 0.00 C ATOM 1308 OD1 ASP A 89 28.178 8.803 -33.791 1.00 0.00 O ATOM 1309 OD2 ASP A 89 29.936 7.548 -34.317 1.00 0.00 O ATOM 0 H ASP A 89 29.086 8.642 -30.769 1.00 0.00 H new ATOM 0 HA ASP A 89 26.736 7.852 -32.096 1.00 0.00 H new ATOM 0 HB2 ASP A 89 29.488 6.580 -31.946 1.00 0.00 H new ATOM 0 HB3 ASP A 89 28.187 5.914 -32.913 1.00 0.00 H new ATOM 1314 N SER A 90 27.840 6.089 -29.511 1.00 0.00 N ATOM 1315 CA SER A 90 27.516 5.049 -28.564 1.00 0.00 C ATOM 1316 C SER A 90 26.189 5.354 -27.932 1.00 0.00 C ATOM 1317 O SER A 90 25.417 4.452 -27.641 1.00 0.00 O ATOM 1318 CB SER A 90 28.556 4.916 -27.433 1.00 0.00 C ATOM 1319 OG SER A 90 29.802 4.478 -27.963 1.00 0.00 O ATOM 0 H SER A 90 28.681 6.619 -29.283 1.00 0.00 H new ATOM 0 HA SER A 90 27.499 4.112 -29.121 1.00 0.00 H new ATOM 0 HB2 SER A 90 28.683 5.875 -26.930 1.00 0.00 H new ATOM 0 HB3 SER A 90 28.202 4.208 -26.684 1.00 0.00 H new ATOM 0 HG SER A 90 30.456 4.398 -27.238 1.00 0.00 H new ATOM 1325 N ILE A 91 25.909 6.651 -27.699 1.00 0.00 N ATOM 1326 CA ILE A 91 24.669 7.053 -27.067 1.00 0.00 C ATOM 1327 C ILE A 91 23.499 6.654 -27.923 1.00 0.00 C ATOM 1328 O ILE A 91 22.488 6.196 -27.405 1.00 0.00 O ATOM 1329 CB ILE A 91 24.587 8.539 -26.830 1.00 0.00 C ATOM 1330 CG1 ILE A 91 25.653 8.964 -25.815 1.00 0.00 C ATOM 1331 CG2 ILE A 91 23.164 8.897 -26.350 1.00 0.00 C ATOM 1332 CD1 ILE A 91 25.496 8.258 -24.468 1.00 0.00 C ATOM 0 H ILE A 91 26.530 7.423 -27.943 1.00 0.00 H new ATOM 0 HA ILE A 91 24.642 6.548 -26.101 1.00 0.00 H new ATOM 0 HB ILE A 91 24.782 9.080 -27.756 1.00 0.00 H new ATOM 0 HG12 ILE A 91 26.642 8.749 -26.221 1.00 0.00 H new ATOM 0 HG13 ILE A 91 25.597 10.042 -25.665 1.00 0.00 H new ATOM 0 HG21 ILE A 91 23.098 9.971 -26.177 1.00 0.00 H new ATOM 0 HG22 ILE A 91 22.440 8.607 -27.111 1.00 0.00 H new ATOM 0 HG23 ILE A 91 22.948 8.366 -25.423 1.00 0.00 H new ATOM 0 HD11 ILE A 91 26.277 8.596 -23.787 1.00 0.00 H new ATOM 0 HD12 ILE A 91 24.519 8.493 -24.046 1.00 0.00 H new ATOM 0 HD13 ILE A 91 25.580 7.181 -24.610 1.00 0.00 H new ATOM 1344 N ALA A 92 23.593 6.831 -29.257 1.00 0.00 N ATOM 1345 CA ALA A 92 22.478 6.487 -30.113 1.00 0.00 C ATOM 1346 C ALA A 92 22.180 5.013 -29.989 1.00 0.00 C ATOM 1347 O ALA A 92 21.020 4.611 -29.876 1.00 0.00 O ATOM 1348 CB ALA A 92 22.748 6.794 -31.596 1.00 0.00 C ATOM 0 H ALA A 92 24.412 7.201 -29.739 1.00 0.00 H new ATOM 0 HA ALA A 92 21.635 7.095 -29.786 1.00 0.00 H new ATOM 0 HB1 ALA A 92 21.877 6.515 -32.190 1.00 0.00 H new ATOM 0 HB2 ALA A 92 22.944 7.859 -31.717 1.00 0.00 H new ATOM 0 HB3 ALA A 92 23.614 6.225 -31.933 1.00 0.00 H new ATOM 1354 N GLU A 93 23.232 4.170 -29.995 1.00 0.00 N ATOM 1355 CA GLU A 93 23.030 2.738 -29.894 1.00 0.00 C ATOM 1356 C GLU A 93 22.553 2.393 -28.503 1.00 0.00 C ATOM 1357 O GLU A 93 21.679 1.545 -28.325 1.00 0.00 O ATOM 1358 CB GLU A 93 24.319 1.935 -30.162 1.00 0.00 C ATOM 1359 CG GLU A 93 24.791 2.020 -31.624 1.00 0.00 C ATOM 1360 CD GLU A 93 23.702 1.464 -32.534 1.00 0.00 C ATOM 1361 OE1 GLU A 93 23.212 0.337 -32.252 1.00 0.00 O ATOM 1362 OE2 GLU A 93 23.350 2.157 -33.525 1.00 0.00 O ATOM 0 H GLU A 93 24.206 4.463 -30.068 1.00 0.00 H new ATOM 0 HA GLU A 93 22.293 2.471 -30.651 1.00 0.00 H new ATOM 0 HB2 GLU A 93 25.111 2.302 -29.509 1.00 0.00 H new ATOM 0 HB3 GLU A 93 24.150 0.890 -29.901 1.00 0.00 H new ATOM 0 HG2 GLU A 93 25.010 3.054 -31.889 1.00 0.00 H new ATOM 0 HG3 GLU A 93 25.714 1.455 -31.754 1.00 0.00 H new ATOM 1369 N LYS A 94 23.134 3.058 -27.483 1.00 0.00 N ATOM 1370 CA LYS A 94 22.790 2.794 -26.103 1.00 0.00 C ATOM 1371 C LYS A 94 21.350 3.169 -25.855 1.00 0.00 C ATOM 1372 O LYS A 94 20.631 2.458 -25.161 1.00 0.00 O ATOM 1373 CB LYS A 94 23.671 3.596 -25.124 1.00 0.00 C ATOM 1374 CG LYS A 94 23.415 3.253 -23.654 1.00 0.00 C ATOM 1375 CD LYS A 94 23.822 1.819 -23.313 1.00 0.00 C ATOM 1376 CE LYS A 94 23.689 1.511 -21.823 1.00 0.00 C ATOM 1377 NZ LYS A 94 24.095 0.117 -21.551 1.00 0.00 N ATOM 0 H LYS A 94 23.843 3.780 -27.607 1.00 0.00 H new ATOM 0 HA LYS A 94 22.953 1.730 -25.930 1.00 0.00 H new ATOM 0 HB2 LYS A 94 24.720 3.410 -25.355 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.495 4.661 -25.277 1.00 0.00 H new ATOM 0 HG2 LYS A 94 23.968 3.946 -23.020 1.00 0.00 H new ATOM 0 HG3 LYS A 94 22.357 3.391 -23.430 1.00 0.00 H new ATOM 0 HD2 LYS A 94 23.203 1.124 -23.881 1.00 0.00 H new ATOM 0 HD3 LYS A 94 24.854 1.654 -23.624 1.00 0.00 H new ATOM 0 HE2 LYS A 94 24.309 2.197 -21.246 1.00 0.00 H new ATOM 0 HE3 LYS A 94 22.659 1.666 -21.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 23.528 -0.263 -20.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 23.941 -0.462 -22.