USER MOD reduce.3.24.130724 H: found=0, std=0, add=944, rem=0, adj=31 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= 0.677 K(o=0.68,f=-6.9!) USER MOD Set 1.2: A 116 GLN : amide:sc= 0 K(o=0.68,f=-3!) USER MOD Set 2.1: A 75 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 76 MET CE :methyl -150:sc= -0.145 (180deg=-0.333) USER MOD Set 3.1: A 29 SER OG : rot 85:sc= 1.67 USER MOD Set 3.2: A 94 LYS NZ :NH3+ -141:sc= 0.526 (180deg=-0.00109) USER MOD Set 4.1: A 16 ASN : amide:sc= -0.0443 K(o=-4.3,f=-7.4!) USER MOD Set 4.2: A 19 MET CE :methyl -156:sc= -2.97! (180deg=-1.47) USER MOD Set 4.3: A 48 MET CE :methyl -130:sc= -1.3 (180deg=-1.01) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0.162 K(o=0.16,f=-7.9!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ -144:sc= 0.733 (180deg=0.196) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 1.02 K(o=1,f=-7.2!) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.00069) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 172:sc= 0 (180deg=-0.0201) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 74:sc= 0.0573 USER MOD Single : A 47 MET CE :methyl 164:sc= -1.57 (180deg=-2.09!) 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= -0.143 X(o=-0.14,f=-0.17) USER MOD Single : A 68 MET CE :methyl -110:sc= -3.51 (180deg=-8.97!) USER MOD Single : A 69 ASN : amide:sc= -0.145 X(o=-0.15,f=-0.26) USER MOD Single : A 70 MET CE :methyl -116:sc= -0.0313 (180deg=-0.336) USER MOD Single : A 74 SER OG : rot 69:sc= 0.671 USER MOD Single : A 86 ASN : amide:sc= 1.11 K(o=1.1,f=-0.39) USER MOD Single : A 87 ASN : amide:sc= -0.182 K(o=-0.18,f=-6.9!) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 79:sc= 1.31 USER MOD Single : A 99 SER OG : rot 68:sc= 0.713 USER MOD Single : A 100 GLN : amide:sc= -0.0544 K(o=-0.054,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 K(o=0,f=-1.5!) USER MOD Single : A 108 SER OG : rot 78:sc= 0.0757 USER MOD Single : A 109 THR OG1 : rot -68:sc= 1.11 USER MOD Single : A 110 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 72:sc= 1.06 USER MOD Single : A 122 LYS NZ :NH3+ 166:sc= -0.0114 (180deg=-0.171) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 125 MET CE :methyl -133:sc= -0.104 (180deg=-0.729) USER MOD Single : A 126 THR OG1 : rot 73:sc= 0.748 USER MOD Single : A 127 MET CE :methyl 163:sc= -0.122 (180deg=-0.644) USER MOD Single : A 134 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 82 N SER A 7 2.686 0.626 -5.613 1.00 0.00 N ATOM 83 CA SER A 7 3.444 1.846 -5.711 1.00 0.00 C ATOM 84 C SER A 7 4.441 1.667 -6.812 1.00 0.00 C ATOM 85 O SER A 7 4.901 0.557 -7.078 1.00 0.00 O ATOM 86 CB SER A 7 4.206 2.175 -4.415 1.00 0.00 C ATOM 87 OG SER A 7 3.291 2.551 -3.395 1.00 0.00 O ATOM 0 HA SER A 7 2.752 2.667 -5.901 1.00 0.00 H new ATOM 0 HB2 SER A 7 4.785 1.309 -4.094 1.00 0.00 H new ATOM 0 HB3 SER A 7 4.915 2.983 -4.595 1.00 0.00 H new ATOM 0 HG SER A 7 3.784 2.757 -2.573 1.00 0.00 H new ATOM 93 N PRO A 8 4.791 2.757 -7.462 1.00 0.00 N ATOM 94 CA PRO A 8 5.756 2.722 -8.532 1.00 0.00 C ATOM 95 C PRO A 8 7.169 2.793 -8.035 1.00 0.00 C ATOM 96 O PRO A 8 7.869 1.786 -8.001 1.00 0.00 O ATOM 97 CB PRO A 8 5.405 3.936 -9.398 1.00 0.00 C ATOM 98 CG PRO A 8 4.693 4.915 -8.457 1.00 0.00 C ATOM 99 CD PRO A 8 4.271 4.108 -7.219 1.00 0.00 C ATOM 0 HA PRO A 8 5.709 1.784 -9.084 1.00 0.00 H new ATOM 0 HB2 PRO A 8 6.301 4.385 -9.827 1.00 0.00 H new ATOM 0 HB3 PRO A 8 4.761 3.652 -10.230 1.00 0.00 H new ATOM 0 HG2 PRO A 8 5.355 5.735 -8.178 1.00 0.00 H new ATOM 0 HG3 PRO A 8 3.825 5.359 -8.944 1.00 0.00 H new ATOM 0 HD2 PRO A 8 4.688 4.535 -6.307 1.00 0.00 H new ATOM 0 HD3 PRO A 8 3.187 4.100 -7.101 1.00 0.00 H new ATOM 107 N TRP A 9 7.626 3.999 -7.627 1.00 0.00 N ATOM 108 CA TRP A 9 8.977 4.135 -7.143 1.00 0.00 C ATOM 109 C TRP A 9 8.969 4.075 -5.639 1.00 0.00 C ATOM 110 O TRP A 9 10.024 4.009 -5.012 1.00 0.00 O ATOM 111 CB TRP A 9 9.617 5.471 -7.547 1.00 0.00 C ATOM 112 CG TRP A 9 9.577 5.723 -9.034 1.00 0.00 C ATOM 113 CD1 TRP A 9 10.438 5.272 -9.992 1.00 0.00 C ATOM 114 CD2 TRP A 9 8.589 6.515 -9.729 1.00 0.00 C ATOM 115 NE1 TRP A 9 10.060 5.730 -11.219 1.00 0.00 N ATOM 116 CE2 TRP A 9 8.927 6.490 -11.079 1.00 0.00 C ATOM 117 CE3 TRP A 9 7.492 7.211 -9.306 1.00 0.00 C ATOM 118 CZ2 TRP A 9 8.184 7.149 -12.011 1.00 0.00 C ATOM 119 CZ3 TRP A 9 6.736 7.880 -10.247 1.00 0.00 C ATOM 120 CH2 TRP A 9 7.079 7.849 -11.584 1.00 0.00 C ATOM 0 H TRP A 9 7.078 4.859 -7.630 1.00 0.00 H new ATOM 0 HA TRP A 9 9.556 3.324 -7.584 1.00 0.00 H new ATOM 0 HB2 TRP A 9 9.102 6.283 -7.033 1.00 0.00 H new ATOM 0 HB3 TRP A 9 10.653 5.487 -7.210 1.00 0.00 H new ATOM 0 HD1 TRP A 9 11.296 4.643 -9.805 1.00 0.00 H new ATOM 0 HE1 TRP A 9 10.541 5.539 -12.098 1.00 0.00 H new ATOM 0 HE3 TRP A 9 7.223 7.237 -8.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 8.455 7.123 -13.056 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 5.864 8.435 -9.933 1.00 0.00 H new ATOM 0 HH2 TRP A 9 6.473 8.380 -12.303 1.00 0.00 H new ATOM 131 N ALA A 10 7.768 4.092 -5.016 1.00 0.00 N ATOM 132 CA ALA A 10 7.695 4.056 -3.574 1.00 0.00 C ATOM 133 C ALA A 10 7.722 2.623 -3.117 1.00 0.00 C ATOM 134 O ALA A 10 7.830 2.356 -1.924 1.00 0.00 O ATOM 135 CB ALA A 10 6.418 4.716 -3.013 1.00 0.00 C ATOM 0 H ALA A 10 6.867 4.130 -5.493 1.00 0.00 H new ATOM 0 HA ALA A 10 8.550 4.619 -3.201 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.425 4.655 -1.925 1.00 0.00 H new ATOM 0 HB2 ALA A 10 6.385 5.762 -3.318 1.00 0.00 H new ATOM 0 HB3 ALA A 10 5.541 4.198 -3.400 1.00 0.00 H new ATOM 141 N ASN A 11 7.615 1.664 -4.062 1.00 0.00 N ATOM 142 CA ASN A 11 7.636 0.270 -3.695 1.00 0.00 C ATOM 143 C ASN A 11 9.068 -0.178 -3.819 1.00 0.00 C ATOM 144 O ASN A 11 9.629 -0.180 -4.914 1.00 0.00 O ATOM 145 CB ASN A 11 6.777 -0.612 -4.635 1.00 0.00 C ATOM 146 CG ASN A 11 6.696 -2.068 -4.186 1.00 0.00 C ATOM 147 OD1 ASN A 11 7.489 -2.533 -3.374 1.00 0.00 O ATOM 148 ND2 ASN A 11 5.707 -2.814 -4.733 1.00 0.00 N ATOM 0 H ASN A 11 7.516 1.845 -5.061 1.00 0.00 H new ATOM 0 HA ASN A 11 7.229 0.163 -2.689 1.00 0.00 H new ATOM 0 HB2 ASN A 11 5.770 -0.199 -4.690 1.00 0.00 H new ATOM 0 HB3 ASN A 11 7.193 -0.572 -5.641 1.00 0.00 H new ATOM 0 HD21 ASN A 11 5.604 -3.795 -4.472 1.00 0.00 H new ATOM 0 HD22 ASN A 11 5.065 -2.395 -5.406 1.00 0.00 H new ATOM 155 N PRO A 12 9.682 -0.559 -2.712 1.00 0.00 N ATOM 156 CA PRO A 12 11.067 -1.020 -2.723 1.00 0.00 C ATOM 157 C PRO A 12 11.288 -2.179 -3.644 1.00 0.00 C ATOM 158 O PRO A 12 12.338 -2.294 -4.268 1.00 0.00 O ATOM 159 CB PRO A 12 11.343 -1.434 -1.273 1.00 0.00 C ATOM 160 CG PRO A 12 10.347 -0.613 -0.469 1.00 0.00 C ATOM 161 CD PRO A 12 9.108 -0.566 -1.357 1.00 0.00 C ATOM 0 HA PRO A 12 11.734 -0.238 -3.086 1.00 0.00 H new ATOM 0 HB2 PRO A 12 11.192 -2.503 -1.126 1.00 0.00 H new ATOM 0 HB3 PRO A 12 12.370 -1.214 -0.982 1.00 0.00 H new ATOM 0 HG2 PRO A 12 10.131 -1.077 0.493 1.00 0.00 H new ATOM 0 HG3 PRO A 12 10.728 0.387 -0.262 1.00 0.00 H new ATOM 0 HD2 PRO A 12 8.461 -1.428 -1.196 1.00 0.00 H new ATOM 0 HD3 PRO A 12 8.507 0.323 -1.167 1.00 0.00 H new ATOM 169 N LYS A 13 10.288 -3.076 -3.737 1.00 0.00 N ATOM 170 CA LYS A 13 10.396 -4.228 -4.587 1.00 0.00 C ATOM 171 C LYS A 13 10.491 -3.779 -6.023 1.00 0.00 C ATOM 172 O LYS A 13 11.325 -4.274 -6.781 1.00 0.00 O ATOM 173 CB LYS A 13 9.177 -5.148 -4.443 1.00 0.00 C ATOM 174 CG LYS A 13 9.261 -6.410 -5.298 1.00 0.00 C ATOM 175 CD LYS A 13 8.038 -7.296 -5.091 1.00 0.00 C ATOM 176 CE LYS A 13 8.082 -8.570 -5.933 1.00 0.00 C ATOM 177 NZ LYS A 13 6.877 -9.393 -5.685 1.00 0.00 N ATOM 0 H LYS A 13 9.407 -3.006 -3.227 1.00 0.00 H new ATOM 0 HA LYS A 13 11.288 -4.781 -4.292 1.00 0.00 H new ATOM 0 HB2 LYS A 13 9.070 -5.434 -3.397 1.00 0.00 H new ATOM 0 HB3 LYS A 13 8.279 -4.593 -4.716 1.00 0.00 H new ATOM 0 HG2 LYS A 13 9.341 -6.136 -6.350 1.00 0.00 H new ATOM 0 HG3 LYS A 13 10.164 -6.966 -5.044 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.963 -7.565 -4.037 1.00 0.00 H new ATOM 0 HD3 LYS A 13 7.139 -6.732 -5.340 1.00 0.00 H new ATOM 0 HE2 LYS A 13 8.143 -8.313 -6.990 1.00 0.00 H new ATOM 0 HE3 LYS A 13 8.978 -9.143 -5.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 6.921 -10.256 -6.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 6.835 -9.653 -4.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 6.027 -8.849 -5.938 1.00 0.00 H new ATOM 191 N LYS A 14 9.631 -2.812 -6.432 1.00 0.00 N ATOM 192 CA LYS A 14 9.653 -2.352 -7.804 1.00 0.00 C ATOM 193 C LYS A 14 10.907 -1.564 -8.026 1.00 0.00 C ATOM 194 O LYS A 14 11.525 -1.644 -9.085 1.00 0.00 O ATOM 195 CB LYS A 14 8.457 -1.450 -8.163 1.00 0.00 C ATOM 196 CG LYS A 14 7.126 -2.194 -8.071 1.00 0.00 C ATOM 197 CD LYS A 14 6.986 -3.294 -9.123 1.00 0.00 C ATOM 198 CE LYS A 14 6.427 -4.581 -8.524 1.00 0.00 C ATOM 199 NZ LYS A 14 6.070 -5.542 -9.591 1.00 0.00 N ATOM 0 H LYS A 14 8.939 -2.359 -5.835 1.00 0.00 H new ATOM 0 HA LYS A 14 9.602 -3.238 -8.437 1.00 0.00 H new ATOM 0 HB2 LYS A 14 8.438 -0.591 -7.493 1.00 0.00 H new ATOM 0 HB3 LYS A 14 8.586 -1.063 -9.174 1.00 0.00 H new ATOM 0 HG2 LYS A 14 7.029 -2.633 -7.078 1.00 0.00 H new ATOM 0 HG3 LYS A 14 6.309 -1.482 -8.186 1.00 0.00 H new ATOM 0 HD2 LYS A 14 6.331 -2.951 -9.923 1.00 0.00 H new ATOM 0 HD3 LYS A 14 7.959 -3.494 -9.572 1.00 0.00 H new ATOM 0 HE2 LYS A 14 7.164 -5.028 -7.857 1.00 0.00 H new ATOM 0 HE3 LYS A 14 5.547 -4.355 -7.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 5.216 -6.067 -9.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 5.888 -5.027 -10.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 6.855 -6.209 -9.734 1.00 0.00 H new ATOM 213 N ALA A 15 11.301 -0.766 -7.016 1.00 0.00 N ATOM 214 CA ALA A 15 12.487 0.053 -7.131 1.00 0.00 C ATOM 215 C ALA A 15 13.696 -0.827 -7.311 1.00 0.00 C ATOM 216 O ALA A 15 14.562 -0.539 -8.138 1.00 0.00 O ATOM 217 CB ALA A 15 12.721 0.937 -5.892 1.00 0.00 C ATOM 0 H ALA A 15 10.810 -0.682 -6.126 1.00 0.00 H new ATOM 0 HA ALA A 15 12.336 0.703 -7.993 1.00 0.00 H new ATOM 0 HB1 ALA A 15 13.625 1.530 -6.034 1.00 0.00 H new ATOM 0 HB2 ALA A 15 11.869 1.602 -5.753 1.00 0.00 H new ATOM 0 HB3 ALA A 15 12.836 0.306 -5.011 1.00 0.00 H new ATOM 223 N ASN A 16 13.790 -1.927 -6.528 1.00 0.00 N ATOM 224 CA ASN A 16 14.922 -2.814 -6.635 1.00 0.00 C ATOM 225 C ASN A 16 14.918 -3.466 -7.991 1.00 0.00 C ATOM 226 O ASN A 16 15.962 -3.627 -8.611 1.00 0.00 O ATOM 227 CB ASN A 16 14.923 -3.927 -5.569 1.00 0.00 C ATOM 228 CG ASN A 16 15.240 -3.391 -4.178 1.00 0.00 C ATOM 229 OD1 ASN A 16 15.806 -2.312 -4.028 1.00 0.00 O ATOM 230 ND2 ASN A 16 14.875 -4.168 -3.130 1.00 0.00 N ATOM 0 H ASN A 16 13.096 -2.200 -5.832 1.00 0.00 H new ATOM 0 HA ASN A 16 15.812 -2.203 -6.482 1.00 0.00 H new ATOM 0 HB2 ASN A 16 13.949 -4.415 -5.555 1.00 0.00 H new ATOM 0 HB3 ASN A 16 15.656 -4.687 -5.840 1.00 0.00 H new ATOM 0 HD21 ASN A 16 15.069 -3.862 -2.176 1.00 0.00 H new ATOM 0 HD22 ASN A 16 14.406 -5.059 -3.294 1.00 0.00 H new ATOM 237 N ALA A 17 13.736 -3.869 -8.489 1.00 0.00 N ATOM 238 CA ALA A 17 13.671 -4.508 -9.782 1.00 0.00 C ATOM 239 C ALA A 17 14.086 -3.523 -10.847 1.00 0.00 C ATOM 240 O ALA A 17 14.791 -3.877 -11.794 1.00 0.00 O ATOM 241 CB ALA A 17 12.260 -5.017 -10.123 1.00 0.00 C ATOM 0 H ALA A 17 12.839 -3.760 -8.015 1.00 0.00 H new ATOM 0 HA ALA A 17 14.342 -5.367 -9.746 1.00 0.00 H new ATOM 0 HB1 ALA A 17 12.271 -5.488 -11.106 1.00 0.00 H new ATOM 0 HB2 ALA A 17 11.945 -5.745 -9.375 1.00 0.00 H new ATOM 0 HB3 ALA A 17 11.563 -4.179 -10.130 1.00 0.00 H new ATOM 247 N PHE A 18 13.649 -2.253 -10.703 1.00 0.00 N ATOM 248 