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 25.102 0.093 -21.294 1.00 0.00 H new ATOM 1391 N THR A 95 20.903 4.306 -26.426 1.00 0.00 N ATOM 1392 CA THR A 95 19.545 4.771 -26.216 1.00 0.00 C ATOM 1393 C THR A 95 18.582 3.752 -26.753 1.00 0.00 C ATOM 1394 O THR A 95 17.575 3.449 -26.115 1.00 0.00 O ATOM 1395 CB THR A 95 19.257 6.087 -26.897 1.00 0.00 C ATOM 1396 OG1 THR A 95 20.124 7.093 -26.389 1.00 0.00 O ATOM 1397 CG2 THR A 95 17.793 6.483 -26.636 1.00 0.00 C ATOM 0 H THR A 95 21.468 4.904 -27.029 1.00 0.00 H new ATOM 0 HA THR A 95 19.428 4.915 -25.142 1.00 0.00 H new ATOM 0 HB THR A 95 19.422 5.985 -27.970 1.00 0.00 H new ATOM 0 HG1 THR A 95 21.054 6.849 -26.578 1.00 0.00 H new ATOM 0 HG21 THR A 95 17.580 7.433 -27.126 1.00 0.00 H new ATOM 0 HG22 THR A 95 17.131 5.713 -27.034 1.00 0.00 H new ATOM 0 HG23 THR A 95 17.629 6.583 -25.563 1.00 0.00 H new ATOM 1405 N GLU A 96 18.862 3.198 -27.951 1.00 0.00 N ATOM 1406 CA GLU A 96 17.968 2.220 -28.530 1.00 0.00 C ATOM 1407 C GLU A 96 17.906 1.012 -27.629 1.00 0.00 C ATOM 1408 O GLU A 96 16.827 0.474 -27.374 1.00 0.00 O ATOM 1409 CB GLU A 96 18.416 1.754 -29.931 1.00 0.00 C ATOM 1410 CG GLU A 96 17.438 0.750 -30.567 1.00 0.00 C ATOM 1411 CD GLU A 96 17.924 0.395 -31.968 1.00 0.00 C ATOM 1412 OE1 GLU A 96 18.983 0.933 -32.388 1.00 0.00 O ATOM 1413 OE2 GLU A 96 17.238 -0.423 -32.636 1.00 0.00 O ATOM 0 H GLU A 96 19.685 3.416 -28.512 1.00 0.00 H new ATOM 0 HA GLU A 96 16.994 2.699 -28.631 1.00 0.00 H new ATOM 0 HB2 GLU A 96 18.514 2.622 -30.583 1.00 0.00 H new ATOM 0 HB3 GLU A 96 19.403 1.297 -29.858 1.00 0.00 H new ATOM 0 HG2 GLU A 96 17.371 -0.149 -29.954 1.00 0.00 H new ATOM 0 HG3 GLU A 96 16.437 1.179 -30.614 1.00 0.00 H new ATOM 1420 N ALA A 97 19.075 0.557 -27.122 1.00 0.00 N ATOM 1421 CA ALA A 97 19.111 -0.607 -26.263 1.00 0.00 C ATOM 1422 C ALA A 97 18.357 -0.332 -24.986 1.00 0.00 C ATOM 1423 O ALA A 97 17.606 -1.177 -24.505 1.00 0.00 O ATOM 1424 CB ALA A 97 20.545 -1.023 -25.888 1.00 0.00 C ATOM 0 H ALA A 97 19.984 0.984 -27.300 1.00 0.00 H new ATOM 0 HA ALA A 97 18.650 -1.419 -26.826 1.00 0.00 H new ATOM 0 HB1 ALA A 97 20.512 -1.901 -25.243 1.00 0.00 H new ATOM 0 HB2 ALA A 97 21.104 -1.259 -26.794 1.00 0.00 H new ATOM 0 HB3 ALA A 97 21.036 -0.204 -25.362 1.00 0.00 H new ATOM 1430 N LEU A 98 18.545 0.872 -24.406 1.00 0.00 N ATOM 1431 CA LEU A 98 17.880 1.215 -23.164 1.00 0.00 C ATOM 1432 C LEU A 98 16.402 1.315 -23.378 1.00 0.00 C ATOM 1433 O LEU A 98 15.625 0.929 -22.515 1.00 0.00 O ATOM 1434 CB LEU A 98 18.358 2.546 -22.550 1.00 0.00 C ATOM 1435 CG LEU A 98 19.785 2.470 -21.982 1.00 0.00 C ATOM 1436 CD1 LEU A 98 20.306 3.867 -21.604 1.00 0.00 C ATOM 1437 CD2 LEU A 98 19.861 1.507 -20.785 1.00 0.00 C ATOM 0 H LEU A 98 19.147 1.604 -24.784 1.00 0.00 H new ATOM 0 HA LEU A 98 18.133 0.414 -22.469 1.00 0.00 H new ATOM 0 HB2 LEU A 98 18.317 3.326 -23.311 1.00 0.00 H new ATOM 0 HB3 LEU A 98 17.672 2.840 -21.755 1.00 0.00 H new ATOM 0 HG LEU A 98 20.431 2.073 -22.765 1.00 0.00 H new ATOM 0 HD11 LEU A 98 21.317 3.783 -21.205 1.00 0.00 H new ATOM 0 HD12 LEU A 98 20.317 4.503 -22.489 1.00 0.00 H new ATOM 0 HD13 LEU A 98 19.654 4.307 -20.849 1.00 0.00 H new ATOM 0 HD21 LEU A 98 20.883 1.476 -20.407 1.00 0.00 H new ATOM 0 HD22 LEU A 98 19.193 1.853 -19.997 1.00 0.00 H new ATOM 0 HD23 LEU A 98 19.561 0.508 -21.102 1.00 0.00 H new ATOM 1449 N SER A 99 15.971 1.856 -24.533 1.00 0.00 N ATOM 1450 CA SER A 99 14.554 1.999 -24.791 1.00 0.00 C ATOM 1451 C SER A 99 13.923 0.634 -24.787 1.00 0.00 C ATOM 1452 O SER A 99 12.849 0.437 -24.218 1.00 0.00 O ATOM 1453 CB SER A 99 14.250 2.667 -26.149 1.00 0.00 C ATOM 1454 OG SER A 99 12.844 2.803 -26.338 1.00 0.00 O ATOM 0 H SER A 99 16.581 2.190 -25.279 1.00 0.00 H new ATOM 0 HA SER A 99 14.148 2.641 -24.009 1.00 0.00 H new ATOM 0 HB2 SER A 99 14.725 3.647 -26.192 1.00 0.00 H new ATOM 0 HB3 SER A 99 14.675 2.071 -26.957 1.00 0.00 H new ATOM 0 HG SER A 99 12.670 3.230 -27.203 1.00 0.00 H new ATOM 1460 N GLN A 100 14.584 -0.343 -25.438 1.00 0.00 N ATOM 1461 CA GLN A 100 14.051 -1.684 -25.492 1.00 0.00 C ATOM 1462 C GLN A 100 14.098 -2.298 -24.118 1.00 0.00 C ATOM 1463 O GLN A 100 13.173 -3.004 -23.713 1.00 0.00 O ATOM 1464 CB GLN A 100 14.833 -2.602 -26.452 1.00 0.00 C ATOM 1465 CG GLN A 100 14.627 -2.220 -27.925 1.00 0.00 C ATOM 1466 CD GLN A 100 15.586 -3.038 -28.782 1.00 0.00 C ATOM 1467 OE1 GLN A 100 16.668 -3.414 -28.343 1.00 0.00 O ATOM 1468 NE2 GLN A 100 15.181 -3.321 -30.044 1.00 0.00 N ATOM 0 H GLN A 100 15.473 -0.215 -25.921 1.00 0.00 H new ATOM 0 HA GLN A 100 13.029 -1.600 -25.860 1.00 0.00 H new ATOM 0 HB2 GLN A 100 15.895 -2.554 -26.212 1.00 0.00 H new ATOM 0 HB3 GLN A 100 14.519 -3.635 -26.300 1.00 0.00 H new ATOM 0 HG2 GLN A 100 13.596 -2.411 -28.224 1.00 0.00 H new ATOM 0 HG3 GLN A 100 14.808 -1.155 -28.068 1.00 0.00 H new ATOM 0 HE21 GLN A 100 14.274 -2.991 -30.375 1.00 0.00 H new ATOM 0 HE22 GLN A 100 15.783 -3.864 -30.663 1.00 0.00 H new ATOM 1477 N ALA A 101 15.193 -2.047 -23.366 1.00 0.00 N ATOM 1478 CA ALA A 101 15.336 -2.619 -22.044 1.00 0.00 C ATOM 1479 C ALA A 101 14.263 -2.089 -21.132 1.00 0.00 C ATOM 1480 O ALA A 101 13.687 -2.835 -20.345 1.00 0.00 O ATOM 1481 CB ALA A 101 16.697 -2.305 -21.406 1.00 0.00 C ATOM 0 H ALA A 101 15.971 -1.458 -23.663 1.00 0.00 H new ATOM 0 HA ALA A 101 15.252 -3.699 -22.167 1.00 0.00 H new ATOM 0 HB1 ALA A 101 16.748 -2.759 -20.416 1.00 0.00 H new ATOM 0 HB2 ALA A 101 17.494 -2.708 -22.031 1.00 0.00 H new ATOM 0 HB3 ALA A 101 16.817 -1.225 -21.317 1.00 0.00 H new ATOM 1487 N LEU A 102 13.981 -0.776 -21.215 1.00 0.00 N ATOM 1488 CA LEU A 102 12.977 -0.177 -20.363 1.00 0.00 C ATOM 1489 C LEU A 102 11.628 -0.743 -20.697 1.00 0.00 C ATOM 1490 O LEU A 102 10.838 -1.034 -19.804 1.00 0.00 O ATOM 1491 CB LEU A 102 12.897 1.356 -20.508 1.00 0.00 C ATOM 1492 CG LEU A 102 14.100 2.085 -19.885 1.00 0.00 C ATOM 1493 CD1 LEU A 102 14.142 3.563 -20.311 1.00 0.00 C ATOM 1494 CD2 LEU A 102 14.094 1.958 -18.354 1.00 0.00 C ATOM 0 H LEU A 102 14.436 -0.129 -21.859 1.00 0.00 H new ATOM 0 HA LEU A 102 13.268 -0.407 -19.338 1.00 0.00 H new ATOM 0 HB2 LEU A 102 12.833 1.612 -21.566 1.00 0.00 H new ATOM 0 HB3 LEU A 102 11.981 1.712 -20.037 1.00 0.00 H new ATOM 0 HG LEU A 102 15.003 1.604 -20.260 1.00 0.00 H new ATOM 0 HD11 LEU A 102 15.004 4.049 -19.854 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.223 3.627 -21.396 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.229 4.062 -19.985 1.00 0.00 H new ATOM 0 HD21 LEU A 102 14.956 2.483 -17.942 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.178 2.396 -17.956 1.00 0.00 H new ATOM 0 HD23 LEU A 102 14.144 0.905 -18.076 1.00 0.00 H new ATOM 1506 N LYS A 103 11.335 -0.928 -22.001 1.00 0.00 N ATOM 1507 CA LYS A 103 10.052 -1.437 -22.407 1.00 0.00 C ATOM 1508 C LYS A 103 9.845 -2.817 -21.842 1.00 0.00 C ATOM 1509 O LYS A 103 8.793 -3.116 -21.276 1.00 0.00 O ATOM 1510 CB LYS A 103 9.946 -1.517 -23.937 1.00 0.00 C ATOM 1511 CG LYS A 103 8.599 -2.027 -24.434 1.00 0.00 C ATOM 1512 CD LYS A 103 8.552 -2.058 -25.958 1.00 0.00 C ATOM 1513 CE LYS A 103 7.218 -2.572 -26.501 1.00 0.00 C ATOM 1514 NZ LYS A 103 7.233 -2.572 -27.980 1.00 0.00 N ATOM 0 H LYS A 103 11.977 -0.728 -22.768 1.00 0.00 H new ATOM 0 HA LYS A 103 9.291 -0.754 -22.031 1.00 0.00 H new ATOM 0 HB2 LYS A 103 10.127 -0.527 -24.357 1.00 0.00 H new ATOM 0 HB3 LYS A 103 10.733 -2.171 -24.313 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.418 -3.027 -24.041 1.00 0.00 H new ATOM 0 HG3 LYS A 103 7.802 -1.387 -24.055 1.00 0.00 H new ATOM 0 HD2 LYS A 103 8.733 -1.054 -26.343 1.00 0.00 H new ATOM 0 HD3 LYS A 103 9.358 -2.691 -26.329 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.032 -3.581 -26.132 1.00 0.00 H new ATOM 0 HE3 LYS A 103 6.404 -1.945 -26.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 6.321 -2.923 -28.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 7.390 -1.604 -28.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 7.998 -3.189 -28.319 1.00 0.00 H new ATOM 1528 N GLN A 104 10.859 -3.691 -21.978 1.00 0.00 N ATOM 1529 CA GLN A 104 10.738 -5.047 -21.489 1.00 0.00 C ATOM 1530 C GLN A 104 10.720 -5.059 -19.983 1.00 0.00 C ATOM 1531 O GLN A 104 9.981 -5.827 -19.369 1.00 0.00 O ATOM 1532 CB GLN A 104 11.889 -5.957 -21.956 1.00 0.00 C ATOM 1533 CG GLN A 104 11.843 -6.239 -23.464 1.00 0.00 C ATOM 1534 CD GLN A 104 13.001 -7.161 -23.820 1.00 0.00 C ATOM 1535 OE1 GLN A 104 13.236 -8.168 -23.162 1.00 0.00 O ATOM 1536 NE2 GLN A 104 13.750 -6.811 -24.895 1.00 0.00 N ATOM 0 H GLN A 104 11.753 -3.473 -22.418 1.00 0.00 H new ATOM 0 HA GLN A 104 9.804 -5.433 -21.898 1.00 0.00 H new ATOM 0 HB2 GLN A 104 12.841 -5.489 -21.706 1.00 0.00 H new ATOM 0 HB3 GLN A 104 11.845 -6.901 -21.412 1.00 0.00 H new ATOM 0 HG2 GLN A 104 10.894 -6.702 -23.734 1.00 0.00 H new ATOM 0 HG3 GLN A 104 11.914 -5.308 -24.026 1.00 0.00 H new ATOM 0 HE21 GLN A 104 13.525 -5.966 -25.420 1.00 0.00 H new ATOM 0 HE22 GLN A 104 14.538 -7.393 -25.179 1.00 0.00 H new ATOM 1545 N CYS A 105 11.552 -4.206 -19.351 1.00 0.00 N ATOM 1546 CA CYS A 105 11.631 -4.186 -17.905 1.00 0.00 C ATOM 1547 C CYS A 105 10.321 -3.724 -17.324 1.00 0.00 C ATOM 1548 O CYS A 105 9.807 -4.345 -16.401 1.00 0.00 O ATOM 1549 CB CYS A 105 12.747 -3.269 -17.357 1.00 0.00 C ATOM 1550 SG CYS A 105 12.947 -3.461 -15.556 1.00 0.00 S ATOM 0 H CYS A 105 12.162 -3.539 -19.823 1.00 0.00 H new ATOM 0 HA CYS A 105 11.864 -5.208 -17.608 1.00 0.00 H new ATOM 0 HB2 CYS A 105 13.688 -3.502 -17.855 1.00 0.00 H new ATOM 0 HB3 CYS A 105 12.512 -2.230 -17.589 1.00 0.00 H new ATOM 1555 N PHE A 106 9.738 -2.621 -17.855 1.00 0.00 N ATOM 1556 CA PHE A 106 8.490 -2.112 -17.316 1.00 0.00 C ATOM 1557 C PHE A 106 7.396 -3.120 -17.539 1.00 0.00 C ATOM 1558 O PHE A 106 6.527 -3.304 -16.687 1.00 0.00 O ATOM 1559 CB PHE A 106 8.040 -0.780 -17.950 1.00 0.00 C ATOM 1560 CG PHE A 106 8.764 0.417 -17.421 1.00 0.00 C ATOM 1561 CD1 PHE A 106 9.528 1.204 -18.256 1.00 0.00 C ATOM 1562 CD2 PHE A 106 8.684 0.747 -16.085 1.00 0.00 C ATOM 1563 CE1 PHE A 106 10.196 2.299 -17.764 1.00 0.00 C ATOM 1564 CE2 PHE A 106 9.353 1.844 -15.594 1.00 0.00 C ATOM 1565 CZ PHE A 106 10.108 2.620 -16.434 1.00 0.00 C ATOM 0 H PHE A 106 10.116 -2.089 -18.639 1.00 0.00 H new ATOM 0 HA PHE A 106 8.671 -1.933 -16.256 1.00 0.00 H new ATOM 0 HB2 PHE A 106 8.187 -0.834 -19.029 1.00 0.00 H new ATOM 0 HB3 PHE A 106 6.971 -0.651 -17.780 1.00 0.00 H new ATOM 0 HD1 PHE A 106 9.602 0.958 -19.305 1.00 0.00 H new ATOM 0 HD2 PHE A 106 8.091 0.139 -15.418 1.00 0.00 H new ATOM 0 HE1 PHE A 106 10.792 2.909 -18.427 1.00 0.00 H new ATOM 0 HE2 PHE A 106 9.283 2.094 -14.546 1.00 0.00 H new ATOM 0 HZ PHE A 106 10.632 3.482 -16.049 1.00 0.00 H new ATOM 1575 N ARG A 107 7.413 -3.797 -18.702 1.00 0.00 N ATOM 1576 CA ARG A 107 6.395 -4.775 -19.013 1.00 0.00 C ATOM 1577 C ARG A 107 6.447 -5.906 -18.013 1.00 0.00 C ATOM 1578 O ARG A 107 5.410 -6.416 -17.593 1.00 0.00 O ATOM 1579 CB ARG A 107 6.567 -5.380 -20.423 1.00 0.00 C ATOM 1580 CG ARG A 107 5.424 -6.325 -20.812 1.00 0.00 C ATOM 1581 CD ARG A 107 5.607 -6.923 -22.210 1.00 0.00 C ATOM 1582 NE ARG A 107 6.779 -7.848 -22.180 1.00 0.00 N ATOM 1583 CZ ARG A 107 7.213 -8.451 -23.327 1.00 0.00 C ATOM 1584 NH1 ARG A 107 6.575 -8.213 -24.510 1.00 0.00 N ATOM 1585 NH2 ARG A 107 8.286 -9.293 -23.286 1.00 0.00 N ATOM 0 H ARG A 107 8.121 -3.675 -19.426 1.00 0.00 H new ATOM 0 HA ARG A 107 5.439 -4.253 -18.972 1.00 0.00 H new ATOM 0 HB2 ARG A 107 6.629 -4.573 -21.154 1.00 0.00 H new ATOM 0 HB3 ARG A 107 7.511 -5.923 -20.467 1.00 0.00 H new ATOM 0 HG2 ARG A 107 5.359 -7.131 -20.081 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.479 -5.783 -20.773 1.00 0.00 H new ATOM 0 HD2 ARG A 107 4.708 -7.460 -22.513 1.00 0.00 H new ATOM 0 HD3 ARG A 107 5.768 -6.132 -22.942 1.00 0.00 H new ATOM 0 HE ARG A 107 7.258 -8.031 -21.298 1.00 0.00 H new ATOM 0 HH11 ARG A 107 5.773 -7.584 -24.539 1.00 0.00 H new ATOM 0 HH12 ARG A 107 6.901 -8.664 -25.365 1.00 0.00 H new ATOM 0 HH21 ARG A 107 8.761 -9.471 -22.401 1.00 0.00 H new ATOM 0 HH22 ARG A 107 8.613 -9.745 -24.140 1.00 0.00 H new ATOM 1599 N SER A 108 7.663 -6.321 -17.601 1.00 0.00 N ATOM 1600 CA SER A 108 7.788 -7.443 -16.693 1.00 0.00 C ATOM 1601 C SER A 108 7.744 -6.995 -15.252 1.00 0.00 C ATOM 1602 O SER A 108 7.813 -7.838 -14.358 1.00 0.00 O ATOM 1603 CB SER A 108 9.104 -8.218 -16.889 1.00 0.00 C ATOM 1604 OG SER A 108 9.166 -8.753 -18.204 1.00 0.00 O ATOM 0 H SER A 108 8.546 -5.896 -17.884 1.00 0.00 H new ATOM 0 HA SER A 108 6.943 -8.092 -16.922 1.00 0.00 H new ATOM 0 HB2 SER A 108 9.953 -7.557 -16.717 1.00 0.00 H new ATOM 0 HB3 SER A 108 9.173 -9.023 -16.157 1.00 0.00 H new ATOM 0 HG SER A 108 9.456 -8.055 -18.828 1.00 0.00 H new ATOM 1610 N THR A 109 7.636 -5.675 -14.963 1.00 0.00 N ATOM 1611 CA THR A 109 7.610 -5.248 -13.579 1.00 0.00 C ATOM 1612 C THR A 109 6.298 -4.585 -13.288 1.00 0.00 C ATOM 1613 O THR A 109 5.454 -5.137 -12.585 1.00 0.00 O ATOM 1614 CB THR A 109 8.714 -4.282 -13.221 1.00 0.00 C ATOM 1615 OG1 THR A 109 8.863 -3.286 -14.225 1.00 0.00 O ATOM 1616 CG2 THR A 109 10.026 -5.065 -13.060 1.00 0.00 C ATOM 0 H THR A 109 7.569 -4.927 -15.654 1.00 0.00 H new ATOM 0 HA THR A 109 7.754 -6.147 -12.980 1.00 0.00 H new ATOM 0 HB THR A 109 8.460 -3.782 -12.287 1.00 0.00 H new ATOM 0 HG1 THR A 109 9.113 -3.710 -15.072 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.831 -4.377 -12.801 1.00 0.00 H new ATOM 0 HG22 THR A 109 9.913 -5.805 -12.268 1.00 0.00 H new ATOM 0 HG23 THR A 109 10.266 -5.569 -13.996 1.00 0.00 H new ATOM 1624 N MET A 110 6.103 -3.362 -13.821 1.00 0.00 N ATOM 1625 CA MET A 110 4.882 -2.629 -13.575 1.00 0.00 C ATOM 1626 C MET A 110 3.745 -3.291 -14.292 1.00 0.00 C ATOM 1627 O MET A 110 2.599 -3.209 -13.853 1.00 0.00 O ATOM 1628 CB MET A 110 4.944 -1.170 -14.050 1.00 0.00 C ATOM 1629 CG MET A 110 5.877 -0.310 -13.199 1.00 0.00 C ATOM 1630 SD MET A 110 5.974 1.402 -13.791 1.00 0.00 S ATOM 1631 CE MET A 110 4.266 1.804 -13.321 1.00 0.00 C ATOM 0 H MET A 110 6.777 -2.880 -14.416 1.00 0.00 H new ATOM 0 HA MET A 110 4.739 -2.630 -12.494 1.00 0.00 H new ATOM 0 HB2 MET A 110 5.278 -1.144 -15.087 1.00 0.00 H new ATOM 0 HB3 MET A 110 3.942 -0.742 -14.028 1.00 0.00 H new ATOM 0 HG2 MET A 110 5.529 -0.315 -12.166 1.00 0.00 H new ATOM 0 HG3 MET A 110 6.875 -0.749 -13.202 1.00 0.00 H new ATOM 0 HE1 MET A 110 4.189 2.870 -13.106 1.00 0.00 H new ATOM 0 HE2 MET A 110 3.594 1.549 -14.140 1.00 0.00 H new ATOM 0 HE3 MET A 110 3.989 1.234 -12.434 1.00 0.00 H new ATOM 1641 N GLY A 111 4.029 -3.961 -15.427 1.00 0.00 N ATOM 1642 CA GLY A 111 2.974 -4.613 -16.157 1.00 0.00 C ATOM 1643 C GLY A 111 2.292 -3.597 -17.019 1.00 0.00 C ATOM 1644 O GLY A 111 1.104 -3.715 -17.309 1.00 0.00 O ATOM 0 H GLY A 111 4.960 -4.052 -15.833 1.00 0.00 H new ATOM 0 HA2 GLY A 111 3.379 -5.418 -16.770 1.00 0.00 H new ATOM 0 HA3 GLY A 111 2.260 -5.065 -15.468 1.00 0.00 H new ATOM 1648 N THR A 112 3.040 -2.564 -17.456 1.00 0.00 N ATOM 1649 CA THR A 112 2.457 -1.546 -18.292 1.00 0.00 C ATOM 1650 C THR A 112 3.465 -1.218 -19.349 1.00 0.00 C ATOM 1651 O THR A 112 4.672 -1.343 -19.139 1.00 0.00 O ATOM 1652 CB THR A 112 2.099 -0.281 -17.542 1.00 0.00 C ATOM 1653 OG1 THR A 112 1.368 0.602 -18.387 1.00 0.00 O ATOM 1654 CG2 THR A 112 3.384 0.412 -17.048 1.00 0.00 C ATOM 0 H THR A 112 4.028 -2.431 -17.239 1.00 0.00 H new ATOM 0 HA THR A 112 1.524 -1.932 -18.702 1.00 0.00 H new ATOM 0 HB THR A 112 1.478 -0.542 -16.685 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.140 1.416 -17.891 1.00 0.00 H new ATOM 0 HG21 THR A 112 3.122 1.322 -16.509 1.00 0.00 H new ATOM 0 HG22 THR A 112 3.927 -0.260 -16.384 1.00 0.00 H new ATOM 0 HG23 THR A 112 4.013 0.664 -17.902 1.00 0.00 H new ATOM 1662 N VAL A 113 2.973 -0.789 -20.530 1.00 0.00 N ATOM 1663 CA VAL A 113 3.851 -0.455 -21.624 1.00 0.00 C ATOM 1664 C VAL A 113 3.838 1.045 -21.783 1.00 0.00 C ATOM 1665 O VAL A 113 4.110 1.581 -22.857 1.00 0.00 O ATOM 1666 CB VAL A 113 3.436 -1.114 -22.922 1.00 0.00 C ATOM 1667 CG1 VAL A 113 2.145 -0.452 -23.448 1.00 0.00 C ATOM 1668 CG2 VAL A 113 4.607 -1.023 -23.921 1.00 0.00 C ATOM 0 H VAL A 113 1.980 -0.673 -20.730 1.00 0.00 H new ATOM 0 HA VAL A 113 4.851 -0.822 -21.395 1.00 0.00 H new ATOM 0 HB VAL A 113 3.211 -2.170 -22.772 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.847 -0.927 -24.383 1.00 0.00 H new ATOM 0 HG12 VAL A 113 1.350 -0.569 -22.712 1.00 0.00 H new ATOM 0 HG13 VAL A 113 2.325 0.609 -23.622 1.00 0.00 H new ATOM 0 HG21 VAL A 113 4.321 -1.495 -24.861 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.852 0.024 -24.100 1.00 0.00 H new ATOM 0 HG23 VAL A 113 5.477 -1.534 -23.509 1.00 0.00 H new ATOM 1678 N ASN A 114 3.526 1.769 -20.685 1.00 0.00 N ATOM 1679 CA ASN A 114 3.487 3.210 -20.741 1.00 0.00 C ATOM 1680 C ASN A 114 4.897 3.694 -20.959 1.00 0.00 C ATOM 1681 O ASN A 