CA PHE A 18 13.951 -1.235 -11.683 1.00 0.00 C ATOM 249 C PHE A 18 15.435 -0.955 -11.724 1.00 0.00 C ATOM 250 O PHE A 18 16.018 -0.836 -12.801 1.00 0.00 O ATOM 251 CB PHE A 18 13.210 0.090 -11.397 1.00 0.00 C ATOM 252 CG PHE A 18 13.283 1.092 -12.507 1.00 0.00 C ATOM 253 CD1 PHE A 18 13.088 0.699 -13.811 1.00 0.00 C ATOM 254 CD2 PHE A 18 13.526 2.422 -12.239 1.00 0.00 C ATOM 255 CE1 PHE A 18 13.138 1.618 -14.832 1.00 0.00 C ATOM 256 CE2 PHE A 18 13.578 3.340 -13.261 1.00 0.00 C ATOM 257 CZ PHE A 18 13.383 2.938 -14.558 1.00 0.00 C ATOM 0 H PHE A 18 13.090 -1.928 -9.915 1.00 0.00 H new ATOM 0 HA PHE A 18 13.614 -1.624 -12.644 1.00 0.00 H new ATOM 0 HB2 PHE A 18 12.163 -0.131 -11.192 1.00 0.00 H new ATOM 0 HB3 PHE A 18 13.625 0.536 -10.493 1.00 0.00 H new ATOM 0 HD1 PHE A 18 12.894 -0.340 -14.034 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.677 2.745 -11.220 1.00 0.00 H new ATOM 0 HE1 PHE A 18 12.984 1.299 -15.852 1.00 0.00 H new ATOM 0 HE2 PHE A 18 13.773 4.380 -13.042 1.00 0.00 H new ATOM 0 HZ PHE A 18 13.422 3.660 -15.361 1.00 0.00 H new ATOM 267 N MET A 19 16.096 -0.830 -10.554 1.00 0.00 N ATOM 268 CA MET A 19 17.514 -0.535 -10.568 1.00 0.00 C ATOM 269 C MET A 19 18.278 -1.743 -11.052 1.00 0.00 C ATOM 270 O MET A 19 19.236 -1.602 -11.805 1.00 0.00 O ATOM 271 CB MET A 19 18.097 -0.092 -9.202 1.00 0.00 C ATOM 272 CG MET A 19 17.800 -1.057 -8.052 1.00 0.00 C ATOM 273 SD MET A 19 19.224 -2.089 -7.589 1.00 0.00 S ATOM 274 CE MET A 19 18.344 -2.999 -6.287 1.00 0.00 C ATOM 0 H MET A 19 15.677 -0.927 -9.629 1.00 0.00 H new ATOM 0 HA MET A 19 17.628 0.314 -11.242 1.00 0.00 H new ATOM 0 HB2 MET A 19 19.177 0.019 -9.299 1.00 0.00 H new ATOM 0 HB3 MET A 19 17.697 0.890 -8.950 1.00 0.00 H new ATOM 0 HG2 MET A 19 17.477 -0.485 -7.182 1.00 0.00 H new ATOM 0 HG3 MET A 19 16.969 -1.703 -8.335 1.00 0.00 H new ATOM 0 HE1 MET A 19 19.063 -3.387 -5.565 1.00 0.00 H new ATOM 0 HE2 MET A 19 17.648 -2.329 -5.782 1.00 0.00 H new ATOM 0 HE3 MET A 19 17.792 -3.827 -6.731 1.00 0.00 H new ATOM 284 N LYS A 20 17.860 -2.966 -10.660 1.00 0.00 N ATOM 285 CA LYS A 20 18.578 -4.153 -11.079 1.00 0.00 C ATOM 286 C LYS A 20 18.495 -4.331 -12.566 1.00 0.00 C ATOM 287 O LYS A 20 19.482 -4.688 -13.201 1.00 0.00 O ATOM 288 CB LYS A 20 18.050 -5.454 -10.447 1.00 0.00 C ATOM 289 CG LYS A 20 18.370 -5.549 -8.962 1.00 0.00 C ATOM 290 CD LYS A 20 17.846 -6.842 -8.330 1.00 0.00 C ATOM 291 CE LYS A 20 18.178 -6.942 -6.840 1.00 0.00 C ATOM 292 NZ LYS A 20 17.649 -8.204 -6.280 1.00 0.00 N ATOM 0 H LYS A 20 17.047 -3.139 -10.068 1.00 0.00 H new ATOM 0 HA LYS A 20 19.602 -3.987 -10.745 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.971 -5.511 -10.588 1.00 0.00 H new ATOM 0 HB3 LYS A 20 18.485 -6.309 -10.965 1.00 0.00 H new ATOM 0 HG2 LYS A 20 19.449 -5.492 -8.822 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.936 -4.694 -8.445 1.00 0.00 H new ATOM 0 HD2 LYS A 20 16.765 -6.895 -8.463 1.00 0.00 H new ATOM 0 HD3 LYS A 20 18.274 -7.697 -8.853 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.258 -6.897 -6.697 1.00 0.00 H new ATOM 0 HE3 LYS A 20 17.751 -6.092 -6.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 17.881 -8.259 -5.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 16.616 -8.231 -6.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 18.077 -9.011 -6.778 1.00 0.00 H new ATOM 306 N CYS A 21 17.315 -4.080 -13.167 1.00 0.00 N ATOM 307 CA CYS A 21 17.183 -4.302 -14.594 1.00 0.00 C ATOM 308 C CYS A 21 18.010 -3.304 -15.365 1.00 0.00 C ATOM 309 O CYS A 21 18.655 -3.670 -16.341 1.00 0.00 O ATOM 310 CB CYS A 21 15.723 -4.249 -15.118 1.00 0.00 C ATOM 311 SG CYS A 21 14.976 -2.591 -15.004 1.00 0.00 S ATOM 0 H CYS A 21 16.478 -3.737 -12.696 1.00 0.00 H new ATOM 0 HA CYS A 21 17.543 -5.318 -14.756 1.00 0.00 H new ATOM 0 HB2 CYS A 21 15.705 -4.577 -16.157 1.00 0.00 H new ATOM 0 HB3 CYS A 21 15.115 -4.954 -14.551 1.00 0.00 H new ATOM 316 N LEU A 22 18.024 -2.020 -14.951 1.00 0.00 N ATOM 317 CA LEU A 22 18.788 -1.034 -15.690 1.00 0.00 C ATOM 318 C LEU A 22 20.262 -1.269 -15.503 1.00 0.00 C ATOM 319 O LEU A 22 21.031 -1.211 -16.459 1.00 0.00 O ATOM 320 CB LEU A 22 18.491 0.413 -15.249 1.00 0.00 C ATOM 321 CG LEU A 22 17.096 0.892 -15.677 1.00 0.00 C ATOM 322 CD1 LEU A 22 16.742 2.231 -15.010 1.00 0.00 C ATOM 323 CD2 LEU A 22 16.989 0.987 -17.209 1.00 0.00 C ATOM 0 H LEU A 22 17.527 -1.664 -14.134 1.00 0.00 H new ATOM 0 HA LEU A 22 18.493 -1.150 -16.733 1.00 0.00 H new ATOM 0 HB2 LEU A 22 18.577 0.482 -14.165 1.00 0.00 H new ATOM 0 HB3 LEU A 22 19.244 1.078 -15.671 1.00 0.00 H new ATOM 0 HG LEU A 22 16.371 0.152 -15.340 1.00 0.00 H new ATOM 0 HD11 LEU A 22 15.749 2.546 -15.331 1.00 0.00 H new ATOM 0 HD12 LEU A 22 16.752 2.112 -13.927 1.00 0.00 H new ATOM 0 HD13 LEU A 22 17.473 2.986 -15.299 1.00 0.00 H new ATOM 0 HD21 LEU A 22 15.991 1.328 -17.484 1.00 0.00 H new ATOM 0 HD22 LEU A 22 17.730 1.694 -17.582 1.00 0.00 H new ATOM 0 HD23 LEU A 22 17.170 0.006 -17.648 1.00 0.00 H new ATOM 335 N ILE A 23 20.684 -1.554 -14.257 1.00 0.00 N ATOM 336 CA ILE A 23 22.085 -1.754 -13.977 1.00 0.00 C ATOM 337 C ILE A 23 22.584 -2.999 -14.663 1.00 0.00 C ATOM 338 O ILE A 23 23.654 -2.997 -15.273 1.00 0.00 O ATOM 339 CB ILE A 23 22.350 -1.887 -12.504 1.00 0.00 C ATOM 340 CG1 ILE A 23 22.060 -0.550 -11.800 1.00 0.00 C ATOM 341 CG2 ILE A 23 23.810 -2.326 -12.313 1.00 0.00 C ATOM 342 CD1 ILE A 23 22.023 -0.679 -10.277 1.00 0.00 C ATOM 0 H ILE A 23 20.069 -1.646 -13.448 1.00 0.00 H new ATOM 0 HA ILE A 23 22.610 -0.875 -14.352 1.00 0.00 H new ATOM 0 HB ILE A 23 21.696 -2.637 -12.059 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.823 0.176 -12.080 1.00 0.00 H new ATOM 0 HG13 ILE A 23 21.105 -0.160 -12.150 1.00 0.00 H new ATOM 0 HG21 ILE A 23 24.023 -2.428 -11.249 1.00 0.00 H new ATOM 0 HG22 ILE A 23 23.970 -3.283 -12.809 1.00 0.00 H new ATOM 0 HG23 ILE A 23 24.474 -1.578 -12.746 1.00 0.00 H new ATOM 0 HD11 ILE A 23 21.815 0.295 -9.834 1.00 0.00 H new ATOM 0 HD12 ILE A 23 21.241 -1.383 -9.990 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.987 -1.042 -9.919 1.00 0.00 H new ATOM 354 N GLN A 24 21.812 -4.099 -14.578 1.00 0.00 N ATOM 355 CA GLN A 24 22.236 -5.346 -15.175 1.00 0.00 C ATOM 356 C GLN A 24 22.323 -5.201 -16.668 1.00 0.00 C ATOM 357 O GLN A 24 23.238 -5.739 -17.285 1.00 0.00 O ATOM 358 CB GLN A 24 21.290 -6.523 -14.858 1.00 0.00 C ATOM 359 CG GLN A 24 21.811 -7.869 -15.383 1.00 0.00 C ATOM 360 CD GLN A 24 20.846 -8.967 -14.952 1.00 0.00 C ATOM 361 OE1 GLN A 24 19.866 -8.714 -14.258 1.00 0.00 O ATOM 362 NE2 GLN A 24 21.130 -10.223 -15.373 1.00 0.00 N ATOM 0 H GLN A 24 20.908 -4.135 -14.106 1.00 0.00 H new ATOM 0 HA GLN A 24 23.211 -5.571 -14.744 1.00 0.00 H new ATOM 0 HB2 GLN A 24 21.150 -6.589 -13.779 1.00 0.00 H new ATOM 0 HB3 GLN A 24 20.311 -6.323 -15.294 1.00 0.00 H new ATOM 0 HG2 GLN A 24 21.895 -7.844 -16.470 1.00 0.00 H new ATOM 0 HG3 GLN A 24 22.809 -8.067 -14.991 1.00 0.00 H new ATOM 0 HE21 GLN A 24 21.954 -10.394 -15.949 1.00 0.00 H new ATOM 0 HE22 GLN A 24 20.519 -10.998 -15.114 1.00 0.00 H new ATOM 371 N LYS A 25 21.372 -4.476 -17.296 1.00 0.00 N ATOM 372 CA LYS A 25 21.419 -4.317 -18.735 1.00 0.00 C ATOM 373 C LYS A 25 22.682 -3.612 -19.116 1.00 0.00 C ATOM 374 O LYS A 25 23.302 -3.948 -20.118 1.00 0.00 O ATOM 375 CB LYS A 25 20.226 -3.538 -19.314 1.00 0.00 C ATOM 376 CG LYS A 25 18.952 -4.380 -19.348 1.00 0.00 C ATOM 377 CD LYS A 25 19.023 -5.481 -20.410 1.00 0.00 C ATOM 378 CE LYS A 25 17.720 -6.275 -20.514 1.00 0.00 C ATOM 379 NZ LYS A 25 17.833 -7.318 -21.556 1.00 0.00 N ATOM 0 H LYS A 25 20.592 -4.011 -16.832 1.00 0.00 H new ATOM 0 HA LYS A 25 21.377 -5.322 -19.154 1.00 0.00 H new ATOM 0 HB2 LYS A 25 20.053 -2.643 -18.716 1.00 0.00 H new ATOM 0 HB3 LYS A 25 20.467 -3.205 -20.323 1.00 0.00 H new ATOM 0 HG2 LYS A 25 18.788 -4.830 -18.369 1.00 0.00 H new ATOM 0 HG3 LYS A 25 18.096 -3.736 -19.550 1.00 0.00 H new ATOM 0 HD2 LYS A 25 19.252 -5.034 -21.378 1.00 0.00 H new ATOM 0 HD3 LYS A 25 19.841 -6.160 -20.171 1.00 0.00 H new ATOM 0 HE2 LYS A 25 17.490 -6.735 -19.553 1.00 0.00 H new ATOM 0 HE3 LYS A 25 16.895 -5.603 -20.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 16.940 -7.848 -21.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 18.031 -6.871 -22.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 18.607 -7.969 -21.313 1.00 0.00 H new ATOM 393 N ILE A 26 23.089 -2.605 -18.328 1.00 0.00 N ATOM 394 CA ILE A 26 24.309 -1.895 -18.622 1.00 0.00 C ATOM 395 C ILE A 26 25.459 -2.860 -18.487 1.00 0.00 C ATOM 396 O ILE A 26 26.352 -2.897 -19.328 1.00 0.00 O ATOM 397 CB ILE A 26 24.549 -0.740 -17.687 1.00 0.00 C ATOM 398 CG1 ILE A 26 23.490 0.347 -17.919 1.00 0.00 C ATOM 399 CG2 ILE A 26 25.978 -0.207 -17.920 1.00 0.00 C ATOM 400 CD1 ILE A 26 23.499 1.417 -16.829 1.00 0.00 C ATOM 0 H ILE A 26 22.590 -2.280 -17.500 1.00 0.00 H new ATOM 0 HA ILE A 26 24.225 -1.492 -19.631 1.00 0.00 H new ATOM 0 HB ILE A 26 24.462 -1.062 -16.649 1.00 0.00 H new ATOM 0 HG12 ILE A 26 23.664 0.818 -18.887 1.00 0.00 H new ATOM 0 HG13 ILE A 26 22.504 -0.115 -17.962 1.00 0.00 H new ATOM 0 HG21 ILE A 26 26.168 0.631 -17.249 1.00 0.00 H new ATOM 0 HG22 ILE A 26 26.699 -1.000 -17.722 1.00 0.00 H new ATOM 0 HG23 ILE A 26 26.078 0.125 -18.953 1.00 0.00 H new ATOM 0 HD11 ILE A 26 22.731 2.160 -17.043 1.00 0.00 H new ATOM 0 HD12 ILE A 26 23.297 0.954 -15.863 1.00 0.00 H new ATOM 0 HD13 ILE A 26 24.475 1.901 -16.802 1.00 0.00 H new ATOM 412 N SER A 27 25.436 -3.687 -17.419 1.00 0.00 N ATOM 413 CA SER A 27 26.515 -4.620 -17.163 1.00 0.00 C ATOM 414 C SER A 27 26.639 -5.636 -18.270 1.00 0.00 C ATOM 415 O SER A 27 27.750 -5.980 -18.668 1.00 0.00 O ATOM 416 CB SER A 27 26.346 -5.384 -15.832 1.00 0.00 C ATOM 417 OG SER A 27 27.444 -6.266 -15.614 1.00 0.00 O ATOM 0 H SER A 27 24.680 -3.715 -16.734 1.00 0.00 H new ATOM 0 HA SER A 27 27.415 -4.008 -17.106 1.00 0.00 H new ATOM 0 HB2 SER A 27 26.273 -4.675 -15.007 1.00 0.00 H new ATOM 0 HB3 SER A 27 25.415 -5.951 -15.848 1.00 0.00 H new ATOM 0 HG SER A 27 27.319 -6.740 -14.765 1.00 0.00 H new ATOM 423 N VAL A 28 25.512 -6.166 -18.780 1.00 0.00 N ATOM 424 CA VAL A 28 25.591 -7.170 -19.815 1.00 0.00 C ATOM 425 C VAL A 28 25.729 -6.512 -21.162 1.00 0.00 C ATOM 426 O VAL A 28 25.821 -7.198 -22.178 1.00 0.00 O ATOM 427 CB VAL A 28 24.395 -8.088 -19.857 1.00 0.00 C ATOM 428 CG1 VAL A 28 24.282 -8.797 -18.495 1.00 0.00 C ATOM 429 CG2 VAL A 28 23.137 -7.274 -20.205 1.00 0.00 C ATOM 0 H VAL A 28 24.567 -5.913 -18.491 1.00 0.00 H new ATOM 0 HA VAL A 28 26.465 -7.776 -19.577 1.00 0.00 H new ATOM 0 HB VAL A 28 24.505 -8.850 -20.629 1.00 0.00 H new ATOM 0 HG11 VAL A 28 23.422 -9.467 -18.504 1.00 0.00 H new ATOM 0 HG12 VAL A 28 25.189 -9.373 -18.308 1.00 0.00 H new ATOM 0 HG13 VAL A 28 24.155 -8.054 -17.707 1.00 0.00 H new ATOM 0 HG21 VAL A 28 22.272 -7.936 -20.236 1.00 0.00 H new ATOM 0 HG22 VAL A 28 22.979 -6.506 -19.448 1.00 0.00 H new ATOM 0 HG23 VAL A 28 23.267 -6.802 -21.179 1.00 0.00 H new ATOM 439 N SER A 29 25.752 -5.160 -21.218 1.00 0.00 N ATOM 440 CA SER A 29 25.892 -4.506 -22.501 1.00 0.00 C ATOM 441 C SER A 29 27.354 -4.499 -22.851 1.00 0.00 C ATOM 442 O SER A 29 28.210 -4.336 -21.995 1.00 0.00 O ATOM 443 CB SER A 29 25.403 -3.043 -22.517 1.00 0.00 C ATOM 444 OG SER A 29 23.985 -2.992 -22.415 1.00 0.00 O ATOM 0 H SER A 29 25.677 -4.538 -20.413 1.00 0.00 H new ATOM 0 HA SER A 29 25.276 -5.058 -23.211 1.00 0.00 H new ATOM 0 HB2 SER A 29 25.853 -2.494 -21.690 1.00 0.00 H new ATOM 0 HB3 SER A 29 25.725 -2.555 -23.437 1.00 0.00 H new ATOM 0 HG SER A 29 