114 5.798 3.404 -20.170 1.00 0.00 O ATOM 1682 CB ASN A 114 2.942 3.839 -19.440 1.00 0.00 C ATOM 1683 CG ASN A 114 2.664 5.329 -19.589 1.00 0.00 C ATOM 1684 OD1 ASN A 114 2.857 5.903 -20.654 1.00 0.00 O ATOM 1685 ND2 ASN A 114 2.197 5.974 -18.491 1.00 0.00 N ATOM 0 H ASN A 114 3.304 1.369 -19.773 1.00 0.00 H new ATOM 0 HA ASN A 114 2.818 3.507 -21.549 1.00 0.00 H new ATOM 0 HB2 ASN A 114 2.024 3.328 -19.149 1.00 0.00 H new ATOM 0 HB3 ASN A 114 3.661 3.685 -18.636 1.00 0.00 H new ATOM 0 HD21 ASN A 114 1.993 6.973 -18.534 1.00 0.00 H new ATOM 0 HD22 ASN A 114 2.049 5.460 -17.622 1.00 0.00 H new ATOM 1692 N ARG A 115 5.105 4.475 -22.044 1.00 0.00 N ATOM 1693 CA ARG A 115 6.422 4.972 -22.358 1.00 0.00 C ATOM 1694 C ARG A 115 6.515 6.400 -21.903 1.00 0.00 C ATOM 1695 O ARG A 115 7.440 7.119 -22.275 1.00 0.00 O ATOM 1696 CB ARG A 115 6.736 4.929 -23.867 1.00 0.00 C ATOM 1697 CG ARG A 115 6.677 3.509 -24.438 1.00 0.00 C ATOM 1698 CD ARG A 115 6.977 3.463 -25.939 1.00 0.00 C ATOM 1699 NE ARG A 115 8.419 3.788 -26.146 1.00 0.00 N ATOM 1700 CZ ARG A 115 8.924 3.911 -27.411 1.00 0.00 C ATOM 1701 NH1 ARG A 115 8.106 3.755 -28.492 1.00 0.00 N ATOM 1702 NH2 ARG A 115 10.246 4.191 -27.590 1.00 0.00 N ATOM 0 H ARG A 115 4.374 4.760 -22.696 1.00 0.00 H new ATOM 0 HA ARG A 115 7.141 4.330 -21.850 1.00 0.00 H new ATOM 0 HB2 ARG A 115 6.027 5.561 -24.401 1.00 0.00 H new ATOM 0 HB3 ARG A 115 7.728 5.346 -24.040 1.00 0.00 H new ATOM 0 HG2 ARG A 115 7.392 2.879 -23.909 1.00 0.00 H new ATOM 0 HG3 ARG A 115 5.688 3.089 -24.256 1.00 0.00 H new ATOM 0 HD2 ARG A 115 6.750 2.475 -26.340 1.00 0.00 H new ATOM 0 HD3 ARG A 115 6.348 4.176 -26.473 1.00 0.00 H new ATOM 0 HE ARG A 115 9.031 3.919 -25.340 1.00 0.00 H new ATOM 0 HH11 ARG A 115 7.117 3.546 -28.357 1.00 0.00 H new ATOM 0 HH12 ARG A 115 8.484 3.847 -29.435 1.00 0.00 H new ATOM 0 HH21 ARG A 115 10.857 4.308 -26.781 1.00 0.00 H new ATOM 0 HH22 ARG A 115 10.625 4.283 -28.533 1.00 0.00 H new ATOM 1716 N GLN A 116 5.537 6.857 -21.090 1.00 0.00 N ATOM 1717 CA GLN A 116 5.555 8.217 -20.599 1.00 0.00 C ATOM 1718 C GLN A 116 6.769 8.400 -19.724 1.00 0.00 C ATOM 1719 O GLN A 116 7.435 9.435 -19.781 1.00 0.00 O ATOM 1720 CB GLN A 116 4.308 8.563 -19.763 1.00 0.00 C ATOM 1721 CG GLN A 116 4.265 10.035 -19.328 1.00 0.00 C ATOM 1722 CD GLN A 116 2.970 10.271 -18.558 1.00 0.00 C ATOM 1723 OE1 GLN A 116 2.137 9.377 -18.427 1.00 0.00 O ATOM 1724 NE2 GLN A 116 2.795 11.507 -18.031 1.00 0.00 N ATOM 0 H GLN A 116 4.744 6.299 -20.774 1.00 0.00 H new ATOM 0 HA GLN A 116 5.573 8.876 -21.467 1.00 0.00 H new ATOM 0 HB2 GLN A 116 3.414 8.335 -20.344 1.00 0.00 H new ATOM 0 HB3 GLN A 116 4.283 7.928 -18.878 1.00 0.00 H new ATOM 0 HG2 GLN A 116 5.126 10.271 -18.703 1.00 0.00 H new ATOM 0 HG3 GLN A 116 4.314 10.689 -20.198 1.00 0.00 H new ATOM 0 HE21 GLN A 116 3.510 12.223 -18.161 1.00 0.00 H new ATOM 0 HE22 GLN A 116 1.949 11.722 -17.504 1.00 0.00 H new ATOM 1733 N PHE A 117 7.088 7.383 -18.891 1.00 0.00 N ATOM 1734 CA PHE A 117 8.225 7.481 -18.001 1.00 0.00 C ATOM 1735 C PHE A 117 9.468 7.491 -18.839 1.00 0.00 C ATOM 1736 O PHE A 117 10.393 8.257 -18.594 1.00 0.00 O ATOM 1737 CB PHE A 117 8.353 6.278 -17.048 1.00 0.00 C ATOM 1738 CG PHE A 117 7.124 6.002 -16.255 1.00 0.00 C ATOM 1739 CD1 PHE A 117 6.274 5.000 -16.655 1.00 0.00 C ATOM 1740 CD2 PHE A 117 6.823 6.734 -15.128 1.00 0.00 C ATOM 1741 CE1 PHE A 117 5.131 4.728 -15.939 1.00 0.00 C ATOM 1742 CE2 PHE A 117 5.678 6.463 -14.411 1.00 0.00 C ATOM 1743 CZ PHE A 117 4.834 5.460 -14.818 1.00 0.00 C ATOM 0 H PHE A 117 6.572 6.505 -18.830 1.00 0.00 H new ATOM 0 HA PHE A 117 8.089 8.384 -17.406 1.00 0.00 H new ATOM 0 HB2 PHE A 117 8.605 5.391 -17.630 1.00 0.00 H new ATOM 0 HB3 PHE A 117 9.183 6.456 -16.364 1.00 0.00 H new ATOM 0 HD1 PHE A 117 6.504 4.422 -17.538 1.00 0.00 H new ATOM 0 HD2 PHE A 117 7.486 7.523 -14.805 1.00 0.00 H new ATOM 0 HE1 PHE A 117 4.468 3.938 -16.260 1.00 0.00 H new ATOM 0 HE2 PHE A 117 5.445 7.040 -13.528 1.00 0.00 H new ATOM 0 HZ PHE A 117 3.937 5.247 -14.256 1.00 0.00 H new ATOM 1753 N ILE A 118 9.493 6.623 -19.870 1.00 0.00 N ATOM 1754 CA ILE A 118 10.646 6.513 -20.739 1.00 0.00 C ATOM 1755 C ILE A 118 10.878 7.835 -21.422 1.00 0.00 C ATOM 1756 O ILE A 118 12.008 8.312 -21.506 1.00 0.00 O ATOM 1757 CB ILE A 118 10.456 5.465 -21.807 1.00 0.00 C ATOM 1758 CG1 ILE A 118 10.380 4.067 -21.169 1.00 0.00 C ATOM 1759 CG2 ILE A 118 11.623 5.569 -22.813 1.00 0.00 C ATOM 1760 CD1 ILE A 118 9.923 2.992 -22.157 1.00 0.00 C ATOM 0 H ILE A 118 8.723 5.997 -20.108 1.00 0.00 H new ATOM 0 HA ILE A 118 11.495 6.227 -20.118 1.00 0.00 H new ATOM 0 HB ILE A 118 9.518 5.630 -22.338 1.00 0.00 H new ATOM 0 HG12 ILE A 118 11.360 3.799 -20.774 1.00 0.00 H new ATOM 0 HG13 ILE A 118 9.692 4.094 -20.324 1.00 0.00 H new ATOM 0 HG21 ILE A 118 11.500 4.817 -23.592 1.00 0.00 H new ATOM 0 HG22 ILE A 118 11.627 6.561 -23.264 1.00 0.00 H new ATOM 0 HG23 ILE A 118 12.567 5.402 -22.294 1.00 0.00 H new ATOM 0 HD11 ILE A 118 9.888 2.026 -21.653 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.931 3.242 -22.533 1.00 0.00 H new ATOM 0 HD13 ILE A 118 10.625 2.941 -22.990 1.00 0.00 H new ATOM 1772 N THR A 119 9.794 8.456 -21.926 1.00 0.00 N ATOM 1773 CA THR A 119 9.906 9.720 -22.625 1.00 0.00 C ATOM 1774 C THR A 119 10.439 10.776 -21.691 1.00 0.00 C ATOM 1775 O THR A 119 11.330 11.541 -22.058 1.00 0.00 O ATOM 1776 CB THR A 119 8.585 10.207 -23.163 1.00 0.00 C ATOM 1777 OG1 THR A 119 8.056 9.259 -24.082 1.00 0.00 O ATOM 1778 CG2 THR A 119 8.794 11.559 -23.871 1.00 0.00 C ATOM 0 H THR A 119 8.843 8.094 -21.855 1.00 0.00 H new ATOM 0 HA THR A 119 10.581 9.550 -23.464 1.00 0.00 H new ATOM 0 HB THR A 119 7.881 10.330 -22.340 1.00 0.00 H new ATOM 0 HG1 THR A 119 7.794 8.447 -23.600 1.00 0.00 H new ATOM 0 HG21 THR A 119 7.841 11.916 -24.262 1.00 0.00 H new ATOM 0 HG22 THR A 119 9.189 12.285 -23.160 1.00 0.00 H new ATOM 0 HG23 THR A 119 9.500 11.434 -24.692 1.00 0.00 H new ATOM 1786 N GLU A 120 9.900 10.847 -20.453 1.00 0.00 N ATOM 1787 CA GLU A 120 10.344 11.859 -19.515 1.00 0.00 C ATOM 1788 C GLU A 120 11.791 11.630 -19.165 1.00 0.00 C ATOM 1789 O GLU A 120 12.572 12.579 -19.084 1.00 0.00 O ATOM 1790 CB GLU A 120 9.531 11.855 -18.204 1.00 0.00 C ATOM 1791 CG GLU A 120 8.095 12.364 -18.405 1.00 0.00 C ATOM 1792 CD GLU A 120 7.302 12.156 -17.117 1.00 0.00 C ATOM 1793 OE1 GLU A 120 7.808 11.441 -16.212 1.00 0.00 O ATOM 1794 OE2 GLU A 120 6.172 12.706 -17.030 1.00 0.00 O ATOM 0 H GLU A 120 9.174 10.223 -20.101 1.00 0.00 H new ATOM 0 HA GLU A 120 10.200 12.821 -20.006 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.502 10.843 -17.801 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.035 12.478 -17.465 1.00 0.00 H new ATOM 0 HG2 GLU A 120 8.105 13.421 -18.673 1.00 0.00 H new ATOM 0 HG3 GLU A 120 7.620 11.831 -19.229 1.00 0.00 H new ATOM 1801 N ILE A 121 12.185 10.357 -18.949 1.00 0.00 N ATOM 1802 CA ILE A 121 13.555 10.051 -18.600 1.00 0.00 C ATOM 1803 C ILE A 121 14.455 10.431 -19.744 1.00 0.00 C ATOM 1804 O ILE A 121 15.498 11.042 -19.542 1.00 0.00 O ATOM 1805 CB ILE A 121 13.764 8.590 -18.289 1.00 0.00 C ATOM 1806 CG1 ILE A 121 13.037 8.224 -16.983 1.00 0.00 C ATOM 1807 CG2 ILE A 121 15.280 8.315 -18.196 1.00 0.00 C ATOM 1808 CD1 ILE A 121 12.951 6.715 -16.762 1.00 0.00 C ATOM 0 H ILE A 121 11.570 9.546 -19.013 1.00 0.00 H new ATOM 0 HA ILE A 121 13.792 10.621 -17.702 1.00 0.00 H new ATOM 0 HB ILE A 121 13.346 7.968 -19.080 1.00 0.00 H new ATOM 0 HG12 ILE A 121 13.557 8.682 -16.141 1.00 0.00 H new ATOM 0 HG13 ILE A 121 12.031 8.643 -17.002 1.00 0.00 H new ATOM 0 HG21 ILE A 121 15.446 7.261 -17.971 1.00 0.00 H new ATOM 0 HG22 ILE A 121 15.754 8.562 -19.146 1.00 0.00 H new ATOM 0 HG23 ILE A 121 15.713 8.927 -17.405 1.00 0.00 H new ATOM 0 HD11 ILE A 121 12.429 6.513 -15.827 1.00 0.00 H new ATOM 0 HD12 ILE A 121 12.406 6.257 -17.588 1.00 0.00 H new ATOM 0 HD13 ILE A 121 13.956 6.296 -16.714 1.00 0.00 H new ATOM 1820 N LYS A 122 14.057 10.072 -20.980 1.00 0.00 N ATOM 1821 CA LYS A 122 14.865 10.371 -22.143 1.00 0.00 C ATOM 1822 C LYS A 122 15.012 11.862 -22.294 1.00 0.00 C ATOM 1823 O LYS A 122 16.101 12.361 -22.575 1.00 0.00 O ATOM 1824 CB LYS A 122 14.255 9.815 -23.447 1.00 0.00 C ATOM 1825 CG LYS A 122 15.115 10.101 -24.683 1.00 0.00 C ATOM 1826 CD LYS A 122 14.510 9.521 -25.965 1.00 0.00 C ATOM 1827 CE LYS A 122 15.363 9.814 -27.199 1.00 0.00 C ATOM 1828 NZ LYS A 122 14.741 9.227 -28.406 1.00 0.00 N ATOM 0 H LYS A 122 13.187 9.580 -21.182 1.00 0.00 H new ATOM 0 HA LYS A 122 15.831 9.893 -21.983 1.00 0.00 H new ATOM 0 HB2 LYS A 122 14.120 8.738 -23.347 1.00 0.00 H new ATOM 0 HB3 LYS A 122 13.266 10.249 -23.592 1.00 0.00 H new ATOM 0 HG2 LYS A 122 15.235 11.178 -24.797 1.00 0.00 H new ATOM 0 HG3 LYS A 122 16.111 9.683 -24.534 1.00 0.00 H new ATOM 0 HD2 LYS A 122 14.396 8.443 -25.854 1.00 0.00 H new ATOM 0 HD3 LYS A 122 13.512 9.934 -26.111 1.00 0.00 H new ATOM 0 HE2 LYS A 122 15.473 10.891 -27.326 1.00 0.00 H new ATOM 0 HE3 LYS A 122 16.364 9.405 -27.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 15.332 9.434 -29.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 14.658 8.197 -28.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 13.795 9.637 -28.543 1.00 0.00 H new ATOM 1842 N HIS A 123 13.903 12.608 -22.121 1.00 0.00 N ATOM 1843 CA HIS A 123 13.939 14.047 -22.271 1.00 0.00 C ATOM 1844 C HIS A 123 14.872 14.650 -21.251 1.00 0.00 C ATOM 1845 O HIS A 123 15.729 15.463 -21.594 1.00 0.00 O ATOM 1846 CB HIS A 123 12.554 14.699 -22.097 1.00 0.00 C ATOM 1847 CG HIS A 123 12.554 16.191 -22.296 1.00 0.00 C ATOM 1848 ND1 HIS A 123 12.737 17.037 -21.213 1.00 0.00 N ATOM 1849 CD2 HIS A 123 12.395 16.911 -23.442 1.00 0.00 C ATOM 1850 CE1 HIS A 123 12.684 18.253 -21.730 1.00 0.00 C ATOM 1851 NE2 HIS A 123 12.479 18.232 -23.068 1.00 0.00 N ATOM 0 H HIS A 123 12.988 12.228 -21.880 1.00 0.00 H new ATOM 0 HA HIS A 123 14.286 14.242 -23.286 1.00 0.00 H new ATOM 0 HB2 HIS A 123 11.859 14.248 -22.805 1.00 0.00 H new ATOM 0 HB3 HIS A 123 12.181 14.475 -21.098 1.00 0.00 H new ATOM 0 HD2 HIS A 123 12.236 16.524 -24.438 1.00 0.00 H new ATOM 0 HE1 HIS A 123 12.792 19.159 -21.151 1.00 0.00 H new ATOM 0 HE2 HIS A 123 12.401 19.042 -23.682 1.00 0.00 H new ATOM 1859 N LEU A 124 14.726 14.260 -19.963 1.00 0.00 N ATOM 1860 CA LEU A 124 15.565 14.821 -18.924 1.00 0.00 C ATOM 1861 C LEU A 124 16.995 14.401 -19.137 1.00 0.00 C ATOM 1862 O LEU A 124 17.915 15.193 -18.962 1.00 0.00 O ATOM 1863 CB LEU A 124 15.150 14.371 -17.507 1.00 0.00 C ATOM 1864 CG LEU A 124 13.811 14.977 -17.055 1.00 0.00 C ATOM 1865 CD1 LEU A 124 13.317 14.326 -15.753 1.00 0.00 C ATOM 1866 CD2 LEU A 124 13.906 16.506 -16.910 1.00 0.00 C ATOM 0 H LEU A 124 14.045 13.572 -19.641 1.00 0.00 H