23.723 -3.026 -21.471 1.00 0.00 H new ATOM 450 N PRO A 30 27.659 -4.710 -24.112 1.00 0.00 N ATOM 451 CA PRO A 30 29.031 -4.686 -24.580 1.00 0.00 C ATOM 452 C PRO A 30 29.468 -3.312 -24.995 1.00 0.00 C ATOM 453 O PRO A 30 30.643 -3.072 -25.265 1.00 0.00 O ATOM 454 CB PRO A 30 28.998 -5.628 -25.778 1.00 0.00 C ATOM 455 CG PRO A 30 27.610 -5.396 -26.380 1.00 0.00 C ATOM 456 CD PRO A 30 26.709 -5.027 -25.191 1.00 0.00 C ATOM 0 HA PRO A 30 29.739 -4.980 -23.806 1.00 0.00 H new ATOM 0 HB2 PRO A 30 29.788 -5.397 -26.492 1.00 0.00 H new ATOM 0 HB3 PRO A 30 29.136 -6.666 -25.476 1.00 0.00 H new ATOM 0 HG2 PRO A 30 27.631 -4.596 -27.121 1.00 0.00 H new ATOM 0 HG3 PRO A 30 27.246 -6.290 -26.886 1.00 0.00 H new ATOM 0 HD2 PRO A 30 26.070 -4.175 -25.423 1.00 0.00 H new ATOM 0 HD3 PRO A 30 26.053 -5.853 -24.916 1.00 0.00 H new ATOM 464 N VAL A 31 28.496 -2.378 -25.065 1.00 0.00 N ATOM 465 CA VAL A 31 28.770 -1.023 -25.480 1.00 0.00 C ATOM 466 C VAL A 31 29.577 -0.310 -24.427 1.00 0.00 C ATOM 467 O VAL A 31 30.519 0.416 -24.743 1.00 0.00 O ATOM 468 CB VAL A 31 27.505 -0.235 -25.720 1.00 0.00 C ATOM 469 CG1 VAL A 31 27.871 1.236 -25.997 1.00 0.00 C ATOM 470 CG2 VAL A 31 26.747 -0.882 -26.894 1.00 0.00 C ATOM 0 H VAL A 31 27.519 -2.557 -24.835 1.00 0.00 H new ATOM 0 HA VAL A 31 29.326 -1.087 -26.415 1.00 0.00 H new ATOM 0 HB VAL A 31 26.854 -0.249 -24.846 1.00 0.00 H new ATOM 0 HG11 VAL A 31 26.961 1.811 -26.171 1.00 0.00 H new ATOM 0 HG12 VAL A 31 28.401 1.647 -25.138 1.00 0.00 H new ATOM 0 HG13 VAL A 31 28.510 1.292 -26.878 1.00 0.00 H new ATOM 0 HG21 VAL A 31 25.828 -0.327 -27.084 1.00 0.00 H new ATOM 0 HG22 VAL A 31 27.373 -0.863 -27.786 1.00 0.00 H new ATOM 0 HG23 VAL A 31 26.502 -1.914 -26.644 1.00 0.00 H new ATOM 480 N PHE A 32 29.225 -0.500 -23.136 1.00 0.00 N ATOM 481 CA PHE A 32 29.932 0.199 -22.086 1.00 0.00 C ATOM 482 C PHE A 32 31.256 -0.497 -21.846 1.00 0.00 C ATOM 483 O PHE A 32 31.394 -1.705 -22.040 1.00 0.00 O ATOM 484 CB PHE A 32 29.123 0.263 -20.756 1.00 0.00 C ATOM 485 CG PHE A 32 29.311 -0.892 -19.814 1.00 0.00 C ATOM 486 CD1 PHE A 32 29.608 -0.670 -18.485 1.00 0.00 C ATOM 487 CD2 PHE A 32 29.187 -2.184 -20.258 1.00 0.00 C ATOM 488 CE1 PHE A 32 29.775 -1.727 -17.622 1.00 0.00 C ATOM 489 CE2 PHE A 32 29.357 -3.241 -19.397 1.00 0.00 C ATOM 490 CZ PHE A 32 29.651 -3.013 -18.081 1.00 0.00 C ATOM 0 H PHE A 32 28.476 -1.116 -22.821 1.00 0.00 H new ATOM 0 HA PHE A 32 30.085 1.228 -22.412 1.00 0.00 H new ATOM 0 HB2 PHE A 32 29.394 1.180 -20.233 1.00 0.00 H new ATOM 0 HB3 PHE A 32 28.064 0.337 -21.002 1.00 0.00 H new ATOM 0 HD1 PHE A 32 29.710 0.341 -18.120 1.00 0.00 H new ATOM 0 HD2 PHE A 32 28.953 -2.372 -21.295 1.00 0.00 H new ATOM 0 HE1 PHE A 32 30.004 -1.544 -16.582 1.00 0.00 H new ATOM 0 HE2 PHE A 32 29.258 -4.253 -19.760 1.00 0.00 H new ATOM 0 HZ PHE A 32 29.785 -3.844 -17.405 1.00 0.00 H new ATOM 500 N PRO A 33 32.246 0.274 -21.446 1.00 0.00 N ATOM 501 CA PRO A 33 33.564 -0.261 -21.153 1.00 0.00 C ATOM 502 C PRO A 33 33.625 -0.930 -19.810 1.00 0.00 C ATOM 503 O PRO A 33 32.940 -0.532 -18.870 1.00 0.00 O ATOM 504 CB PRO A 33 34.474 0.964 -21.203 1.00 0.00 C ATOM 505 CG PRO A 33 33.570 2.105 -20.749 1.00 0.00 C ATOM 506 CD PRO A 33 32.175 1.730 -21.259 1.00 0.00 C ATOM 0 HA PRO A 33 33.854 -1.038 -21.860 1.00 0.00 H new ATOM 0 HB2 PRO A 33 35.336 0.850 -20.545 1.00 0.00 H new ATOM 0 HB3 PRO A 33 34.861 1.135 -22.208 1.00 0.00 H new ATOM 0 HG2 PRO A 33 33.579 2.208 -19.664 1.00 0.00 H new ATOM 0 HG3 PRO A 33 33.899 3.058 -21.163 1.00 0.00 H new ATOM 0 HD2 PRO A 33 31.401 2.003 -20.542 1.00 0.00 H new ATOM 0 HD3 PRO A 33 31.940 2.242 -22.192 1.00 0.00 H new ATOM 514 N GLN A 34 34.479 -1.966 -19.685 1.00 0.00 N ATOM 515 CA GLN A 34 34.592 -2.686 -18.440 1.00 0.00 C ATOM 516 C GLN A 34 35.357 -1.865 -17.429 1.00 0.00 C ATOM 517 O GLN A 34 35.301 -2.142 -16.234 1.00 0.00 O ATOM 518 CB GLN A 34 35.302 -4.052 -18.598 1.00 0.00 C ATOM 519 CG GLN A 34 36.792 -3.944 -18.986 1.00 0.00 C ATOM 520 CD GLN A 34 36.922 -3.991 -20.507 1.00 0.00 C ATOM 521 OE1 GLN A 34 36.094 -3.452 -21.234 1.00 0.00 O ATOM 522 NE2 GLN A 34 37.998 -4.652 -21.003 1.00 0.00 N ATOM 0 H GLN A 34 35.085 -2.305 -20.432 1.00 0.00 H new ATOM 0 HA GLN A 34 33.573 -2.870 -18.100 1.00 0.00 H new ATOM 0 HB2 GLN A 34 35.220 -4.603 -17.661 1.00 0.00 H new ATOM 0 HB3 GLN A 34 34.781 -4.635 -19.357 1.00 0.00 H new ATOM 0 HG2 GLN A 34 37.213 -3.015 -18.602 1.00 0.00 H new ATOM 0 HG3 GLN A 34 37.357 -4.760 -18.536 1.00 0.00 H new ATOM 0 HE21 GLN A 34 38.666 -5.088 -20.367 1.00 0.00 H new ATOM 0 HE22 GLN A 34 38.139 -4.713 -22.011 1.00 0.00 H new ATOM 531 N GLN A 35 36.089 -0.823 -17.882 1.00 0.00 N ATOM 532 CA GLN A 35 36.868 -0.023 -16.959 1.00 0.00 C ATOM 533 C GLN A 35 35.953 0.831 -16.116 1.00 0.00 C ATOM 534 O GLN A 35 36.302 1.193 -14.994 1.00 0.00 O ATOM 535 CB GLN A 35 37.886 0.900 -17.664 1.00 0.00 C ATOM 536 CG GLN A 35 37.233 2.067 -18.421 1.00 0.00 C ATOM 537 CD GLN A 35 38.303 2.763 -19.252 1.00 0.00 C ATOM 538 OE1 GLN A 35 38.783 2.222 -20.242 1.00 0.00 O ATOM 539 NE2 GLN A 35 38.689 3.996 -18.842 1.00 0.00 N ATOM 0 H GLN A 35 36.146 -0.535 -18.859 1.00 0.00 H new ATOM 0 HA GLN A 35 37.427 -0.727 -16.343 1.00 0.00 H new ATOM 0 HB2 GLN A 35 38.577 1.300 -16.922 1.00 0.00 H new ATOM 0 HB3 GLN A 35 38.477 0.309 -18.364 1.00 0.00 H new ATOM 0 HG2 GLN A 35 36.433 1.701 -19.064 1.00 0.00 H new ATOM 0 HG3 GLN A 35 36.782 2.769 -17.719 1.00 0.00 H new ATOM 0 HE21 GLN A 35 38.266 4.413 -18.013 1.00 0.00 H new ATOM 0 HE22 GLN A 35 39.402 4.507 -19.363 1.00 0.00 H new ATOM 548 N GLU A 36 34.748 1.172 -16.629 1.00 0.00 N ATOM 549 CA GLU A 36 33.847 2.008 -15.866 1.00 0.00 C ATOM 550 C GLU A 36 32.969 1.130 -15.019 1.00 0.00 C ATOM 551 O GLU A 36 32.177 1.627 -14.225 1.00 0.00 O ATOM 552 CB GLU A 36 32.948 2.926 -16.729 1.00 0.00 C ATOM 553 CG GLU A 36 31.741 2.208 -17.358 1.00 0.00 C ATOM 554 CD GLU A 36 30.931 3.224 -18.158 1.00 0.00 C ATOM 555 OE1 GLU A 36 31.485 4.310 -18.479 1.00 0.00 O ATOM 556 OE2 GLU A 36 29.746 2.926 -18.457 1.00 0.00 O ATOM 0 H GLU A 36 34.401 0.882 -17.543 1.00 0.00 H new ATOM 0 HA GLU A 36 34.474 2.666 -15.263 1.00 0.00 H new ATOM 0 HB2 GLU A 36 32.587 3.748 -16.111 1.00 0.00 H new ATOM 0 HB3 GLU A 36 33.551 3.365 -17.524 1.00 0.00 H new ATOM 0 HG2 GLU A 36 32.078 1.399 -18.006 1.00 0.00 H new ATOM 0 HG3 GLU A 36 31.122 1.758 -16.582 1.00 0.00 H new ATOM 563 N LYS A 37 33.085 -0.210 -15.175 1.00 0.00 N ATOM 564 CA LYS A 37 32.259 -1.125 -14.416 1.00 0.00 C ATOM 565 C LYS A 37 32.519 -0.928 -12.941 1.00 0.00 C ATOM 566 O LYS A 37 31.591 -0.967 -12.136 1.00 0.00 O ATOM 567 CB LYS A 37 32.527 -2.604 -14.759 1.00 0.00 C ATOM 568 CG LYS A 37 31.612 -3.569 -13.996 1.00 0.00 C ATOM 569 CD LYS A 37 31.863 -5.032 -14.370 1.00 0.00 C ATOM 570 CE LYS A 37 30.954 -5.995 -13.605 1.00 0.00 C ATOM 571 NZ LYS A 37 31.228 -7.391 -14.009 1.00 0.00 N ATOM 0 H LYS A 37 33.739 -0.659 -15.816 1.00 0.00 H new ATOM 0 HA LYS A 37 31.224 -0.903 -14.675 1.00 0.00 H new ATOM 0 HB2 LYS A 37 32.392 -2.754 -15.830 1.00 0.00 H new ATOM 0 HB3 LYS A 37 33.566 -2.842 -14.533 1.00 0.00 H new ATOM 0 HG2 LYS A 37 31.765 -3.440 -12.925 1.00 0.00 H new ATOM 0 HG3 LYS A 37 30.572 -3.318 -14.202 1.00 0.00 H new ATOM 0 HD2 LYS A 37 31.706 -5.162 -15.441 1.00 0.00 H new ATOM 0 HD3 LYS A 37 32.904 -5.282 -14.168 1.00 0.00 H new ATOM 0 HE2 LYS A 37 31.114 -5.882 -12.533 1.00 0.00 H new ATOM 0 HE3 LYS A 37 29.909 -5.751 -13.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 30.604 -8.034 -13.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 31.053 -7.498 -15.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 32.220 -7.624 -13.801 1.00 0.00 H new ATOM 585 N GLU A 38 33.796 -0.719 -12.550 1.00 0.00 N ATOM 586 CA GLU A 38 34.111 -0.528 -11.148 1.00 0.00 C ATOM 587 C GLU A 38 33.436 0.731 -10.662 1.00 0.00 C ATOM 588 O GLU A 38 32.906 0.776 -9.550 1.00 0.00 O ATOM 589 CB GLU A 38 35.623 -0.394 -10.883 1.00 0.00 C ATOM 590 CG GLU A 38 36.378 -1.715 -11.100 1.00 0.00 C ATOM 591 CD GLU A 38 37.875 -1.473 -10.930 1.00 0.00 C ATOM 592 OE1 GLU A 38 38.283 -0.284 -10.849 1.00 0.00 O ATOM 593 OE2 GLU A 38 38.630 -2.479 -10.881 1.00 0.00 O ATOM 0 H GLU A 38 34.596 -0.682 -13.181 1.00 0.00 H new ATOM 0 HA GLU A 38 33.756 -1.412 -10.618 1.00 0.00 H new ATOM 0 HB2 GLU A 38 36.038 0.370 -11.541 1.00 0.00 H new ATOM 0 HB3 GLU A 38 35.780 -0.053 -9.860 1.00 0.00 H new ATOM 0 HG2 GLU A 38 36.036 -2.465 -10.386 1.00 0.00 H new ATOM 0 HG3 GLU A 38 36.172 -2.106 -12.096 1.00 0.00 H new ATOM 600 N ASP A 39 33.447 1.796 -11.497 1.00 0.00 N ATOM 601 CA ASP A 39 32.819 3.044 -11.119 1.00 0.00 C ATOM 602 C ASP A 39 31.332 2.822 -11.020 1.00 0.00 C ATOM 603 O ASP A 39 30.673 3.365 -10.138 1.00 0.00 O ATOM 604 CB ASP A 39 33.070 4.180 -12.132 1.00 0.00 C ATOM 605 CG ASP A 39 34.509 4.675 -12.110 1.00 0.00 C ATOM 606 OD1 ASP A 39 35.236 4.346 -11.135 1.00 0.00 O ATOM 607 OD2 ASP A 39 34.901 5.389 -13.069 1.00 0.00 O ATOM 0 H ASP A 39 33.882 1.799 -12.420 1.00 0.00 H new ATOM 0 HA ASP A 39 33.255 3.349 -10.168 1.00 0.00 H new ATOM 0 HB2 ASP A 39 32.826 3.829 -13.134 1.00 0.00 H new ATOM 0 HB3 ASP A 39 32.400 5.012 -11.913 1.00 0.00 H new ATOM 612 N MET A 40 30.778 2.007 -11.944 1.00 0.00 N ATOM 613 CA MET A 40 29.358 1.730 -11.960 1.00 0.00 C ATOM 614 C MET A 40 28.970 1.059 -10.669 1.00 0.00 C ATOM 615 O MET A 40 27.931 1.369 -10.094 1.00 0.00 O ATOM 616 CB MET A 40 28.943 0.824 -13.143 1.00 0.00 C ATOM 617 CG MET A 40 27.430 0.582 -13.220 1.00 0.00 C ATOM 618 SD MET A 40 26.899 -0.934 -12.364 1.00 0.00 S ATOM 619 CE MET A 40 27.143 -2.046 -13.782 1.00 0.00 C ATOM 0 H MET A 40 31.307 1.539 -12.680 1.00 0.00 H new ATOM 0 HA MET A 40 28.841 2.683 -12.077 1.00 0.00 H new ATOM 0 HB2 MET A 40 29.279 1.278 -14.075 1.00 0.00 H new ATOM 0 HB3 MET A 40 29.453 -0.135 -13.054 1.00 0.00 H new ATOM 0 HG2 MET A 40 26.910 1.437 -12.787 1.00 0.00 H new ATOM 0 HG3 MET A 40 27.131 0.524 -14.267 1.00 0.00 H new ATOM 0 HE1 MET A 40 27.014 -3.079 -13.460 1.00 0.00 H new ATOM 0 HE2 MET A 40 26.413 -1.813 -14.557 1.00 0.00 H new ATOM 0 HE3 MET A 40 28.149 -1.913 -14.180 1.00 0.00 H new ATOM 629 N GLU A 41 29.807 0.121 -10.174 1.00 0.00 N ATOM 630 CA GLU A 41 29.499 -0.574 -8.942 1.00 0.00 C ATOM 631 C GLU A 41 29.444 0.420 -7.809 1.00 0.00 C ATOM 632 O GLU A 41 28.598 0.316 -6.920 1.00 0.00 O ATOM 633 CB GLU A 41 30.538 -1.655 -8.584 1.00 0.00 C ATOM 634 CG GLU A 41 30.473 -2.869 -9.526 1.00 0.00 C ATOM 635 CD GLU A 41 31.652 -3.792 -9.239 1.00 0.00 C ATOM 636 OE1 GLU A 41 32.625 -3.335 -8.580 1.00 0.00 O ATOM 637 OE2 GLU A 41 31.595 -4.971 -9.679 1.00 0.00 O ATOM 0 H GLU A 41 30.684 -0.157 -10.614 1.00 0.00 H new ATOM 0 HA GLU A 41 28.539 -1.068 -9.091 1.00 0.00 H new ATOM 0 HB2 GLU A 41 31.537 -1.221 -8.624 1.00 0.00 H new ATOM 0 HB3 GLU A 41 30.375 -1.986 -7.558 1.00 0.00 H new ATOM 0 HG2 GLU A 41 29.534 -3.404 -9.384 1.00 0.00 H new ATOM 0 HG3 GLU A 41 30.498 -2.540 -10.565 1.00 0.00 H new ATOM 644 N SER A 42 30.365 1.407 -7.813 1.00 0.00 N ATOM 645 CA SER A 42 30.385 2.408 -6.763 1.00 0.00 C ATOM 646 C SER A 42 29.118 3.223 -6.844 1.00 0.00 C ATOM 647 O SER A 42 28.531 3.584 -5.821 1.00 0.00 O ATOM 648 CB SER A 42 31.577 3.380 -6.873 1.00 0.00 C ATOM 649 OG SER A 42 32.800 2.681 -6.671 1.00 0.00 O ATOM 0 H SER A 42 31.087 1.519 -8.525 1.00 0.00 H new ATOM 0 HA SER A 42 30.475 1.873 -5.818 1.00 0.00 H new ATOM 0 HB2 SER A 42 31.579 3.855 -7.854 1.00 0.00 H new ATOM 0 HB3 SER A 42 31.477 4.175 -6.134 1.00 0.00 H new ATOM 0 HG SER A 42 33.551 3.307 -6.745 