new ATOM 0 HA LEU A 124 15.450 15.903 -18.991 1.00 0.00 H new ATOM 0 HB2 LEU A 124 15.077 13.284 -17.483 1.00 0.00 H new ATOM 0 HB3 LEU A 124 15.929 14.654 -16.799 1.00 0.00 H new ATOM 0 HG LEU A 124 13.077 14.766 -17.832 1.00 0.00 H new ATOM 0 HD11 LEU A 124 12.368 14.775 -15.459 1.00 0.00 H new ATOM 0 HD12 LEU A 124 13.178 13.256 -15.911 1.00 0.00 H new ATOM 0 HD13 LEU A 124 14.053 14.484 -14.965 1.00 0.00 H new ATOM 0 HD21 LEU A 124 12.942 16.902 -16.589 1.00 0.00 H new ATOM 0 HD22 LEU A 124 14.665 16.755 -16.169 1.00 0.00 H new ATOM 0 HD23 LEU A 124 14.178 16.946 -17.869 1.00 0.00 H new ATOM 1878 N MET A 125 17.201 13.132 -19.530 1.00 0.00 N ATOM 1879 CA MET A 125 18.533 12.614 -19.739 1.00 0.00 C ATOM 1880 C MET A 125 19.211 13.388 -20.835 1.00 0.00 C ATOM 1881 O MET A 125 20.361 13.802 -20.696 1.00 0.00 O ATOM 1882 CB MET A 125 18.512 11.125 -20.139 1.00 0.00 C ATOM 1883 CG MET A 125 19.903 10.525 -20.353 1.00 0.00 C ATOM 1884 SD MET A 125 19.839 8.749 -20.742 1.00 0.00 S ATOM 1885 CE MET A 125 19.179 8.967 -22.420 1.00 0.00 C ATOM 0 H MET A 125 16.454 12.460 -19.705 1.00 0.00 H new ATOM 0 HA MET A 125 19.074 12.717 -18.798 1.00 0.00 H new ATOM 0 HB2 MET A 125 17.997 10.557 -19.364 1.00 0.00 H new ATOM 0 HB3 MET A 125 17.933 11.012 -21.055 1.00 0.00 H new ATOM 0 HG2 MET A 125 20.403 11.054 -21.164 1.00 0.00 H new ATOM 0 HG3 MET A 125 20.503 10.676 -19.456 1.00 0.00 H new ATOM 0 HE1 MET A 125 19.635 8.236 -23.088 1.00 0.00 H new ATOM 0 HE2 MET A 125 18.099 8.823 -22.408 1.00 0.00 H new ATOM 0 HE3 MET A 125 19.407 9.973 -22.773 1.00 0.00 H new ATOM 1895 N THR A 126 18.498 13.606 -21.957 1.00 0.00 N ATOM 1896 CA THR A 126 19.070 14.323 -23.076 1.00 0.00 C ATOM 1897 C THR A 126 19.324 15.750 -22.673 1.00 0.00 C ATOM 1898 O THR A 126 20.363 16.318 -22.994 1.00 0.00 O ATOM 1899 CB THR A 126 18.169 14.337 -24.285 1.00 0.00 C ATOM 1900 OG1 THR A 126 17.908 13.004 -24.710 1.00 0.00 O ATOM 1901 CG2 THR A 126 18.855 15.120 -25.420 1.00 0.00 C ATOM 0 H THR A 126 17.537 13.294 -22.097 1.00 0.00 H new ATOM 0 HA THR A 126 19.991 13.806 -23.344 1.00 0.00 H new ATOM 0 HB THR A 126 17.225 14.817 -24.028 1.00 0.00 H new ATOM 0 HG1 THR A 126 17.295 12.573 -24.078 1.00 0.00 H new ATOM 0 HG21 THR A 126 18.207 15.133 -26.296 1.00 0.00 H new ATOM 0 HG22 THR A 126 19.044 16.143 -25.094 1.00 0.00 H new ATOM 0 HG23 THR A 126 19.800 14.639 -25.674 1.00 0.00 H new ATOM 1909 N MET A 127 18.361 16.364 -21.954 1.00 0.00 N ATOM 1910 CA MET A 127 18.493 17.747 -21.551 1.00 0.00 C ATOM 1911 C MET A 127 19.680 17.927 -20.639 1.00 0.00 C ATOM 1912 O MET A 127 20.462 18.862 -20.814 1.00 0.00 O ATOM 1913 CB MET A 127 17.243 18.265 -20.812 1.00 0.00 C ATOM 1914 CG MET A 127 17.353 19.742 -20.408 1.00 0.00 C ATOM 1915 SD MET A 127 15.846 20.372 -19.611 1.00 0.00 S ATOM 1916 CE MET A 127 16.088 19.460 -18.058 1.00 0.00 C ATOM 0 H MET A 127 17.497 15.914 -21.651 1.00 0.00 H new ATOM 0 HA MET A 127 18.624 18.318 -22.470 1.00 0.00 H new ATOM 0 HB2 MET A 127 16.370 18.133 -21.451 1.00 0.00 H new ATOM 0 HB3 MET A 127 17.079 17.661 -19.919 1.00 0.00 H new ATOM 0 HG2 MET A 127 18.196 19.866 -19.728 1.00 0.00 H new ATOM 0 HG3 MET A 127 17.567 20.341 -21.293 1.00 0.00 H new ATOM 0 HE1 MET A 127 15.462 19.896 -17.279 1.00 0.00 H new ATOM 0 HE2 MET A 127 15.813 18.415 -18.203 1.00 0.00 H new ATOM 0 HE3 MET A 127 17.134 19.521 -17.759 1.00 0.00 H new ATOM 1926 N PHE A 128 19.850 17.035 -19.643 1.00 0.00 N ATOM 1927 CA PHE A 128 20.940 17.192 -18.706 1.00 0.00 C ATOM 1928 C PHE A 128 22.238 16.904 -19.397 1.00 0.00 C ATOM 1929 O PHE A 128 23.236 17.585 -19.169 1.00 0.00 O ATOM 1930 CB PHE A 128 20.837 16.264 -17.477 1.00 0.00 C ATOM 1931 CG PHE A 128 19.865 16.740 -16.442 1.00 0.00 C ATOM 1932 CD1 PHE A 128 18.749 15.994 -16.126 1.00 0.00 C ATOM 1933 CD2 PHE A 128 20.071 17.940 -15.793 1.00 0.00 C ATOM 1934 CE1 PHE A 128 17.858 16.438 -15.178 1.00 0.00 C ATOM 1935 CE2 PHE A 128 19.179 18.382 -14.844 1.00 0.00 C ATOM 1936 CZ PHE A 128 18.073 17.631 -14.536 1.00 0.00 C ATOM 0 H PHE A 128 19.254 16.223 -19.482 1.00 0.00 H new ATOM 0 HA PHE A 128 20.888 18.221 -18.349 1.00 0.00 H new ATOM 0 HB2 PHE A 128 20.542 15.268 -17.809 1.00 0.00 H new ATOM 0 HB3 PHE A 128 21.822 16.169 -17.021 1.00 0.00 H new ATOM 0 HD1 PHE A 128 18.574 15.054 -16.627 1.00 0.00 H new ATOM 0 HD2 PHE A 128 20.939 18.537 -16.032 1.00 0.00 H new ATOM 0 HE1 PHE A 128 16.987 15.846 -14.938 1.00 0.00 H new ATOM 0 HE2 PHE A 128 19.350 19.322 -14.340 1.00 0.00 H new ATOM 0 HZ PHE A 128 17.373 17.978 -13.790 1.00 0.00 H new ATOM 1946 N ALA A 129 22.256 15.871 -20.262 1.00 0.00 N ATOM 1947 CA ALA A 129 23.468 15.518 -20.953 1.00 0.00 C ATOM 1948 C ALA A 129 23.870 16.631 -21.882 1.00 0.00 C ATOM 1949 O ALA A 129 25.052 16.934 -22.014 1.00 0.00 O ATOM 1950 CB ALA A 129 23.338 14.221 -21.765 1.00 0.00 C ATOM 0 H ALA A 129 21.449 15.287 -20.483 1.00 0.00 H new ATOM 0 HA ALA A 129 24.227 15.356 -20.187 1.00 0.00 H new ATOM 0 HB1 ALA A 129 24.284 14.007 -22.263 1.00 0.00 H new ATOM 0 HB2 ALA A 129 23.085 13.397 -21.097 1.00 0.00 H new ATOM 0 HB3 ALA A 129 22.552 14.336 -22.512 1.00 0.00 H new ATOM 1956 N ALA A 130 22.888 17.257 -22.560 1.00 0.00 N ATOM 1957 CA ALA A 130 23.193 18.328 -23.481 1.00 0.00 C ATOM 1958 C ALA A 130 23.800 19.481 -22.729 1.00 0.00 C ATOM 1959 O ALA A 130 24.764 20.094 -23.190 1.00 0.00 O ATOM 1960 CB ALA