1.00 0.00 H new ATOM 655 N ILE A 43 28.678 3.538 -8.083 1.00 0.00 N ATOM 656 CA ILE A 43 27.475 4.317 -8.285 1.00 0.00 C ATOM 657 C ILE A 43 26.295 3.551 -7.744 1.00 0.00 C ATOM 658 O ILE A 43 25.409 4.132 -7.130 1.00 0.00 O ATOM 659 CB ILE A 43 27.221 4.626 -9.742 1.00 0.00 C ATOM 660 CG1 ILE A 43 28.288 5.604 -10.265 1.00 0.00 C ATOM 661 CG2 ILE A 43 25.795 5.201 -9.890 1.00 0.00 C ATOM 662 CD1 ILE A 43 28.250 5.757 -11.786 1.00 0.00 C ATOM 0 H ILE A 43 29.149 3.258 -8.943 1.00 0.00 H new ATOM 0 HA ILE A 43 27.610 5.263 -7.761 1.00 0.00 H new ATOM 0 HB ILE A 43 27.291 3.717 -10.340 1.00 0.00 H new ATOM 0 HG12 ILE A 43 28.140 6.579 -9.802 1.00 0.00 H new ATOM 0 HG13 ILE A 43 29.275 5.254 -9.963 1.00 0.00 H new ATOM 0 HG21 ILE A 43 25.601 5.428 -10.938 1.00 0.00 H new ATOM 0 HG22 ILE A 43 25.069 4.469 -9.537 1.00 0.00 H new ATOM 0 HG23 ILE A 43 25.707 6.113 -9.299 1.00 0.00 H new ATOM 0 HD11 ILE A 43 29.023 6.458 -12.101 1.00 0.00 H new ATOM 0 HD12 ILE A 43 28.426 4.788 -12.254 1.00 0.00 H new ATOM 0 HD13 ILE A 43 27.273 6.134 -12.089 1.00 0.00 H new ATOM 674 N VAL A 44 26.263 2.217 -7.962 1.00 0.00 N ATOM 675 CA VAL A 44 25.148 1.408 -7.501 1.00 0.00 C ATOM 676 C VAL A 44 25.037 1.500 -6.000 1.00 0.00 C ATOM 677 O VAL A 44 23.941 1.662 -5.464 1.00 0.00 O ATOM 678 CB VAL A 44 25.301 -0.049 -7.856 1.00 0.00 C ATOM 679 CG1 VAL A 44 24.186 -0.859 -7.161 1.00 0.00 C ATOM 680 CG2 VAL A 44 25.259 -0.185 -9.383 1.00 0.00 C ATOM 0 H VAL A 44 26.993 1.697 -8.449 1.00 0.00 H new ATOM 0 HA VAL A 44 24.259 1.798 -7.996 1.00 0.00 H new ATOM 0 HB VAL A 44 26.255 -0.445 -7.509 1.00 0.00 H new ATOM 0 HG11 VAL A 44 24.291 -1.914 -7.414 1.00 0.00 H new ATOM 0 HG12 VAL A 44 24.265 -0.735 -6.081 1.00 0.00 H new ATOM 0 HG13 VAL A 44 23.213 -0.501 -7.497 1.00 0.00 H new ATOM 0 HG21 VAL A 44 25.368 -1.234 -9.658 1.00 0.00 H new ATOM 0 HG22 VAL A 44 24.306 0.190 -9.756 1.00 0.00 H new ATOM 0 HG23 VAL A 44 26.073 0.392 -9.822 1.00 0.00 H new ATOM 690 N GLU A 45 26.175 1.398 -5.281 1.00 0.00 N ATOM 691 CA GLU A 45 26.138 1.442 -3.834 1.00 0.00 C ATOM 692 C GLU A 45 25.628 2.785 -3.377 1.00 0.00 C ATOM 693 O GLU A 45 24.843 2.871 -2.434 1.00 0.00 O ATOM 694 CB GLU A 45 27.520 1.214 -3.191 1.00 0.00 C ATOM 695 CG GLU A 45 28.013 -0.233 -3.357 1.00 0.00 C ATOM 696 CD GLU A 45 29.432 -0.346 -2.809 1.00 0.00 C ATOM 697 OE1 GLU A 45 30.047 0.715 -2.519 1.00 0.00 O ATOM 698 OE2 GLU A 45 29.917 -1.500 -2.672 1.00 0.00 O ATOM 0 H GLU A 45 27.105 1.287 -5.684 1.00 0.00 H new ATOM 0 HA GLU A 45 25.477 0.635 -3.518 1.00 0.00 H new ATOM 0 HB2 GLU A 45 28.243 1.895 -3.640 1.00 0.00 H new ATOM 0 HB3 GLU A 45 27.469 1.458 -2.130 1.00 0.00 H new ATOM 0 HG2 GLU A 45 27.351 -0.918 -2.828 1.00 0.00 H new ATOM 0 HG3 GLU A 45 27.993 -0.518 -4.409 1.00 0.00 H new ATOM 705 N THR A 46 26.069 3.869 -4.042 1.00 0.00 N ATOM 706 CA THR A 46 25.640 5.199 -3.657 1.00 0.00 C ATOM 707 C THR A 46 24.184 5.365 -3.994 1.00 0.00 C ATOM 708 O THR A 46 23.423 5.948 -3.224 1.00 0.00 O ATOM 709 CB THR A 46 26.412 6.296 -4.348 1.00 0.00 C ATOM 710 OG1 THR A 46 27.797 6.179 -4.043 1.00 0.00 O ATOM 711 CG2 THR A 46 25.888 7.662 -3.872 1.00 0.00 C ATOM 0 H THR A 46 26.711 3.838 -4.834 1.00 0.00 H new ATOM 0 HA THR A 46 25.822 5.290 -2.586 1.00 0.00 H new ATOM 0 HB THR A 46 26.279 6.210 -5.426 1.00 0.00 H new ATOM 0 HG1 THR A 46 28.177 5.421 -4.534 1.00 0.00 H new ATOM 0 HG21 THR A 46 26.443 8.458 -4.369 1.00 0.00 H new ATOM 0 HG22 THR A 46 24.829 7.751 -4.116 1.00 0.00 H new ATOM 0 HG23 THR A 46 26.020 7.746 -2.793 1.00 0.00 H new ATOM 719 N MET A 47 23.769 4.855 -5.169 1.00 0.00 N ATOM 720 CA MET A 47 22.394 4.967 -5.593 1.00 0.00 C ATOM 721 C MET A 47 21.519 4.270 -4.591 1.00 0.00 C ATOM 722 O MET A 47 20.498 4.809 -4.170 1.00 0.00 O ATOM 723 CB MET A 47 22.152 4.328 -6.977 1.00 0.00 C ATOM 724 CG MET A 47 20.687 4.374 -7.422 1.00 0.00 C ATOM 725 SD MET A 47 20.035 6.063 -7.589 1.00 0.00 S ATOM 726 CE MET A 47 18.340 5.522 -7.946 1.00 0.00 C ATOM 0 H MET A 47 24.377 4.367 -5.827 1.00 0.00 H new ATOM 0 HA MET A 47 22.157 6.029 -5.664 1.00 0.00 H new ATOM 0 HB2 MET A 47 22.765 4.841 -7.718 1.00 0.00 H new ATOM 0 HB3 MET A 47 22.484 3.290 -6.952 1.00 0.00 H new ATOM 0 HG2 MET A 47 20.589 3.859 -8.377 1.00 0.00 H new ATOM 0 HG3 MET A 47 20.079 3.827 -6.701 1.00 0.00 H new ATOM 0 HE1 MET A 47 17.656 6.361 -7.817 1.00 0.00 H new ATOM 0 HE2 MET A 47 18.282 5.161 -8.973 1.00 0.00 H new ATOM 0 HE3 MET A 47 18.063 4.719 -7.263 1.00 0.00 H new ATOM 736 N MET A 48 21.913 3.052 -4.171 1.00 0.00 N ATOM 737 CA MET A 48 21.120 2.310 -3.226 1.00 0.00 C ATOM 738 C MET A 48 21.104 3.042 -1.909 1.00 0.00 C ATOM 739 O MET A 48 20.089 3.056 -1.210 1.00 0.00 O ATOM 740 CB MET A 48 21.641 0.883 -2.984 1.00 0.00 C ATOM 741 CG MET A 48 20.562 -0.039 -2.411 1.00 0.00 C ATOM 742 SD MET A 48 19.966 -1.270 -3.612 1.00 0.00 S ATOM 743 CE MET A 48 18.810 -0.154 -4.467 1.00 0.00 C ATOM 0 H MET A 48 22.766 2.584 -4.477 1.00 0.00 H new ATOM 0 HA MET A 48 20.120 2.226 -3.652 1.00 0.00 H new ATOM 0 HB2 MET A 48 22.009 0.469 -3.923 1.00 0.00 H new ATOM 0 HB3 MET A 48 22.487 0.919 -2.298 1.00 0.00 H new ATOM 0 HG2 MET A 48 20.960 -0.555 -1.537 1.00 0.00 H new ATOM 0 HG3 MET A 48 19.721 0.564 -2.069 1.00 0.00 H new ATOM 0 HE1 MET A 48 17.833 -0.632 -4.545 1.00 0.00 H new ATOM 0 HE2 MET A 48 18.716 0.774 -3.903 1.00 0.00 H new ATOM 0 HE3 MET A 48 19.187 0.065 -5.466 1.00 0.00 H new ATOM 753 N SER A 49 22.246 3.663 -1.526 1.00 0.00 N ATOM 754 CA SER A 49 22.305 4.389 -0.273 1.00 0.00 C ATOM 755 C SER A 49 21.324 5.529 -0.331 1.00 0.00 C ATOM 756 O SER A 49 20.627 5.811 0.640 1.00 0.00 O ATOM 757 CB SER A 49 23.704 4.967 0.029 1.00 0.00 C ATOM 758 OG SER A 49 23.706 5.647 1.282 1.00 0.00 O ATOM 0 H SER A 49 23.111 3.666 -2.066 1.00 0.00 H new ATOM 0 HA SER A 49 22.065 3.681 0.520 1.00 0.00 H new ATOM 0 HB2 SER A 49 24.440 4.163 0.044 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.999 5.654 -0.764 1.00 0.00 H new ATOM 0 HG SER A 49 24.601 6.006 1.458 1.00 0.00 H new ATOM 764 N ALA A 50 21.268 6.224 -1.487 1.00 0.00 N ATOM 765 CA ALA A 50 20.369 7.346 -1.648 1.00 0.00 C ATOM 766 C ALA A 50 18.941 6.872 -1.530 1.00 0.00 C ATOM 767 O ALA A 50 18.107 7.550 -0.930 1.00 0.00 O ATOM 768 CB ALA A 50 20.524 8.044 -3.011 1.00 0.00 C ATOM 0 H ALA A 50 21.838 6.016 -2.307 1.00 0.00 H new ATOM 0 HA ALA A 50 20.621 8.061 -0.865 1.00 0.00 H new ATOM 0 HB1 ALA A 50 19.824 8.877 -3.075 1.00 0.00 H new ATOM 0 HB2 ALA A 50 21.543 8.417 -3.115 1.00 0.00 H new ATOM 0 HB3 ALA A 50 20.314 7.333 -3.810 1.00 0.00 H new ATOM 774 N ILE A 51 18.623 5.690 -2.109 1.00 0.00 N ATOM 775 CA ILE A 51 17.269 5.174 -2.051 1.00 0.00 C ATOM 776 C ILE A 51 16.901 4.936 -0.614 1.00 0.00 C ATOM 777 O ILE A 51 15.822 5.321 -0.167 1.00 0.00 O ATOM 778 CB ILE A 51 17.097 3.864 -2.793 1.00 0.00 C ATOM 779 CG1 ILE A 51 17.302 4.059 -4.310 1.00 0.00 C ATOM 780 CG2 ILE A 51 15.699 3.294 -2.476 1.00 0.00 C ATOM 781 CD1 ILE A 51 16.290 5.019 -4.930 1.00 0.00 C ATOM 0 H ILE A 51 19.285 5.097 -2.609 1.00 0.00 H new ATOM 0 HA ILE A 51 16.628 5.917 -2.526 1.00 0.00 H new ATOM 0 HB ILE A 51 17.853 3.152 -2.463 1.00 0.00 H new ATOM 0 HG12 ILE A 51 18.309 4.436 -4.490 1.00 0.00 H new ATOM 0 HG13 ILE A 51 17.230 3.092 -4.808 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.562 2.350 -3.004 1.00 0.00 H new ATOM 0 HG22 ILE A 51 15.610 3.125 -1.403 1.00 0.00 H new ATOM 0 HG23 ILE A 51 14.936 4.003 -2.797 1.00 0.00 H new ATOM 0 HD11 ILE A 51 16.486 5.115 -5.998 1.00 0.00 H new ATOM 0 HD12 ILE A 51 15.282 4.632 -4.779 1.00 0.00 H new ATOM 0 HD13 ILE A 51 16.378 5.997 -4.456 1.00 0.00 H new ATOM 793 N SER A 52 17.810 4.297 0.144 1.00 0.00 N ATOM 794 CA SER A 52 17.546 3.997 1.534 1.00 0.00 C ATOM 795 C SER A 52 17.417 5.275 2.318 1.00 0.00 C ATOM 796 O SER A 52 16.582 5.379 3.212 1.00 0.00 O ATOM 797 CB SER A 52 18.661 3.159 2.189 1.00 0.00 C ATOM 798 OG SER A 52 18.731 1.875 1.581 1.00 0.00 O ATOM 0 H SER A 52 18.722 3.987 -0.193 1.00 0.00 H new ATOM 0 HA SER A 52 16.622 3.419 1.551 1.00 0.00 H new ATOM 0 HB2 SER A 52 19.618 3.671 2.087 1.00 0.00 H new ATOM 0 HB3 SER A 52 18.468 3.054 3.257 1.00 0.00 H new ATOM 0 HG SER A 52 19.444 1.351 2.003 1.00 0.00 H new ATOM 804 N GLY A 53 18.270 6.277 2.013 1.00 0.00 N ATOM 805 CA GLY A 53 18.235 7.528 2.739 1.00 0.00 C ATOM 806 C GLY A 53 16.919 8.230 2.535 1.00 0.00 C ATOM 807 O GLY A 53 16.333 8.733 3.491 1.00 0.00 O ATOM 0 H GLY A 53 18.975 6.229 1.277 1.00 0.00 H new ATOM 0 HA2 GLY A 53 18.391 7.341 3.801 1.00 0.00 H new ATOM 0 HA3 GLY A 53 19.050 8.170 2.405 1.00 0.00 H new ATOM 811 N VAL A 54 16.426 8.306 1.278 1.00 0.00 N ATOM 812 CA VAL A 54 15.175 8.996 1.031 1.00 0.00 C ATOM 813 C VAL A 54 14.029 8.171 1.551 1.00 0.00 C ATOM 814 O VAL A 54 13.136 8.688 2.225 1.00 0.00 O ATOM 815 CB VAL A 54 14.926 9.282 -0.430 1.00 0.00 C ATOM 816 CG1 VAL A 54 13.504 9.859 -0.592 1.00 0.00 C ATOM 817 CG2 VAL A 54 16.007 10.260 -0.924 1.00 0.00 C ATOM 0 H VAL A 54 16.872 7.906 0.452 1.00 0.00 H new ATOM 0 HA VAL A 54 15.248 9.952 1.549 1.00 0.00 H new ATOM 0 HB VAL A 54 14.986 8.374 -1.030 1.00 0.00 H new ATOM 0 HG11 VAL A 54 13.314 10.069 -1.645 1.00 0.00 H new ATOM 0 HG12 VAL A 54 12.774 9.135 -0.229 1.00 0.00 H new ATOM 0 HG13 VAL A 54 13.418 10.781 -0.017 1.00 0.00 H new ATOM 0 HG21 VAL A 54 15.844 10.479 -1.979 1.00 0.00 H new ATOM 0 HG22 VAL A 54 15.952 11.184 -0.348 1.00 0.00 H new ATOM 0 HG23 VAL A 54 16.991 9.810 -0.795 1.00 0.00 H new ATOM 827 N SER A 55 14.035 6.856 1.260 1.00 0.00 N ATOM 828 CA SER A 55 12.950 6.007 1.695 1.00 0.00 C ATOM 829 C SER A 55 13.390 5.261 2.913 1.00 0.00 C ATOM 830 O SER A 55 13.780 4.096 2.835 1.00 0.00 O ATOM 831 CB SER A 55 12.525 4.974 0.632 1.00 0.00 C ATOM 832 OG SER A 55 11.769 5.607 -0.393 1.00 0.00 O ATOM 0 H SER A 55 14.770 6.382 0.736 1.00 0.00 H new ATOM 0 HA SER A 55 12.094 6.653 1.890 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.407 4.499 0.203 1.00 0.00 H new ATOM 0 HB3 SER A 55 11.933 4.186 1.097 1.00 0.00 H new ATOM 0 HG SER A 55 11.506 4.942 -1.063 1.00 0.00 H new ATOM 916 N GLU A 62 4.865 12.628 -2.290 1.00 0.00 N ATOM 917 CA GLU A 62 5.036 12.907 -3.697 1.00 0.00 C ATOM 918 C GLU A 62 6.483 13.228 -3.948 1.00 0.00 C ATOM 919 O GLU A 62 7.037 12.873 -4.988 1.00 0.00 O ATOM 920 CB GLU A 62 4.188 14.098 -4.185 1.00 0.00 C ATOM 921 CG GLU A 62 2.684 13.780 -4.208 1.00 0.00 C ATOM 922 CD GLU A 62 1.910 15.044 -4.570 1.00 0.00 C ATOM 923 OE1 GLU A 62 2.530 16.142 -4.581 1.00 0.00 O ATOM 924 OE2 GLU A 62 0.685 14.925 -4.838 1.00 0.00 O ATOM 0 HA GLU A 62 4.708 12.023 -4.244 1.00 0.00 H new ATOM 0 HB2 GLU A 62 4.365 14.956 -3.536 1.00 0.00 H new ATOM 0 HB3 GLU A 62 4.511 14.384 -5.186 1.00 0.00 H new ATOM 0 HG2 GLU A 62 2.478 12.993 -4.933 1.00 0.00 H new ATOM 0 HG3 GLU A 62 2.363 13.409 -3.234 1.00 0.00 H new ATOM 931 N ALA A 63 7.129 13.926 -2.985 1.00 0.00 N ATOM 932 CA ALA A 63 8.518 14.295 -3.132 1.00 0.00 C ATOM 933 C ALA A 63 9.347 13.049 -3.244 1.00 0.00 C ATOM 934 O ALA A 63 10.300 13.000 -4.011 1.00 0.00 O ATOM 935 CB ALA A 63 9.059 15.105 -1.940 1.00 0.00 C ATOM 0 H ALA A 63 6.698 14.233 -2.113 1.00 0.00 H new ATOM 0 HA ALA A 63 8.582 14.918 -4.024 1.00 0.00 H new ATOM 0 HB1 ALA A 63 10.107 15.350 -2.113 1.00 0.00 H new ATOM 0 HB2 ALA A 63 8.484 16.025 -1.834 1.00 0.00 H new ATOM 0 HB3 ALA A 63 8.970 14.514 -1.028 1.00 0.00 H new ATOM 941 N THR A 64 8.999 12.011 -2.460 1.00 0.00 N ATOM 942 CA THR A 64 9.746 10.772 -2.485 1.00 0.00 C ATOM 943 C THR A 64 9.620 10.135 -3.842 1.00 0.00 C ATOM 944 O THR A 64 10.602 9.667 -4.411 1.00 0.00 O ATOM 945 CB THR A 64 9.258 9.776 -1.464 1.00 0.00 C ATOM 946 OG1 THR A 64 9.387 10.319 -0.156 1.00 0.00 O ATOM 947 CG2 THR A 64 10.084 8.483 -1.576 1.00 0.00 C ATOM 0 H THR A 64 8.211 12.020 -1.813 1.00 0.00 H new ATOM 0 HA THR A 64 10.780 11.027 -2.253 1.00 0.00 H new ATOM 0 HB THR A 64 8.208 9.553 -1.651 1.00 0.00 H new ATOM 0 HG1 THR A 64 9.066 9.667 0.502 1.00 0.00 H new ATOM 0 HG21 THR A 64 9.732 7.762 -0.838 1.00 0.00 H new ATOM 0 HG22 THR A 64 9.970 8.064 -2.576 1.00 0.00 H new ATOM 0 HG23 THR A 64 11.135 8.706 -1.393 1.00 0.00 H new ATOM 955 N LEU A 65 8.391 10.114 -4.396 1.00 0.00 N ATOM 956 CA LEU A 65 8.170 9.489 -5.684 1.00 0.00 C ATOM 957 C LEU A 65 8.937 10.225 -6.751 1.00 0.00 C ATOM 958 O LEU A 65 9.567 9.612 -7.613 1.00 0.00 O ATOM 959 CB LEU A 65 6.684 9.498 -6.098 1.00 0.00 C ATOM 960 CG LEU A 65 5.808 8.580 -5.228 1.00 0.00 C ATOM 961 CD1 LEU A 65 4.315 8.795 -5.520 1.00 0.00 C ATOM 962 CD2 LEU A 65 6.196 7.104 -5.400 1.00 0.00 C ATOM 0 H LEU A 65 7.559 10.520 -3.968 1.00 0.00 H new ATOM 0 HA LEU A 65 8.506 8.457 -5.586 1.00 0.00 H new ATOM 0 HB2 LEU A 65 6.303 10.517 -6.038 1.00 0.00 H new ATOM 0 HB3 LEU A 65 6.602 9.188 -7.140 1.00 0.00 H new ATOM 0 HG LEU A 65 5.988 8.849 -4.187 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.722 8.132 -4.890 1.00 0.00 H new ATOM 0 HD12 LEU A 65 4.048 9.831 -5.309 1.00 0.00 H new ATOM 0 HD13 LEU A 65 4.114 8.575 -6.568 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.557 6.484 -4.771 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.070 6.814 -6.443 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.237 6.965 -5.108 1.00 0.00 H new ATOM 974 N GLN A 66 8.901 11.570 -6.708 1.00 0.00 N ATOM 975 CA GLN A 66 9.583 12.362 -7.705 1.00 0.00 C ATOM 976 C GLN A 66 11.073 12.232 -7.530 1.00 0.00 C ATOM 977 O GLN A 66 11.813 12.123 -8.506 1.00 0.00 O ATOM 978 CB GLN A 66 9.221 13.861 -7.616 1.00 0.00 C ATOM 979 CG GLN A 66 9.784 14.692 -8.779 1.00 0.00 C ATOM 980 CD GLN A 66 9.169 14.194 -10.081 1.00 0.00 C ATOM 981 OE1 GLN A 66 7.953 14.159 -10.233 1.00 0.00 O ATOM 982 NE2 GLN A 66 10.030 13.799 -11.051 1.00 0.00 N ATOM 0 H GLN A 66 8.409 12.110 -5.996 1.00 0.00 H new ATOM 0 HA GLN A 66 9.265 11.984 -8.677 1.00 0.00 H new ATOM 0 HB2 GLN A 66 8.136 13.965 -7.596 1.00 0.00 H new ATOM 0 HB3 GLN A 66 9.597 14.263 -6.675 1.00 0.00 H new ATOM 0 HG2 GLN A 66 9.556 15.748 -8.633 1.00 0.00 H new ATOM 0 HG3 GLN A 66 10.870 14.603 -8.816 1.00 0.00 H new ATOM 0 HE21 GLN A 66 11.036 13.842 -10.888 1.00 0.00 H new ATOM 0 HE22 GLN A 66 9.672 13.459 -11.943 1.00 0.00 H new ATOM 991 N ALA A 67 11.541 12.243 -6.265 1.00 0.00 N ATOM 992 CA ALA A 67 12.956 12.160 -5.987 1.00 0.00 C ATOM 993 C ALA A 67 13.507 10.846 -6.462 1.00 0.00 C ATOM 994 O ALA A 67 14.608 10.796 -6.995 1.00 0.00 O ATOM 995 CB ALA A 67 13.277 12.287 -4.487 1.00 0.00 C ATOM 0 H ALA A 67 10.949 12.309 -5.437 1.00 0.00 H new ATOM 0 HA ALA A 67 13.415 12.995 -6.516 1.00 0.00 H new ATOM 0 HB1 ALA A 67 14.355 12.217 -4.338 1.00 0.00 H new ATOM 0 HB2 ALA A 67 12.921 13.249 -4.119 1.00 0.00 H new ATOM 0 HB3 ALA A 67 12.783 11.484 -3.940 1.00 0.00 H new ATOM 1001 N MET A 68 12.757 9.741 -6.274 1.00 0.00 N ATOM 1002 CA MET A 68 13.258 8.448 -6.682 1.00 0.00 C ATOM 1003 C MET A 68 13.302 8.361 -8.178 1.00 0.00 C ATOM 1004 O MET A 68 14.301 7.919 -8.740 1.00 0.00 O ATOM 1005 CB MET A 68 12.415 7.275 -6.148 1.00 0.00 C ATOM 1006 CG MET A 68 13.022 6.635 -4.897 1.00 0.00 C ATOM 1007 SD MET A 68 13.208 7.797 -3.510 1.00 0.00 S ATOM 1008 CE MET A 68 14.980 8.110 -3.768 1.00 0.00 C ATOM 0 H MET A 68 11.828 9.733 -5.852 1.00 0.00 H new ATOM 0 HA MET A 68 14.257 8.362 -6.256 1.00 0.00 H new ATOM 0 HB2 MET A 68 11.410 7.629 -5.919 1.00 0.00 H new ATOM 0 HB3 MET A 68 12.317 6.519 -6.927 1.00 0.00 H new ATOM 0 HG2 MET A 68 12.393 5.802 -4.582 1.00 0.00 H new ATOM 0 HG3 MET A 68 13.998 6.220 -5.147 1.00 0.00 H new ATOM 0 HE1 MET A 68 15.551 7.657 -2.958 1.00 0.00 H new ATOM 0 HE2 MET A 68 15.291 7.677 -4.718 1.00 0.00 H new ATOM 0 HE3 MET A 68 15.161 9.185 -3.782 1.00 0.00 H new ATOM 1018 N ASN A 69 12.225 8.789 -8.871 1.00 0.00 N ATOM 1019 CA ASN A 69 12.210 8.726 -10.314 1.00 0.00 C ATOM 1020 C ASN A 69 13.340 9.577 -10.844 1.00 0.00 C ATOM 1021 O ASN A 69 14.026 9.193 -11.793 1.00 0.00 O ATOM 1022 CB ASN A 69 10.873 9.213 -10.909 1.00 0.00 C ATOM 1023 CG ASN A 69 10.845 9.128 -12.432 1.00 0.00 C ATOM 1024 OD1 ASN A 69 11.016 8.059 -13.010 1.00 0.00 O ATOM 1025 ND2 ASN A 69 10.621 10.283 -13.105 1.00 0.00 N ATOM 0 H ASN A 69 11.379 9.172 -8.448 1.00 0.00 H new ATOM 0 HA ASN A 69 12.332 7.684 -10.610 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.058 8.616 -10.500 1.00 0.00 H new ATOM 0 HB3 ASN A 69 10.697 10.244 -10.603 1.00 0.00 H new ATOM 0 HD21 ASN A 69 10.590 10.281 -14.125 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.483 11.154 -12.592 1.00 0.00 H new ATOM 1032 N MET A 70 13.558 10.758 -10.231 1.00 0.00 N ATOM 1033 CA MET A 70 14.617 11.638 -10.661 1.00 0.00 C ATOM 1034 C MET A 70 15.946 10.991 -10.359 1.00 0.00 C ATOM 1035 O MET A 70 16.886 11.100 -11.140 1.00 0.00 O ATOM 1036 CB MET A 70 14.577 13.009 -9.955 1.00 0.00 C ATOM 1037 CG MET A 70 15.622 13.995 -10.494 1.00 0.00 C ATOM 1038 SD MET A 70 15.385 14.402 -12.250 1.00 0.00 S ATOM 1039 CE MET A 70 13.986 15.528 -11.973 1.00 0.00 C ATOM 0 H MET A 70 13.009 11.106 -9.444 1.00 0.00 H new ATOM 0 HA MET A 70 14.482 11.806 -11.729 1.00 0.00 H new ATOM 0 HB2 MET A 70 13.584 13.442 -10.072 1.00 0.00 H new ATOM 0 HB3 MET A 70 14.739 12.866 -8.887 1.00 0.00 H new ATOM 0 HG2 MET A 70 15.583 14.912 -9.907 1.00 0.00 H new ATOM 0 HG3 MET A 70 16.617 13.571 -10.357 1.00 0.00 H new ATOM 0 HE1 MET A 70 13.092 15.121 -12.446 1.00 0.00 H new ATOM 0 HE2 MET A 70 13.813 15.637 -10.902 1.00 0.00 H new ATOM 0 HE3 MET A 70 14.213 16.503 -12.405 1.00 0.00 H new ATOM 1049 N ALA A 71 16.052 10.309 -9.195 1.00 0.00 N ATOM 1050 CA ALA A 71 17.296 9.687 -8.804 1.00 0.00 C ATOM 1051 C ALA A 71 17.694 8.619 -9.794 1.00 0.00 C ATOM 1052 O ALA A 71 18.873 8.494 -10.128 1.00 0.00 O ATOM 1053 CB ALA A 71 17.226 9.039 -7.410 1.00 0.00 C ATOM 0 H ALA A 71 15.288 10.187 -8.530 1.00 0.00 H new ATOM 0 HA ALA A 71 18.034 10.489 -8.780 1.00 0.00 H new ATOM 0 HB1 ALA A 71 18.189 8.588 -7.170 1.00 0.00 H new ATOM 0 HB2 ALA A 71 16.986 9.800 -6.667 1.00 0.00 H new ATOM 0 HB3 ALA A 71 16.453 8.270 -7.405 1.00 0.00 H new ATOM 1059 N PHE A 72 16.723 7.814 -10.290 1.00 0.00 N ATOM 1060 CA PHE A 72 17.059 6.760 -11.225 1.00 0.00 C ATOM 1061 C PHE A 72 17.571 7.386 -12.485 1.00 0.00 C ATOM 1062 O PHE A 72 18.558 6.929 -13.065 1.00 0.00 O ATOM 1063 CB PHE A 72 15.859 5.871 -11.615 1.00 0.00 C ATOM 1064 CG PHE A 72 15.363 4.986 -10.518 1.00 0.00 C ATOM 1065 CD1 PHE A 72 14.189 5.281 -9.863 1.00 0.00 C ATOM 1066 CD2 PHE A 72 16.069 3.862 -10.146 1.00 0.00 C ATOM 1067 CE1 PHE A 72 13.727 4.474 -8.854 1.00 0.00 C ATOM 1068 CE2 PHE A 72 15.604 3.054 -9.136 1.00 0.00 C ATOM 1069 CZ PHE A 72 14.434 3.360 -8.490 1.00 0.00 C ATOM 0 H PHE A 72 15.733 7.885 -10.055 1.00 0.00 H new ATOM 0 HA PHE A 72 17.797 6.130 -10.729 1.00 0.00 H new ATOM 0 HB2 PHE A 72 15.041 6.511 -11.947 1.00 0.00 H new ATOM 0 HB3 PHE A 72 16.143 5.251 -12.465 1.00 0.00 H new ATOM 0 HD1 PHE A 72 13.625 6.157 -10.146 1.00 0.00 H new ATOM 0 HD2 PHE A 72 16.992 3.615 -10.650 1.00 0.00 H new ATOM 0 HE1 PHE A 72 12.805 4.718 -8.347 1.00 0.00 H new ATOM 0 HE2 PHE A 72 16.162 2.175 -8.850 1.00 0.00 H new ATOM 0 HZ PHE A 72 14.071 2.724 -7.696 1.00 0.00 H new ATOM 1079 N ALA A 73 16.900 8.464 -12.934 1.00 0.00 N ATOM 1080 CA ALA A 73 17.301 9.133 -14.143 1.00 0.00 C ATOM 1081 C ALA A 73 18.660 9.752 -13.949 1.00 0.00 C ATOM 1082 O ALA A 73 19.487 9.729 -14.852 1.00 0.00 O ATOM 1083 CB ALA A 73 16.323 10.246 -14.566 1.00 0.00 C ATOM 0 H ALA A 73 16.089 8.871 -12.469 1.00 0.00 H new ATOM 0 HA ALA A 73 17.313 8.377 -14.928 1.00 0.00 H new ATOM 0 HB1 ALA A 73 16.679 10.714 -15.484 1.00 0.00 H new ATOM 0 HB2 ALA A 73 15.335 9.817 -14.736 1.00 0.00 H new ATOM 0 HB3 ALA A 73 16.262 10.996 -13.777 1.00 0.00 H new ATOM 1089 N SER A 74 18.911 10.328 -12.755 1.00 0.00 N ATOM 1090 CA SER A 74 20.179 10.978 -12.486 1.00 0.00 C ATOM 1091 C SER A 74 21.301 9.974 -12.522 1.00 0.00 C ATOM 1092 O SER A 74 22.372 10.259 -13.054 1.00 0.00 O ATOM 1093 CB SER A 74 20.218 11.666 -11.108 1.00 0.00 C ATOM 1094 OG SER A 74 19.277 12.733 -11.067 1.00 0.00 O ATOM 0 H SER A 74 18.250 10.349 -11.979 1.00 0.00 H new ATOM 0 HA SER A 74 20.297 11.735 -13.262 1.00 0.00 H new ATOM 0 HB2 SER A 74 19.993 10.942 -10.325 1.00 0.00 H new ATOM 0 HB3 SER A 74 21.220 12.047 -10.911 1.00 0.00 H new ATOM 0 HG SER A 74 18.368 12.368 -11.086 1.00 0.00 H new ATOM 1100 N SER A 75 21.089 8.772 -11.942 1.00 0.00 N ATOM 1101 CA SER A 75 22.138 7.767 -11.921 1.00 0.00 C ATOM 1102 C SER A 75 22.471 7.366 -13.335 1.00 0.00 C ATOM 1103 O SER A 75 23.645 7.293 -13.715 1.00 0.00 O ATOM 1104 CB SER A 75 21.727 6.496 -11.147 1.00 0.00 C ATOM 1105 OG SER A 75 22.785 5.541 -11.150 1.00 0.00 O ATOM 0 H SER A 75 20.216 8.492 -11.495 1.00 0.00 H new ATOM 0 HA SER A 75 22.996 8.212 -11.416 1.00 0.00 H new ATOM 0 HB2 SER A 75 21.468 6.757 -10.121 1.00 0.00 H new ATOM 0 HB3 SER A 75 20.836 6.061 -11.599 1.00 0.00 H new ATOM 0 HG SER A 75 22.507 4.743 -10.654 1.00 0.00 H new ATOM 1111 N MET A 76 21.434 7.100 -14.152 1.00 0.00 N ATOM 1112 CA MET A 76 21.652 6.693 -15.517 1.00 0.00 C ATOM 1113 C MET A 76 22.263 7.838 -16.279 1.00 0.00 C ATOM 1114 O MET A 76 23.127 7.636 -17.128 1.00 0.00 O ATOM 1115 CB MET A 76 20.352 6.275 -16.231 1.00 0.00 C ATOM 1116 CG MET A 76 19.751 4.977 -15.672 1.00 0.00 C ATOM 1117 SD MET A 76 20.849 3.534 -15.856 1.00 0.00 S ATOM 1118 CE MET A 76 21.424 3.500 -14.130 1.00 0.00 C ATOM 0 H MET A 76 20.454 7.164 -13.877 1.00 0.00 H new ATOM 0 HA MET A 76 22.313 5.827 -15.492 1.00 0.00 H new ATOM 0 HB2 MET A 76 19.620 7.077 -16.139 1.00 0.00 H new ATOM 0 HB3 MET A 76 20.553 6.147 -17.295 1.00 0.00 H new ATOM 0 HG2 MET A 76 19.521 5.117 -14.616 1.00 0.00 H new ATOM 0 HG3 MET A 76 18.808 4.774 -16.179 1.00 0.00 H new ATOM 0 HE1 MET A 76 22.437 3.098 -14.092 1.00 0.00 H new ATOM 0 HE2 MET A 76 21.420 4.512 -13.725 1.00 0.00 H new ATOM 0 HE3 MET A 76 20.761 2.869 -13.538 1.00 0.00 H new ATOM 1128 N ALA A 77 21.821 9.077 -15.979 1.00 0.00 N ATOM 1129 CA ALA A 77 22.325 10.244 -16.667 1.00 0.00 C ATOM 1130 C ALA A 77 23.805 10.383 -16.434 1.00 0.00 C ATOM 1131 O ALA A 77 24.535 10.745 -17.345 1.00 0.00 O ATOM 1132 CB ALA A 77 21.651 11.551 -16.210 1.00 0.00 C ATOM 0 H ALA A 77 21.119 9.276 -15.266 1.00 0.00 H new ATOM 0 HA ALA A 77 22.101 10.092 -17.723 1.00 0.00 H new ATOM 0 HB1 ALA A 77 22.072 12.390 -16.763 1.00 0.00 H new ATOM 0 HB2 ALA A 77 20.579 11.493 -16.399 1.00 0.00 H new ATOM 0 HB3 ALA A 77 21.824 11.696 -15.144 1.00 0.00 H new ATOM 1138 N GLU A 78 24.290 10.100 -15.204 1.00 0.00 N ATOM 1139 CA GLU A 78 25.708 10.240 -14.932 1.00 0.00 C ATOM 1140 C GLU A 78 26.478 9.290 -15.810 1.00 0.00 C ATOM 1141 O GLU A 78 27.522 9.649 -16.361 1.00 0.00 O ATOM 1142 CB GLU A 78 26.078 9.942 -13.465 1.00 0.00 C ATOM 1143 CG GLU A 78 25.584 11.032 -12.500 1.00 0.00 C ATOM 1144 CD GLU A 78 25.825 10.579 -11.064 1.00 0.00 C ATOM 1145 OE1 GLU A 78 26.115 9.370 -10.858 1.00 0.00 O ATOM 1146 OE2 GLU A 78 25.723 11.441 -10.152 1.00 0.00 O ATOM 0 H GLU A 78 23.726 9.783 -14.415 1.00 0.00 H new ATOM 0 HA GLU A 78 25.963 11.280 -15.136 1.00 0.00 H new ATOM 0 HB2 GLU A 78 25.651 8.983 -13.174 1.00 0.00 H new