A 130 21.950 18.849 -24.227 1.00 0.00 C ATOM 0 H ALA A 130 21.897 17.032 -22.478 1.00 0.00 H new ATOM 0 HA ALA A 130 23.885 17.918 -24.217 1.00 0.00 H new ATOM 0 HB1 ALA A 130 22.242 19.652 -24.904 1.00 0.00 H new ATOM 0 HB2 ALA A 130 21.502 18.037 -24.799 1.00 0.00 H new ATOM 0 HB3 ALA A 130 21.225 19.228 -23.506 1.00 0.00 H new ATOM 1966 N GLU A 131 23.242 19.806 -21.545 1.00 0.00 N ATOM 1967 CA GLU A 131 23.758 20.909 -20.765 1.00 0.00 C ATOM 1968 C GLU A 131 25.140 20.572 -20.279 1.00 0.00 C ATOM 1969 O GLU A 131 26.033 21.419 -20.276 1.00 0.00 O ATOM 1970 CB GLU A 131 22.887 21.239 -19.536 1.00 0.00 C ATOM 1971 CG GLU A 131 21.539 21.868 -19.923 1.00 0.00 C ATOM 1972 CD GLU A 131 20.664 21.987 -18.681 1.00 0.00 C ATOM 1973 OE1 GLU A 131 21.003 21.350 -17.647 1.00 0.00 O ATOM 1974 OE2 GLU A 131 19.643 22.721 -18.748 1.00 0.00 O ATOM 0 H GLU A 131 22.448 19.320 -21.128 1.00 0.00 H new ATOM 0 HA GLU A 131 23.761 21.780 -21.420 1.00 0.00 H new ATOM 0 HB2 GLU A 131 22.709 20.327 -18.966 1.00 0.00 H new ATOM 0 HB3 GLU A 131 23.429 21.923 -18.883 1.00 0.00 H new ATOM 0 HG2 GLU A 131 21.697 22.851 -20.366 1.00 0.00 H new ATOM 0 HG3 GLU A 131 21.041 21.256 -20.675 1.00 0.00 H new ATOM 1981 N ALA A 132 25.343 19.312 -19.846 1.00 0.00 N ATOM 1982 CA ALA A 132 26.634 18.894 -19.353 1.00 0.00 C ATOM 1983 C ALA A 132 27.641 18.954 -20.472 1.00 0.00 C ATOM 1984 O ALA A 132 28.778 19.365 -20.270 1.00 0.00 O ATOM 1985 CB ALA A 132 26.626 17.462 -18.796 1.00 0.00 C ATOM 0 H ALA A 132 24.627 18.586 -19.834 1.00 0.00 H new ATOM 0 HA ALA A 132 26.894 19.572 -18.540 1.00 0.00 H new ATOM 0 HB1 ALA A 132 27.624 17.204 -18.441 1.00 0.00 H new ATOM 0 HB2 ALA A 132 25.918 17.397 -17.970 1.00 0.00 H new ATOM 0 HB3 ALA A 132 26.330 16.767 -19.582 1.00 0.00 H new ATOM 1991 N ALA A 133 27.238 18.519 -21.686 1.00 0.00 N ATOM 1992 CA ALA A 133 28.137 18.532 -22.817 1.00 0.00 C ATOM 1993 C ALA A 133 28.495 19.953 -23.150 1.00 0.00 C ATOM 1994 O ALA A 133 29.635 20.240 -23.502 1.00 0.00 O ATOM 1995 CB ALA A 133 27.537 17.878 -24.074 1.00 0.00 C ATOM 0 H ALA A 133 26.304 18.162 -21.888 1.00 0.00 H new ATOM 0 HA ALA A 133 29.014 17.953 -22.527 1.00 0.00 H new ATOM 0 HB1 ALA A 133 28.262 17.920 -24.887 1.00 0.00 H new ATOM 0 HB2 ALA A 133 27.291 16.838 -23.861 1.00 0.00 H new ATOM 0 HB3 ALA A 133 26.633 18.412 -24.366 1.00 0.00 H new ATOM 2001 N GLN A 134 27.514 20.876 -23.066 1.00 0.00 N ATOM 2002 CA GLN A 134 27.783 22.264 -23.368 1.00 0.00 C ATOM 2003 C GLN A 134 28.787 22.776 -22.370 1.00 0.00 C ATOM 2004 O GLN A 134 29.706 23.516 -22.719 1.00 0.00 O ATOM 2005 CB GLN A 134 26.524 23.151 -23.287 1.00 0.00 C ATOM 2006 CG GLN A 134 26.788 24.600 -23.717 1.00 0.00 C ATOM 2007 CD GLN A 134 25.473 25.369 -23.671 1.00 0.00 C ATOM 2008 OE1 GLN A 134 24.419 24.811 -23.374 1.00 0.00 O ATOM 2009 NE2 GLN A 134 25.530 26.689 -23.975 1.00 0.00 N ATOM 0 H GLN A 134 26.552 20.674 -22.795 1.00 0.00 H new ATOM 0 HA GLN A 134 28.154 22.314 -24.392 1.00 0.00 H new ATOM 0 HB2 GLN A 134 25.744 22.726 -23.919 1.00 0.00 H new ATOM 0 HB3 GLN A 134 26.145 23.144 -22.265 1.00 0.00 H new ATOM 0 HG2 GLN A 134 27.520 25.063 -23.056 1.00 0.00 H new ATOM 0 HG3 GLN A 134 27.206 24.626 -24.723 1.00 0.00 H new ATOM 0 HE21 GLN A 134 26.423 27.119 -24.217 1.00 0.00 H new ATOM 0 HE22 GLN A 134 24.680 27.253 -23.962 1.00 0.00 H new ATOM 2018 N GLU A 135 28.621 22.387 -21.087 1.00 0.00 N ATOM 2019 CA GLU A 135 29.531 22.821 -20.053 1.00 0.00 C ATOM 2020 C GLU A 135 30.895 22.233 -20.318 1.00 0.00 C ATOM 2021 O GLU A 135 31.911 22.910 -20.158 1.00 0.00 O ATOM 2022 CB GLU A 135 29.080 22.381 -18.643 1.00 0.00 C ATOM 2023 CG GLU A 135 30.007 22.892 -17.528 1.00 0.00 C ATOM 2024 CD GLU A 135 29.455 22.443 -16.178 1.00 0.00 C ATOM 2025 OE1 GLU A 135 28.384 21.777 -16.162 1.00 0.00 O ATOM 2026 OE2 GLU A 135 30.102 22.756 -15.144 1.00 0.00 O ATOM 0 H GLU A 135 27.868 21.780 -20.764 1.00 0.00 H new ATOM 0 HA GLU A 135 29.551 23.911 -20.077 1.00 0.00 H new ATOM 0 HB2 GLU A 135 28.068 22.744 -18.462 1.00 0.00 H new ATOM 0 HB3 GLU A 135 29.040 21.292 -18.604 1.00 0.00 H new ATOM 0 HG2 GLU A 135 31.016 22.504 -17.670 1.00 0.00 H new ATOM 0 HG3 GLU A 135 30.075 23.979 -17.564 1.00 0.00 H new ATOM 2033 N ALA A 136 30.950 20.940 -20.724 1.00 0.00 N ATOM 2034 CA ALA A 136 32.219 20.298 -20.985 1.00 0.00 C ATOM 2035 C ALA A 136 32.897 20.978 -22.145 1.00 0.00 C ATOM 2036 O ALA A 136 34.106 21.200 -22.122 1.00 0.00 O ATOM 2037 CB ALA A 136 32.072 18.804 -21.329 1.00 0.00 C ATOM 0 H ALA A 136 30.133 20.347 -20.870 1.00 0.00 H new ATOM 0 HA ALA A 136 32.807 20.382 -20.071 1.00 0.00 H new ATOM 0 HB1 ALA A 136 33.057 18.375 -21.515 1.00 0.00 H new ATOM 0 HB2 ALA A 136 31.601 18.283 -20.495 1.00 0.00 H new ATOM 0 HB3 ALA A 136 31.454 18.695 -22.220 1.00 0.00 H new ATOM 2043 N ALA A 137 32.121 21.313 -23.200 1.00 0.00 N ATOM 2044 CA ALA A 137 32.678 21.961 -24.365 1.00 0.00 C ATOM 2045 C ALA A 137 33.199 23.319 -23.978 1.00 0.00 C ATOM 2046 O ALA A 137 34.252 23.744 -24.449 1.00 0.00 O ATOM 2047 CB ALA A 137 31.648 22.143 -25.493 1.00 0.00 C ATOM 0 H ALA A 137 31.117 21.139 -23.250 1.00 0.00 H new ATOM 0 HA ALA A 137 33.476 21.317 -24.736 1.00 0.00 H new ATOM 0 HB1 ALA A 137 32.122 22.635 -26.343 1.00 0.00 H new ATOM 0 HB2 ALA A 137 31.271 21.168 -25.802 1.00 0.00 H new ATOM 0 HB3 ALA A 137 30.820 22.755 -25.135 1.00 0.00 H new