ATOM 0 HB3 GLU A 78 27.161 9.848 -13.379 1.00 0.00 H new ATOM 0 HG2 GLU A 78 26.108 11.968 -12.691 1.00 0.00 H new ATOM 0 HG3 GLU A 78 24.523 11.222 -12.660 1.00 0.00 H new ATOM 1153 N LEU A 79 25.975 8.049 -15.960 1.00 0.00 N ATOM 1154 CA LEU A 79 26.655 7.077 -16.792 1.00 0.00 C ATOM 1155 C LEU A 79 26.584 7.526 -18.229 1.00 0.00 C ATOM 1156 O LEU A 79 27.544 7.382 -18.987 1.00 0.00 O ATOM 1157 CB LEU A 79 26.040 5.666 -16.694 1.00 0.00 C ATOM 1158 CG LEU A 79 26.301 5.001 -15.330 1.00 0.00 C ATOM 1159 CD1 LEU A 79 25.472 3.720 -15.166 1.00 0.00 C ATOM 1160 CD2 LEU A 79 27.799 4.720 -15.124 1.00 0.00 C ATOM 0 H LEU A 79 25.118 7.715 -15.520 1.00 0.00 H new ATOM 0 HA LEU A 79 27.684 7.016 -16.437 1.00 0.00 H new ATOM 0 HB2 LEU A 79 24.965 5.729 -16.864 1.00 0.00 H new ATOM 0 HB3 LEU A 79 26.451 5.039 -17.485 1.00 0.00 H new ATOM 0 HG LEU A 79 25.985 5.702 -14.558 1.00 0.00 H new ATOM 0 HD11 LEU A 79 25.679 3.275 -14.193 1.00 0.00 H new ATOM 0 HD12 LEU A 79 24.411 3.961 -15.236 1.00 0.00 H new ATOM 0 HD13 LEU A 79 25.736 3.013 -15.952 1.00 0.00 H new ATOM 0 HD21 LEU A 79 27.951 4.250 -14.152 1.00 0.00 H new ATOM 0 HD22 LEU A 79 28.155 4.053 -15.909 1.00 0.00 H new ATOM 0 HD23 LEU A 79 28.354 5.657 -15.165 1.00 0.00 H new ATOM 1172 N VAL A 80 25.423 8.082 -18.631 1.00 0.00 N ATOM 1173 CA VAL A 80 25.229 8.539 -19.990 1.00 0.00 C ATOM 1174 C VAL A 80 26.172 9.679 -20.286 1.00 0.00 C ATOM 1175 O VAL A 80 26.749 9.739 -21.362 1.00 0.00 O ATOM 1176 CB VAL A 80 23.816 9.007 -20.256 1.00 0.00 C ATOM 1177 CG1 VAL A 80 23.754 9.686 -21.640 1.00 0.00 C ATOM 1178 CG2 VAL A 80 22.878 7.789 -20.168 1.00 0.00 C ATOM 0 H VAL A 80 24.616 8.218 -18.022 1.00 0.00 H new ATOM 0 HA VAL A 80 25.429 7.685 -20.637 1.00 0.00 H new ATOM 0 HB VAL A 80 23.499 9.742 -19.517 1.00 0.00 H new ATOM 0 HG11 VAL A 80 22.736 10.024 -21.834 1.00 0.00 H new ATOM 0 HG12 VAL A 80 24.430 10.541 -21.656 1.00 0.00 H new ATOM 0 HG13 VAL A 80 24.052 8.973 -22.409 1.00 0.00 H new ATOM 0 HG21 VAL A 80 21.852 8.105 -20.357 1.00 0.00 H new ATOM 0 HG22 VAL A 80 23.172 7.049 -20.912 1.00 0.00 H new ATOM 0 HG23 VAL A 80 22.945 7.350 -19.173 1.00 0.00 H new ATOM 1188 N ILE A 81 26.362 10.612 -19.330 1.00 0.00 N ATOM 1189 CA ILE A 81 27.229 11.749 -19.572 1.00 0.00 C ATOM 1190 C ILE A 81 28.620 11.278 -19.876 1.00 0.00 C ATOM 1191 O ILE A 81 29.242 11.742 -20.832 1.00 0.00 O ATOM 1192 CB ILE A 81 27.332 12.679 -18.395 1.00 0.00 C ATOM 1193 CG1 ILE A 81 26.005 13.417 -18.176 1.00 0.00 C ATOM 1194 CG2 ILE A 81 28.492 13.658 -18.670 1.00 0.00 C ATOM 1195 CD1 ILE A 81 25.924 14.096 -16.807 1.00 0.00 C ATOM 0 H ILE A 81 25.930 10.590 -18.406 1.00 0.00 H new ATOM 0 HA ILE A 81 26.783 12.286 -20.409 1.00 0.00 H new ATOM 0 HB ILE A 81 27.535 12.123 -17.480 1.00 0.00 H new ATOM 0 HG12 ILE A 81 25.878 14.167 -18.957 1.00 0.00 H new ATOM 0 HG13 ILE A 81 25.181 12.711 -18.276 1.00 0.00 H new ATOM 0 HG21 ILE A 81 28.592 14.348 -17.832 1.00 0.00 H new ATOM 0 HG22 ILE A 81 29.419 13.098 -18.793 1.00 0.00 H new ATOM 0 HG23 ILE A 81 28.285 14.221 -19.580 1.00 0.00 H new ATOM 0 HD11 ILE A 81 24.964 14.602 -16.708 1.00 0.00 H new ATOM 0 HD12 ILE A 81 26.021 13.346 -16.022 1.00 0.00 H new ATOM 0 HD13 ILE A 81 26.729 14.825 -16.714 1.00 0.00 H new ATOM 1207 N ALA A 82 29.141 10.332 -19.071 1.00 0.00 N ATOM 1208 CA ALA A 82 30.488 9.863 -19.283 1.00 0.00 C ATOM 1209 C ALA A 82 30.598 9.252 -20.653 1.00 0.00 C ATOM 1210 O ALA A 82 31.547 9.515 -21.383 1.00 0.00 O ATOM 1211 CB ALA A 82 30.921 8.805 -18.253 1.00 0.00 C ATOM 0 H ALA A 82 28.649 9.897 -18.291 1.00 0.00 H new ATOM 0 HA ALA A 82 31.141 10.729 -19.177 1.00 0.00 H new ATOM 0 HB1 ALA A 82 31.943 8.490 -18.463 1.00 0.00 H new ATOM 0 HB2 ALA A 82 30.871 9.231 -17.251 1.00 0.00 H new ATOM 0 HB3 ALA A 82 30.256 7.944 -18.314 1.00 0.00 H new ATOM 1217 N GLU A 83 29.606 8.440 -21.044 1.00 0.00 N ATOM 1218 CA GLU A 83 29.655 7.800 -22.335 1.00 0.00 C ATOM 1219 C GLU A 83 29.470 8.820 -23.435 1.00 0.00 C ATOM 1220 O GLU A 83 30.127 8.748 -24.463 1.00 0.00 O ATOM 1221 CB GLU A 83 28.578 6.713 -22.503 1.00 0.00 C ATOM 1222 CG GLU A 83 28.856 5.471 -21.639 1.00 0.00 C ATOM 1223 CD GLU A 83 27.660 4.527 -21.720 1.00 0.00 C ATOM 1224 OE1 GLU A 83 26.565 4.983 -22.149 1.00 0.00 O ATOM 1225 OE2 GLU A 83 27.830 3.334 -21.356 1.00 0.00 O ATOM 0 H GLU A 83 28.780 8.223 -20.486 1.00 0.00 H new ATOM 0 HA GLU A 83 30.635 7.328 -22.402 1.00 0.00 H new ATOM 0 HB2 GLU A 83 27.605 7.126 -22.238 1.00 0.00 H new ATOM 0 HB3 GLU A 83 28.524 6.418 -23.551 1.00 0.00 H new ATOM 0 HG2 GLU A 83 29.757 4.966 -21.986 1.00 0.00 H new ATOM 0 HG3 GLU A 83 29.033 5.765 -20.604 1.00 0.00 H new ATOM 1232 N ASP A 84 28.571 9.803 -23.227 1.00 0.00 N ATOM 1233 CA ASP A 84 28.277 10.793 -24.248 1.00 0.00 C ATOM 1234 C ASP A 84 29.488 11.631 -24.568 1.00 0.00 C ATOM 1235 O ASP A 84 29.799 11.843 -25.738 1.00 0.00 O ATOM 1236 CB ASP A 84 27.140 11.750 -23.825 1.00 0.00 C ATOM 1237 CG ASP A 84 26.715 12.691 -24.947 1.00 0.00 C ATOM 1238 OD1 ASP A 84 26.195 12.184 -25.975 1.00 0.00 O ATOM 1239 OD2 ASP A 84 26.901 13.925 -24.785 1.00 0.00 O ATOM 0 H ASP A 84 28.045 9.921 -22.361 1.00 0.00 H new ATOM 0 HA ASP A 84 27.967 10.226 -25.126 1.00 0.00 H new ATOM 0 HB2 ASP A 84 26.279 11.165 -23.502 1.00 0.00 H new ATOM 0 HB3 ASP A 84 27.466 12.338 -22.967 1.00 0.00 H new ATOM 1244 N VAL A 85 30.188 12.145 -23.543 1.00 0.00 N ATOM 1245 CA VAL A 85 31.334 12.992 -23.796 1.00 0.00 C ATOM 1246 C VAL A 85 32.418 12.192 -24.464 1.00 0.00 C ATOM 1247 O VAL A 85 33.040 12.646 -25.423 1.00 0.00 O ATOM 1248 CB VAL A 85 31.897 13.608 -22.537 1.00 0.00 C ATOM 1249 CG1 VAL A 85 33.223 14.320 -22.875 1.00 0.00 C ATOM 1250 CG2 VAL A 85 30.848 14.577 -21.962 1.00 0.00 C ATOM 0 H VAL A 85 29.977 11.986 -22.558 1.00 0.00 H new ATOM 0 HA VAL A 85 30.990 13.801 -24.440 1.00 0.00 H new ATOM 0 HB VAL A 85 32.113 12.850 -21.784 1.00 0.00 H new ATOM 0 HG11 VAL A 85 33.636 14.768 -21.971 1.00 0.00 H new ATOM 0 HG12 VAL A 85 33.932 13.597 -23.279 1.00 0.00 H new ATOM 0 HG13 VAL A 85 33.039 15.099 -23.615 1.00 0.00 H new ATOM 0 HG21 VAL A 85 31.235 15.033 -21.051 1.00 0.00 H new ATOM 0 HG22 VAL A 85 30.632 15.355 -22.694 1.00 0.00 H new ATOM 0 HG23 VAL A 85 29.934 14.030 -21.733 1.00 0.00 H new ATOM 1260 N ASN A 86 32.663 10.969 -23.962 1.00 0.00 N ATOM 1261 CA ASN A 86 33.716 10.144 -24.506 1.00 0.00 C ATOM 1262 C ASN A 86 33.367 9.654 -25.894 1.00 0.00 C ATOM 1263 O ASN A 86 34.236 9.601 -26.763 1.00 0.00 O ATOM 1264 CB ASN A 86 34.030 8.941 -23.597 1.00 0.00 C ATOM 1265 CG ASN A 86 34.841 9.370 -22.377 1.00 0.00 C ATOM 1266 OD1 ASN A 86 36.065 9.421 -22.420 1.00 0.00 O ATOM 1267 ND2 ASN A 86 34.141 9.733 -21.269 1.00 0.00 N ATOM 0 H ASN A 86 32.145 10.548 -23.191 1.00 0.00 H new ATOM 0 HA ASN A 86 34.605 10.772 -24.564 1.00 0.00 H new ATOM 0 HB2 ASN A 86 33.100 8.474 -23.273 1.00 0.00 H new ATOM 0 HB3 ASN A 86 34.585 8.191 -24.160 1.00 0.00 H new ATOM 0 HD21 ASN A 86 34.634 10.060 -20.439 1.00 0.00 H new ATOM 0 HD22 ASN A 86 33.122 9.678 -21.268 1.00 0.00 H new ATOM 1274 N ASN A 87 32.095 9.276 -26.145 1.00 0.00 N ATOM 1275 CA ASN A 87 31.735 8.796 -27.458 1.00 0.00 C ATOM 1276 C ASN A 87 30.230 8.880 -27.585 1.00 0.00 C ATOM 1277 O ASN A 87 29.500 8.028 -27.075 1.00 0.00 O ATOM 1278 CB ASN A 87 32.158 7.327 -27.693 1.00 0.00 C ATOM 1279 CG ASN A 87 32.044 6.918 -29.157 1.00 0.00 C ATOM 1280 OD1 ASN A 87 31.349 7.558 -29.943 1.00 0.00 O ATOM 1281 ND2 ASN A 87 32.742 5.820 -29.538 1.00 0.00 N ATOM 0 H ASN A 87 31.334 9.299 -25.466 1.00 0.00 H new ATOM 0 HA ASN A 87 32.252 9.411 -28.195 1.00 0.00 H new ATOM 0 HB2 ASN A 87 33.186 7.190 -27.359 1.00 0.00 H new ATOM 0 HB3 ASN A 87 31.535 6.670 -27.085 1.00 0.00 H new ATOM 0 HD21 ASN A 87 32.701 5.500 -30.506 1.00 0.00 H new ATOM 0 HD22 ASN A 87 33.308 5.314 -28.857 1.00 0.00 H new ATOM 1288 N PRO A 88 29.746 9.884 -28.289 1.00 0.00 N ATOM 1289 CA PRO A 88 28.311 10.072 -28.474 1.00 0.00 C ATOM 1290 C PRO A 88 27.674 9.027 -29.348 1.00 0.00 C ATOM 1291 O PRO A 88 26.460 8.835 -29.309 1.00 0.00 O ATOM 1292 CB PRO A 88 28.188 11.459 -29.107 1.00 0.00 C ATOM 1293 CG PRO A 88 29.519 11.662 -29.823 1.00 0.00 C ATOM 1294 CD PRO A 88 30.541 10.919 -28.965 1.00 0.00 C ATOM 0 HA PRO A 88 27.786 9.981 -27.523 1.00 0.00 H new ATOM 0 HB2 PRO A 88 27.350 11.507 -29.803 1.00 0.00 H new ATOM 0 HB3 PRO A 88 28.020 12.228 -28.353 1.00 0.00 H new ATOM 0 HG2 PRO A 88 29.488 11.262 -30.836 1.00 0.00 H new ATOM 0 HG3 PRO A 88 29.766 12.720 -29.905 1.00 0.00 H new ATOM 0 HD2 PRO A 88 31.332 10.481 -29.574 1.00 0.00 H new ATOM 0 HD3 PRO A 88 31.022 11.585 -28.249 1.00 0.00 H new ATOM 1302 N ASP A 89 28.488 8.327 -30.165 1.00 0.00 N ATOM 1303 CA ASP A 89 27.954 7.302 -31.042 1.00 0.00 C ATOM 1304 C ASP A 89 27.447 6.171 -30.189 1.00 0.00 C ATOM 1305 O ASP A 89 26.426 5.544 -30.488 1.00 0.00 O ATOM 1306 CB ASP A 89 28.999 6.733 -32.026 1.00 0.00 C ATOM 1307 CG ASP A 89 29.384 7.734 -33.107 1.00 0.00 C ATOM 1308 OD1 ASP A 89 28.659 8.751 -33.263 1.00 0.00 O ATOM 1309 OD2 ASP A 89 30.410 7.490 -33.795 1.00 0.00 O ATOM 0 H ASP A 89 29.498 8.460 -30.225 1.00 0.00 H new ATOM 0 HA ASP A 89 27.165 7.763 -31.637 1.00 0.00 H new ATOM 0 HB2 ASP A 89 29.891 6.438 -31.474 1.00 0.00 H new ATOM 0 HB3 ASP A 89 28.601 5.832 -32.494 1.00 0.00 H new ATOM 1314 N SER A 90 28.180 5.892 -29.093 1.00 0.00 N ATOM 1315 CA SER A 90 27.820 4.824 -28.189 1.00 0.00 C ATOM 1316 C SER A 90 26.478 5.121 -27.585 1.00 0.00 C ATOM 1317 O SER A 90 25.687 4.216 -27.354 1.00 0.00 O ATOM 1318 CB SER A 90 28.827 4.645 -27.036 1.00 0.00 C ATOM 1319 OG SER A 90 30.082 4.212 -27.546 1.00 0.00 O ATOM 0 H SER A 90 29.023 6.402 -28.827 1.00 0.00 H new ATOM 0 HA SER A 90 27.810 3.906 -28.776 1.00 0.00 H new ATOM 0 HB2 SER A 90 28.949 5.586 -26.500 1.00 0.00 H new ATOM 0 HB3 SER A 90 28.446 3.917 -26.320 1.00 0.00 H new ATOM 0 HG SER A 90 30.716 4.103 -26.806 1.00 0.00 H new ATOM 1325 N ILE A 91 26.206 6.410 -27.306 1.00 0.00 N ATOM 1326 CA ILE A 91 24.953 6.801 -26.694 1.00 0.00 C ATOM 1327 C ILE A 91 23.802 6.447 -27.593 1.00 0.00 C ATOM 1328 O ILE A 91 22.780 5.968 -27.119 1.00 0.00 O ATOM 1329 CB ILE A 91 24.880 8.277 -26.401 1.00 0.00 C ATOM 1330 CG1 ILE A 91 25.911 8.646 -25.329 1.00 0.00 C ATOM 1331 CG2 ILE A 91 23.446 8.637 -25.959 1.00 0.00 C ATOM 1332 CD1 ILE A 91 25.684 7.899 -24.015 1.00 0.00 C ATOM 0 H ILE A 91 26.843 7.183 -27.499 1.00 0.00 H new ATOM 0 HA ILE A 91 24.895 6.259 -25.750 1.00 0.00 H new ATOM 0 HB ILE A 91 25.116 8.850 -27.298 1.00 0.00 H new ATOM 0 HG12 ILE A 91 26.911 8.425 -25.701 1.00 0.00 H new ATOM 0 HG13 ILE A 91 25.870 9.719 -25.144 1.00 0.00 H new ATOM 0 HG21 ILE A 91 23.388 9.704 -25.746 1.00 0.00 H new ATOM 0 HG22 ILE A 91 22.746 8.388 -26.757 1.00 0.00 H new ATOM 0 HG23 ILE A 91 23.189 8.073 -25.062 1.00 0.00 H new ATOM 0 HD11 ILE A 91 26.442 8.198 -23.291 1.00 0.00 H new ATOM 0 HD12 ILE A 91 24.695 8.140 -23.625 1.00 0.00 H new ATOM 0 HD13 ILE A 91 25.753 6.825 -24.190 1.00 0.00 H new ATOM 1344 N ALA A 92 23.925 6.681 -28.914 1.00 0.00 N ATOM 1345 CA ALA A 92 22.826 6.381 -29.808 1.00 0.00 C ATOM 1346 C ALA A 92 22.518 4.905 -29.760 1.00 0.00 C ATOM 1347 O ALA A 92 21.352 4.506 -29.685 1.00 0.00 O ATOM 1348 CB ALA A 92 23.128 6.756 -31.271 1.00 0.00 C ATOM 0 H ALA A 92 24.756 7.066 -29.362 1.00 0.00 H new ATOM 0 HA ALA A 92 21.979 6.977 -29.469 1.00 0.00 H new ATOM 0 HB1 ALA A 92 22.269 6.509 -31.895 1.00 0.00 H new ATOM 0 HB2 ALA A 92 23.330 7.825 -31.338 1.00 0.00 H new ATOM 0 HB3 ALA A 92 23.999 6.200 -31.617 1.00 0.00 H new ATOM 1354 N GLU A 93 23.565 4.058 -29.784 1.00 0.00 N ATOM 1355 CA GLU A 93 23.353 2.624 -29.758 1.00 0.00 C ATOM 1356 C GLU A 93 22.840 2.211 -28.400 1.00 0.00 C ATOM 1357 O GLU A 93 21.958 1.358 -28.288 1.00 0.00 O ATOM 1358 CB GLU A 93 24.641 1.824 -30.038 1.00 0.00 C ATOM 1359 CG GLU A 93 25.114 1.966 -31.494 1.00 0.00 C ATOM 1360 CD GLU A 93 26.450 1.246 -31.659 1.00 0.00 C ATOM 1361 OE1 GLU A 93 27.045 0.847 -30.622 1.00 0.00 O ATOM 1362 OE2 GLU A 93 26.891 1.089 -32.827 1.00 0.00 O ATOM 0 H GLU A 93 24.542 4.348 -29.821 1.00 0.00 H new ATOM 0 HA GLU A 93 22.632 2.403 -30.545 1.00 0.00 H new ATOM 0 HB2 GLU A 93 25.430 2.165 -29.368 1.00 0.00 H new ATOM 0 HB3 GLU A 93 24.467 0.771 -29.816 1.00 0.00 H new ATOM 0 HG2 GLU A 93 24.373 1.544 -32.173 1.00 0.00 H new ATOM 0 HG3 GLU A 93 25.220 3.019 -31.754 1.00 0.00 H new ATOM 1369 N LYS A 94 23.393 2.821 -27.330 1.00 0.00 N ATOM 1370 CA LYS A 94 23.003 2.482 -25.980 1.00 0.00 C ATOM 1371 C LYS A 94 21.569 2.883 -25.752 1.00 0.00 C ATOM 1372 O LYS A 94 20.820 2.170 -25.097 1.00 0.00 O ATOM 1373 CB LYS A 94 23.873 3.189 -24.920 1.00 0.00 C ATOM 1374 CG LYS A 94 23.681 2.619 -23.510 1.00 0.00 C ATOM 1375 CD LYS A 94 24.518 1.358 -23.276 1.00 0.00 C ATOM 1376 CE LYS A 94 24.200 0.676 -21.944 1.00 0.00 C ATOM 1377 NZ LYS A 94 22.978 -0.148 -22.067 1.00 0.00 N ATOM 0 H LYS A 94 24.107 3.546 -27.393 1.00 0.00 H new ATOM 0 HA LYS A 94 23.136 1.405 -25.873 1.00 0.00 H new ATOM 0 HB2 LYS A 94 24.922 3.101 -25.202 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.633 4.252 -24.912 1.00 0.00 H new ATOM 0 HG2 LYS A 94 23.954 3.375 -22.774 1.00 0.00 H new ATOM 0 HG3 LYS A 94 22.627 2.388 -23.354 1.00 0.00 H new ATOM 0 HD2 LYS A 94 24.343 0.655 -24.090 1.00 0.00 H new ATOM 0 HD3 LYS A 94 25.576 1.619 -23.302 1.00 0.00 H new ATOM 0 HE2 LYS A 94 25.039 0.051 -21.639 1.00 0.00 H new ATOM 0 HE3 LYS A 94 24.063 1.428 -21.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 22.412 -0.061 -21.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 22.418 0.181 -22.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 23.243 -1.143 -22.209 1.00 0.00 H new ATOM 1391 N THR A 95 21.157 4.047 -26.299 1.00 0.00 N ATOM 1392 CA THR A 95 19.804 4.537 -26.107 1.00 0.00 C ATOM 1393 C THR A 95 18.829 3.554 -26.684 1.00 0.00 C ATOM 1394 O THR A 95 17.788 3.283 -26.087 1.00 0.00 O ATOM 1395 CB THR A 95 19.558 5.874 -26.761 1.00 0.00 C ATOM 1396 OG1 THR A 95 20.427 6.854 -26.207 1.00 0.00 O ATOM 1397 CG2 THR A 95 18.094 6.294 -26.529 1.00 0.00 C ATOM 0 H THR A 95 21.748 4.650 -26.871 1.00 0.00 H new ATOM 0 HA THR A 95 19.670 4.658 -25.032 1.00 0.00 H new ATOM 0 HB THR A 95 19.751 5.791 -27.830 1.00 0.00 H new ATOM 0 HG1 THR A 95 21.320 6.760 -26.601 1.00 0.00 H new ATOM 0 HG21 THR A 95 17.914 7.260 -27.001 1.00 0.00 H new ATOM 0 HG22 THR A 95 17.428 5.548 -26.963 1.00 0.00 H new ATOM 0 HG23 THR A 95 17.903 6.371 -25.459 1.00 0.00 H new ATOM 1405 N GLU A 96 19.130 2.999 -27.879 1.00 0.00 N ATOM 1406 CA GLU A 96 18.226 2.052 -28.491 1.00 0.00 C ATOM 1407 C GLU A 96 18.088 0.846 -27.591 1.00 0.00 C ATOM 1408 O GLU A 96 16.981 0.354 -27.364 1.00 0.00 O ATOM 1409 CB GLU A 96 18.713 1.568 -29.873 1.00 0.00 C ATOM 1410 CG GLU A 96 17.726 0.599 -30.549 1.00 0.00 C ATOM 1411 CD GLU A 96 18.260 0.221 -31.926 1.00 0.00 C ATOM 1412 OE1 GLU A 96 19.359 0.712 -32.297 1.00 0.00 O ATOM 1413 OE2 GLU A 96 17.571 -0.568 -32.626 1.00 0.00 O ATOM 0 H GLU A 96 19.976 3.196 -28.414 1.00 0.00 H new ATOM 0 HA GLU A 96 17.274 2.564 -28.629 1.00 0.00 H new ATOM 0 HB2 GLU A 96 18.869 2.431 -30.521 1.00 0.00 H new ATOM 0 HB3 GLU A 96 19.679 1.075 -29.761 1.00 0.00 H new ATOM 0 HG2 GLU A 96 17.598 -0.294 -29.937 1.00 0.00 H new ATOM 0 HG3 GLU A 96 16.745 1.065 -30.641 1.00 0.00 H new ATOM 1420 N ALA A 97 19.224 0.342 -27.055 1.00 0.00 N ATOM 1421 CA ALA A 97 19.187 -0.819 -26.191 1.00 0.00 C ATOM 1422 C ALA A 97 18.436 -0.494 -24.923 1.00 0.00 C ATOM 1423 O ALA A 97 17.651 -1.303 -24.431 1.00 0.00 O ATOM 1424 CB ALA A 97 20.592 -1.310 -25.797 1.00 0.00 C ATOM 0 H ALA A 97 20.155 0.727 -27.213 1.00 0.00 H new ATOM 0 HA ALA A 97 18.689 -1.608 -26.755 1.00 0.00 H new ATOM 0 HB1 ALA A 97 20.504 -2.182 -25.149 1.00 0.00 H new ATOM 0 HB2 ALA A 97 21.148 -1.579 -26.695 1.00 0.00 H new ATOM 0 HB3 ALA A 97 21.120 -0.517 -25.268 1.00 0.00 H new ATOM 1430 N LEU A 98 18.669 0.710 -24.364 1.00 0.00 N ATOM 1431 CA LEU A 98 18.013 1.108 -23.134 1.00 0.00 C ATOM 1432 C LEU A 98 16.540 1.249 -23.363 1.00 0.00 C ATOM 1433 O LEU A 98 15.746 0.934 -22.485 1.00 0.00 O ATOM 1434 CB LEU A 98 18.537 2.439 -22.554 1.00 0.00 C ATOM 1435 CG LEU A 98 19.956 2.321 -21.971 1.00 0.00 C ATOM 1436 CD1 LEU A 98 20.538 3.705 -21.641 1.00 0.00 C ATOM 1437 CD2 LEU A 98 19.980 1.402 -20.737 1.00 0.00 C ATOM 0 H LEU A 98 19.303 1.408 -24.752 1.00 0.00 H new ATOM 0 HA LEU A 98 18.234 0.322 -22.412 1.00 0.00 H new ATOM 0 HB2 LEU A 98 18.533 3.197 -23.337 1.00 0.00 H new ATOM 0 HB3 LEU A 98 17.857 2.783 -21.775 1.00 0.00 H new ATOM 0 HG LEU A 98 20.588 1.867 -22.734 1.00 0.00 H new ATOM 0 HD11 LEU A 98 21.541 3.589 -21.231 1.00 0.00 H new ATOM 0 HD12 LEU A 98 20.584 4.306 -22.549 1.00 0.00 H new ATOM 0 HD13 LEU A 98 19.902 4.202 -20.909 1.00 0.00 H new ATOM 0 HD21 LEU A 98 20.997 1.340 -20.349 1.00 0.00 H new ATOM 0 HD22 LEU A 98 19.323 1.808 -19.968 1.00 0.00 H new ATOM 0 HD23 LEU A 98 19.638 0.406 -21.018 1.00 0.00 H new ATOM 1449 N SER A 99 16.134 1.749 -24.544 1.00 0.00 N ATOM 1450 CA SER A 99 14.723 1.923 -24.819 1.00 0.00 C ATOM 1451 C SER A 99 14.050 0.581 -24.763 1.00 0.00 C ATOM 1452 O SER A 99 12.954 0.447 -24.221 1.00 0.00 O ATOM 1453 CB SER A 99 14.447 2.532 -26.208 1.00 0.00 C ATOM 1454 OG SER A 99 14.957 3.858 -26.271 1.00 0.00 O ATOM 0 H SER A 99 16.759 2.030 -25.300 1.00 0.00 H new ATOM 0 HA SER A 99 14.336 2.612 -24.068 1.00 0.00 H new ATOM 0 HB2 SER A 99 14.910 1.919 -26.981 1.00 0.00 H new ATOM 0 HB3 SER A 99 13.375 2.537 -26.405 1.00 0.00 H new ATOM 0 HG SER A 99 15.936 3.834 -26.234 1.00 0.00 H new ATOM 1460 N GLN A 100 14.704 -0.451 -25.332 1.00 0.00 N ATOM 1461 CA GLN A 100 14.138 -1.778 -25.324 1.00 0.00 C ATOM 1462 C GLN A 100 14.157 -2.311 -23.914 1.00 0.00 C ATOM 1463 O GLN A 100 13.210 -2.964 -23.476 1.00 0.00 O ATOM 1464 CB GLN A 100 14.913 -2.766 -26.219 1.00 0.00 C ATOM 1465 CG GLN A 100 14.747 -2.459 -27.713 1.00 0.00 C ATOM 1466 CD GLN A 100 15.701 -3.344 -28.506 1.00 0.00 C ATOM 1467 OE1 GLN A 100 16.767 -3.718 -28.028 1.00 0.00 O ATOM 1468 NE2 GLN A 100 15.310 -3.690 -29.757 1.00 0.00 N ATOM 0 H GLN A 100 15.611 -0.375 -25.792 1.00 0.00 H new ATOM 0 HA GLN A 100 13.124 -1.695 -25.714 1.00 0.00 H new ATOM 0 HB2 GLN A 100 15.971 -2.733 -25.960 1.00 0.00 H new ATOM 0 HB3 GLN A 100 14.568 -3.780 -26.019 1.00 0.00 H new ATOM 0 HG2 GLN A 100 13.718 -2.641 -28.023 1.00 0.00 H new ATOM 0 HG3 GLN A 100 14.958 -1.407 -27.908 1.00 0.00 H new ATOM 0 HE21 GLN A 100 14.416 -3.360 -30.122 1.00 0.00 H new ATOM 0 HE22 GLN A 100 15.910 -4.280 -30.334 1.00 0.00 H new ATOM 1477 N ALA A 101 15.255 -2.037 -23.174 1.00 0.00 N ATOM 1478 CA ALA A 101 15.383 -2.521 -21.817 1.00 0.00 C ATOM 1479 C ALA A 101 14.309 -1.926 -20.949 1.00 0.00 C ATOM 1480 O ALA A 101 13.738 -2.612 -20.106 1.00 0.00 O ATOM 1481 CB ALA A 101 16.741 -2.165 -21.191 1.00 0.00 C ATOM 0 H ALA A 101 16.048 -1.488 -23.506 1.00 0.00 H new ATOM 0 HA ALA A 101 15.292 -3.606 -21.869 1.00 0.00 H new ATOM 0 HB1 ALA A 101 16.785 -2.551 -20.173 1.00 0.00 H new ATOM 0 HB2 ALA A 101 17.542 -2.609 -21.782 1.00 0.00 H new ATOM 0 HB3 ALA A 101 16.861 -1.082 -21.173 1.00 0.00 H new ATOM 1487 N LEU A 102 14.021 -0.623 -21.127 1.00 0.00 N ATOM 1488 CA LEU A 102 13.015 0.029 -20.316 1.00 0.00 C ATOM 1489 C LEU A 102 11.668 -0.574 -20.590 1.00 0.00 C ATOM 1490 O LEU A 102 10.900 -0.817 -19.664 1.00 0.00 O ATOM 1491 CB LEU A 102 12.913 1.544 -20.580 1.00 0.00 C ATOM 1492 CG LEU A 102 14.111 2.337 -20.028 1.00 0.00 C ATOM 1493 CD1 LEU A 102 14.127 3.775 -20.573 1.00 0.00 C ATOM 1494 CD2 LEU A 102 14.114 2.337 -18.491 1.00 0.00 C ATOM 0 H LEU A 102 14.471 -0.022 -21.818 1.00 0.00 H new ATOM 0 HA LEU A 102 13.319 -0.119 -19.280 1.00 0.00 H new ATOM 0 HB2 LEU A 102 12.836 1.715 -21.654 1.00 0.00 H new ATOM 0 HB3 LEU A 102 11.996 1.924 -20.130 1.00 0.00 H new ATOM 0 HG LEU A 102 15.019 1.839 -20.368 1.00 0.00 H new ATOM 0 HD11 LEU A 102 14.985 4.309 -20.165 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.198 3.751 -21.660 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.209 4.285 -20.281 1.00 0.00 H new ATOM 0 HD21 LEU A 102 14.971 2.904 -18.129 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.195 2.795 -18.125 1.00 0.00 H new ATOM 0 HD23 LEU A 102 14.178 1.311 -18.127 1.00 0.00 H new ATOM 1506 N LYS A 103 11.352 -0.845 -21.873 1.00 0.00 N ATOM 1507 CA LYS A 103 10.066 -1.396 -22.214 1.00 0.00 C ATOM 1508 C LYS A 103 9.900 -2.744 -21.567 1.00 0.00 C ATOM 1509 O LYS A 103 8.871 -3.029 -20.956 1.00 0.00 O ATOM 1510 CB LYS A 103 9.912 -1.561 -23.732 1.00 0.00 C ATOM 1511 CG LYS A 103 8.553 -2.115 -24.147 1.00 0.00 C ATOM 1512 CD LYS A 103 8.443 -2.229 -25.663 1.00 0.00 C ATOM 1513 CE LYS A 103 7.095 -2.788 -26.120 1.00 0.00 C ATOM 1514 NZ LYS A 103 7.045 -2.866 -27.596 1.00 0.00 N ATOM 0 H LYS A 103 11.974 -0.687 -22.666 1.00 0.00 H new ATOM 0 HA LYS A 103 9.305 -0.703 -21.855 1.00 0.00 H new ATOM 0 HB2 LYS A 103 10.064 -0.594 -24.212 1.00 0.00 H new ATOM 0 HB3 LYS A 103 10.694 -2.226 -24.099 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.403 -3.095 -23.694 1.00 0.00 H new ATOM 0 HG3 LYS A 103 7.762 -1.466 -23.770 1.00 0.00 H new ATOM 0 HD2 LYS A 103 8.593 -1.245 -26.108 1.00 0.00 H new ATOM 0 HD3 LYS A 103 9.242 -2.872 -26.033 1.00 0.00 H new ATOM 0 HE2 LYS A 103 6.940 -3.778 -25.691 1.00 0.00 H new ATOM 0 HE3 LYS A 103 6.288 -2.153 -25.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 6.124 -3.247 -27.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 7.172 -1.915 -27.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 7.804 -3.490 -27.937 1.00 0.00 H new ATOM 1528 N GLN A 104 10.929 -3.606 -21.682 1.00 0.00 N ATOM 1529 CA GLN A 104 10.862 -4.925 -21.124 1.00 0.00 C ATOM 1530 C GLN A 104 10.833 -4.848 -19.620 1.00 0.00 C ATOM 1531 O GLN A 104 10.101 -5.592 -18.965 1.00 0.00 O ATOM 1532 CB GLN A 104 12.074 -5.775 -21.539 1.00 0.00 C ATOM 1533 CG GLN A 104 11.948 -7.221 -21.074 1.00 0.00 C ATOM 1534 CD GLN A 104 13.148 -8.011 -21.580 1.00 0.00 C ATOM 1535 OE1 GLN A 104 14.016 -7.481 -22.268 1.00 0.00 O ATOM 1536 NE2 GLN A 104 13.204 -9.320 -21.231 1.00 0.00 N ATOM 0 H GLN A 104 11.804 -3.391 -22.159 1.00 0.00 H new ATOM 0 HA GLN A 104 9.952 -5.391 -21.502 1.00 0.00 H new ATOM 0 HB2 GLN A 104 12.178 -5.752 -22.624 1.00 0.00 H new ATOM 0 HB3 GLN A 104 12.982 -5.339 -21.122 1.00 0.00 H new ATOM 0 HG2 GLN A 104 11.901 -7.264 -19.986 1.00 0.00 H new ATOM 0 HG3 GLN A 104 11.023 -7.658 -21.451 1.00 0.00 H new ATOM 0 HE21 GLN A 104 12.465 -9.727 -20.658 1.00 0.00 H new ATOM 0 HE22 GLN A 104 13.985 -9.898 -21.541 1.00 0.00 H new ATOM 1545 N CYS A 105 11.642 -3.943 -19.036 1.00 0.00 N ATOM 1546 CA CYS A 105 11.716 -3.829 -17.595 1.00 0.00 C ATOM 1547 C CYS A 105 10.394 -3.365 -17.042 1.00 0.00 C ATOM 1548 O CYS A 105 9.888 -3.950 -16.092 1.00 0.00 O ATOM 1549 CB CYS A 105 12.805 -2.846 -17.114 1.00 0.00 C ATOM 1550 SG CYS A 105 13.002 -2.897 -15.305 1.00 0.00 S ATOM 0 H CYS A 105 12.241 -3.294 -19.546 1.00 0.00 H new ATOM 0 HA CYS A 105 11.973 -4.824 -17.231 1.00 0.00 H new ATOM 0 HB2 CYS A 105 13.754 -3.091 -17.591 1.00 0.00 H new ATOM 0 HB3 CYS A 105 12.545 -1.834 -17.424 1.00 0.00 H new ATOM 1555 N PHE A 106 9.794 -2.301 -17.630 1.00 0.00 N ATOM 1556 CA PHE A 106 8.536 -1.789 -17.119 1.00 0.00 C ATOM 1557 C PHE A 106 7.457 -2.820 -17.311 1.00 0.00 C ATOM 1558 O PHE A 106 6.588 -2.982 -16.456 1.00 0.00 O ATOM 1559 CB PHE A 106 8.075 -0.483 -17.802 1.00 0.00 C ATOM 1560 CG PHE A 106 8.762 0.739 -17.280 1.00 0.00 C ATOM 1561 CD1 PHE A 106 9.592 1.482 -18.093 1.00 0.00 C ATOM 1562 CD2 PHE A 106 8.578 1.139 -15.973 1.00 0.00 C ATOM 1563 CE1 PHE A 106 10.225 2.602 -17.608 1.00 0.00 C ATOM 1564 CE2 PHE A 106 9.212 2.260 -15.489 1.00 0.00 C ATOM 1565 CZ PHE A 106 10.035 2.990 -16.306 1.00 0.00 C ATOM 0 H PHE A 106 10.164 -1.803 -18.439 1.00 0.00 H new ATOM 0 HA PHE A 106 8.706 -1.569 -16.065 1.00 0.00 H new ATOM 0 HB2 PHE A 106 8.254 -0.561 -18.874 1.00 0.00 H new ATOM 0 HB3 PHE A 106 6.999 -0.371 -17.666 1.00 0.00 H new ATOM 0 HD1 PHE A 106 9.746 1.182 -19.119 1.00 0.00 H new ATOM 0 HD2 PHE A 106 7.931 0.568 -15.324 1.00 0.00 H new ATOM 0 HE1 PHE A 106 10.873 3.177 -18.253 1.00 0.00 H new ATOM 0 HE2 PHE A 106 9.061 2.565 -14.464 1.00 0.00 H new ATOM 0 HZ PHE A 106 10.533 3.869 -15.925 1.00 0.00 H new ATOM 1575 N ARG A 107 7.489 -3.545 -18.444 1.00 0.00 N ATOM 1576 CA ARG A 107 6.486 -4.548 -18.715 1.00 0.00 C ATOM 1577 C ARG A 107 6.555 -5.632 -17.667 1.00 0.00 C ATOM 1578 O ARG A 107 5.529 -6.149 -17.230 1.00 0.00 O ATOM 1579 CB ARG A 107 6.661 -5.206 -20.099 1.00 0.00 C ATOM 1580 CG ARG A 107 5.556 -6.214 -20.430 1.00 0.00 C ATOM 1581 CD ARG A 107 5.713 -6.812 -21.831 1.00 0.00 C ATOM 1582 NE ARG A 107 4.606 -7.789 -22.052 1.00 0.00 N ATOM 1583 CZ ARG A 107 4.510 -8.467 -23.234 1.00 0.00 C ATOM 1584 NH1 ARG A 107 5.427 -8.253 -24.222 1.00 0.00 N ATOM 1585 NH2 ARG A 107 3.495 -9.359 -23.426 1.00 0.00 N ATOM 0 H ARG A 107 8.198 -3.444 -19.170 1.00 0.00 H new ATOM 0 HA ARG A 107 5.522 -4.040 -18.698 1.00 0.00 H new ATOM 0 HB2 ARG A 107 6.677 -4.430 -20.864 1.00 0.00 H new ATOM 0 HB3 ARG A 107 7.627 -5.710 -20.135 1.00 0.00 H new ATOM 0 HG2 ARG A 107 5.567 -7.016 -19.692 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.586 -5.724 -20.354 1.00 0.00 H new ATOM 0 HD2 ARG A 107 5.681 -6.026 -22.585 1.00 0.00 H new ATOM 0 HD3 ARG A 107 6.680 -7.306 -21.926 1.00 0.00 H new ATOM 0 HE ARG A 107 3.918 -7.951 -21.317 1.00 0.00 H new ATOM 0 HH11 ARG A 107 6.185 -7.586 -24.078 1.00 0.00 H new ATOM 0 HH12 ARG A 107 5.354 -8.760 -25.104 1.00 0.00 H new ATOM 0 HH21 ARG A 107 2.810 -9.518 -22.688 1.00 0.00 H new ATOM 0 HH22 ARG A 107 3.422 -9.866 -24.308 1.00 0.00 H new ATOM 1599 N SER A 108 7.779 -6.001 -17.233 1.00 0.00 N ATOM 1600 CA SER A 108 7.925 -7.076 -16.272 1.00 0.00 C ATOM 1601 C SER A 108 7.847 -6.560 -14.855 1.00 0.00 C ATOM 1602 O SER A 108 7.938 -7.355 -13.920 1.00 0.00 O ATOM 1603 CB SER A 108 9.271 -7.812 -16.413 1.00 0.00 C ATOM 1604 OG SER A 108 9.379 -8.397 -17.705 1.00 0.00 O ATOM 0 H SER A 108 8.654 -5.571 -17.534 1.00 0.00 H new ATOM 0 HA SER A 108 7.106 -7.764 -16.481 1.00 0.00 H new ATOM 0 HB2 SER A 108 10.093 -7.115 -16.252 1.00 0.00 H new ATOM 0 HB3 SER A 108 9.353 -8.584 -15.648 1.00 0.00 H new ATOM 0 HG SER A 108 9.612 -7.705 -18.359 1.00 0.00 H new ATOM 1610 N THR A 109 7.681 -5.232 -14.634 1.00 0.00 N ATOM 1611 CA THR A 109 7.625 -4.737 -13.273 1.00 0.00 C ATOM 1612 C THR A 109 6.307 -4.057 -13.043 1.00 0.00 C ATOM 1613 O THR A 109 5.466 -4.554 -12.294 1.00 0.00 O ATOM 1614 CB THR A 109 8.721 -3.756 -12.942 1.00 0.00 C ATOM 1615 OG1 THR A 109 8.883 -2.804 -13.985 1.00 0.00 O ATOM 1616 CG2 THR A 109 10.031 -4.530 -12.733 1.00 0.00 C ATOM 0 H THR A 109 7.589 -4.524 -15.362 1.00 0.00 H new ATOM 0 HA THR A 109 7.753 -5.606 -12.627 1.00 0.00 H new ATOM 0 HB THR A 109 8.454 -3.217 -12.033 1.00 0.00 H new ATOM 0 HG1 THR A 109 9.233 -3.251 -14.784 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.832 -3.831 -12.493 1.00 0.00 H new ATOM 0 HG22 THR A 109 9.909 -5.238 -11.913 1.00 0.00 H new ATOM 0 HG23 THR A 109 10.283 -5.071 -13.645 1.00 0.00 H new ATOM 1624 N MET A 110 6.111 -2.883 -13.670 1.00 0.00 N ATOM 1625 CA MET A 110 4.887 -2.137 -13.496 1.00 0.00 C ATOM 1626 C MET A 110 3.764 -2.886 -14.157 1.00 0.00 C ATOM 1627 O MET A 110 2.615 -2.814 -13.721 1.00 0.00 O ATOM 1628 CB MET A 110 4.958 -0.722 -14.109 1.00 0.00 C ATOM 1629 CG MET A 110 3.796 0.176 -13.673 1.00 0.00 C ATOM 1630 SD MET A 110 3.822 0.555 -11.895 1.00 0.00 S ATOM 1631 CE MET A 110 2.137 1.230 -11.857 1.00 0.00 C ATOM 0 H MET A 110 6.789 -2.447 -14.294 1.00 0.00 H new ATOM 0 HA MET A 110 4.723 -2.027 -12.424 1.00 0.00 H new ATOM 0 HB2 MET A 110 5.900 -0.254 -13.822 1.00 0.00 H new ATOM 0 HB3 MET A 110 4.960 -0.802 -15.196 1.00 0.00 H new ATOM 0 HG2 MET A 110 3.831 1.107 -14.238 1.00 0.00 H new ATOM 0 HG3 MET A 110 2.854 -0.312 -13.921 1.00 0.00 H new ATOM 0 HE1 MET A 110 1.895 1.548 -10.843 1.00 0.00 H new ATOM 0 HE2 MET A 110 2.072 2.085 -12.530 1.00 0.00 H new ATOM 0 HE3 MET A 110 1.431 0.463 -12.175 1.00 0.00 H new ATOM 1641 N GLY A 111 4.075 -3.629 -15.241 1.00 0.00 N ATOM 1642 CA GLY A 111 3.052 -4.382 -15.926 1.00 0.00 C ATOM 1643 C GLY A 111 2.448 -3.511 -16.985 1.00 0.00 C ATOM 1644 O GLY A 111 1.448 -3.875 -17.598 1.00 0.00 O ATOM 0 H GLY A 111 5.011 -3.711 -15.639 1.00 0.00 H new ATOM 0 HA2 GLY A 111 3.478 -5.280 -16.372 1.00 0.00 H new ATOM 0 HA3 GLY A 111 2.286 -4.708 -15.222 1.00 0.00 H new ATOM 1648 N THR A 112 3.049 -2.326 -17.226 1.00 0.00 N ATOM 1649 CA THR A 112 2.533 -1.434 -18.223 1.00 0.00 C ATOM 1650 C THR A 112 3.666 -1.088 -19.144 1.00 0.00 C ATOM 1651 O THR A 112 4.836 -1.203 -18.786 1.00 0.00 O ATOM 1652 CB THR A 112 1.981 -0.156 -17.646 1.00 0.00 C ATOM 1653 OG1 THR A 112 2.989 0.554 -16.933 1.00 0.00 O ATOM 1654 CG2 THR A 112 0.814 -0.497 -16.704 1.00 0.00 C ATOM 0 H THR A 112 3.880 -1.990 -16.738 1.00 0.00 H new ATOM 0 HA THR A 112 1.711 -1.936 -18.733 1.00 0.00 H new ATOM 0 HB THR A 112 1.630 0.480 -18.459 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.611 1.381 -16.568 1.00 0.00 H new ATOM 0 HG21 THR A 112 0.407 0.422 -16.281 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.035 -1.015 -17.263 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.172 -1.140 -15.899 1.00 0.00 H new ATOM 1662 N VAL A 113 3.320 -0.650 -20.372 1.00 0.00 N ATOM 1663 CA VAL A 113 4.317 -0.289 -21.345 1.00 0.00 C ATOM 1664 C VAL A 113 4.192 1.186 -21.591 1.00 0.00 C ATOM 1665 O VAL A 113 4.520 1.678 -22.669 1.00 0.00 O ATOM 1666 CB VAL A 113 4.151 -1.013 -22.656 1.00 0.00 C ATOM 1667 CG1 VAL A 113 4.676 -2.449 -22.479 1.00 0.00 C ATOM 1668 CG2 VAL A 113 2.666 -0.976 -23.064 1.00 0.00 C ATOM 0 H VAL A 113 2.357 -0.545 -20.692 1.00 0.00 H new ATOM 0 HA VAL A 113 5.294 -0.566 -20.950 1.00 0.00 H new ATOM 0 HB VAL A 113 4.720 -0.538 -23.455 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.566 -2.995 -23.416 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.729 -2.419 -22.197 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.105 -2.951 -21.698 1.00 0.00 H new ATOM 0 HG21 VAL A 113 2.536 -1.498 -24.012 1.00 0.00 H new ATOM 0 HG22 VAL A 113 2.065 -1.464 -22.296 1.00 0.00 H new ATOM 0 HG23 VAL A 113 2.344 0.060 -23.173 1.00 0.00 H new ATOM 1678 N ASN A 114 3.695 1.933 -20.574 1.00 0.00 N ATOM 1679 CA ASN A 114 3.522 3.360 -20.716 1.00 0.00 C ATOM 1680 C ASN A 114 4.878 3.964 -20.981 1.00 0.00 C ATOM 1681 O ASN A 114 5.813 3.811 -20.195 1.00 0.00 O ATOM 1682 CB ASN A 114 2.929 4.012 -19.447 1.00 0.00 C ATOM 1683 CG ASN A 114 2.500 5.456 -19.676 1.00 0.00 C ATOM 1684 OD1 ASN A 114 2.700 6.014 -20.751 1.00 0.00 O ATOM 1685 ND2 ASN A 114 1.897 6.085 -18.637 1.00 0.00 N ATOM 0 H ASN A 114 3.417 1.557 -19.667 1.00 0.00 H new ATOM 0 HA ASN A 114 2.824 3.542 -21.533 1.00 0.00 H new ATOM 0 HB2 ASN A 114 2.070 3.431 -19.112 1.00 0.00 H new ATOM 0 HB3 ASN A 114 3.668 3.979 -18.647 1.00 0.00 H new ATOM 0 HD21 ASN A 114 1.593 7.054 -18.734 1.00 0.00 H new ATOM 0 HD22 ASN A 114 1.747 5.589 -17.758 1.00 0.00 H new ATOM 1692 N ARG A 115 4.990 4.697 -22.111 1.00 0.00 N ATOM 1693 CA ARG A 115 6.245 5.301 -22.486 1.00 0.00 C ATOM 1694 C ARG A 115 6.332 6.679 -21.893 1.00 0.00 C ATOM 1695 O ARG A 115 7.276 7.412 -22.165 1.00 0.00 O ATOM 1696 CB ARG A 115 6.415 5.424 -24.016 1.00 0.00 C ATOM 1697 CG ARG A 115 5.420 6.399 -24.655 1.00 0.00 C ATOM 1698 CD ARG A 115 5.501 6.395 -26.185 1.00 0.00 C ATOM 1699 NE ARG A 115 4.491 7.360 -26.718 1.00 0.00 N ATOM 1700 CZ ARG A 115 4.780 8.695 -26.814 1.00 0.00 C ATOM 1701 NH1 ARG A 115 5.996 9.168 -26.410 1.00 0.00 N ATOM 1702 NH2 ARG A 115 3.848 9.556 -27.310 1.00 0.00 N ATOM 0 H ARG A 115 4.223 4.872 -22.760 1.00 0.00 H new ATOM 0 HA ARG A 115 7.034 4.651 -22.108 1.00 0.00 H new ATOM 0 HB2 ARG A 115 7.430 5.753 -24.237 1.00 0.00 H new ATOM 0 HB3 ARG A 115 6.293 4.440 -24.469 1.00 0.00 H new ATOM 0 HG2 ARG A 115 4.408 6.136 -24.347 1.00 0.00 H new ATOM 0 HG3 ARG A 115 5.614 7.406 -24.286 1.00 0.00 H new ATOM 0 HD2 ARG A 115 6.502 6.676 -26.512 1.00 0.00 H new ATOM 0 HD3 ARG A 115 5.309 5.394 -26.572 1.00 0.00 H new ATOM 0 HE ARG A 115 3.576 7.020 -27.014 1.00 0.00 H new ATOM 0 HH11 ARG A 115 6.694 8.526 -26.035 1.00 0.00 H new ATOM 0 HH12 ARG A 115 6.206 10.163 -26.484 1.00 0.00 H new ATOM 0 HH21 ARG A 115 2.938 9.206 -27.609 1.00 0.00 H new ATOM 0 HH22 ARG A 115 4.060 10.551 -27.383 1.00 0.00 H new ATOM 1716 N GLN A 116 5.336 7.077 -21.072 1.00 0.00 N ATOM 1717 CA GLN A 116 5.359 8.391 -20.469 1.00 0.00 C ATOM 1718 C GLN A 116 6.557 8.499 -19.558 1.00 0.00 C ATOM 1719 O GLN A 116 7.247 9.519 -19.547 1.00 0.00 O ATOM 1720 CB GLN A 116 4.099 8.685 -19.634 1.00 0.00 C ATOM 1721 CG GLN A 116 4.075 10.113 -19.066 1.00 0.00 C ATOM 1722 CD GLN A 116 2.767 10.311 -18.311 1.00 0.00 C ATOM 1723 OE1 GLN A 116 1.895 9.447 -18.313 1.00 0.00 O ATOM 1724 NE2 GLN A 116 2.627 11.479 -17.639 1.00 0.00 N ATOM 0 H GLN A 116 4.528 6.506 -20.826 1.00 0.00 H new ATOM 0 HA GLN A 116 5.404 9.113 -21.284 1.00 0.00 H new ATOM 0 HB2 GLN A 116 3.215 8.531 -20.253 1.00 0.00 H new ATOM 0 HB3 GLN A 116 4.040 7.972 -18.812 1.00 0.00 H new ATOM 0 HG2 GLN A 116 4.924 10.270 -18.401 1.00 0.00 H new ATOM 0 HG3 GLN A 116 4.162 10.842 -19.871 1.00 0.00 H new ATOM 0 HE21 GLN A 116 3.374 12.173 -17.661 1.00 0.00 H new ATOM 0 HE22 GLN A 116 1.774 11.664 -17.111 1.00 0.00 H new ATOM 1733 N PHE A 117 6.840 7.433 -18.776 1.00 0.00 N ATOM 1734 CA PHE A 117 7.957 7.467 -17.856 1.00 0.00 C ATOM 1735 C PHE A 117 9.224 7.435 -18.658 1.00 0.00 C ATOM 1736 O PHE A 117 10.177 8.153 -18.369 1.00 0.00 O ATOM 1737 CB PHE A 117 8.007 6.246 -16.920 1.00 0.00 C ATOM 1738 CG PHE A 117 6.742 6.007 -16.172 1.00 0.00 C ATOM 1739 CD1 PHE A 117 5.873 5.036 -16.606 1.00 0.00 C ATOM 1740 CD2 PHE A 117 6.429 6.740 -15.048 1.00 0.00 C ATOM 1741 CE1 PHE A 117 4.701 4.795 -15.929 1.00 0.00 C ATOM 1742 CE2 PHE A 117 5.255 6.501 -14.371 1.00 0.00 C ATOM 1743 CZ PHE A 117 4.392 5.529 -14.812 1.00 0.00 C ATOM 0 H PHE A 117 6.310 6.561 -18.775 1.00 0.00 H new ATOM 0 HA PHE A 117 7.844 8.367 -17.252 1.00 0.00 H new ATOM 0 HB2 PHE A 117 8.243 5.359 -17.508 1.00 0.00 H new ATOM 0 HB3 PHE A 117 8.820 6.381 -16.206 1.00 0.00 H new ATOM 0 HD1 PHE A 117 6.112 4.457 -17.486 1.00 0.00 H new ATOM 0 HD2 PHE A 117 7.107 7.504 -14.697 1.00 0.00 H new ATOM 0 HE1 PHE A 117 4.024 4.028 -16.276 1.00 0.00 H new ATOM 0 HE2 PHE A 117 5.012 7.079 -13.492 1.00 0.00 H new ATOM 0 HZ PHE A 117 3.471 5.342 -14.280 1.00 0.00 H new ATOM 1753 N ILE A 118 9.239 6.589 -19.705 1.00 0.00 N ATOM 1754 CA ILE A 118 10.412 6.434 -20.539 1.00 0.00 C ATOM 1755 C ILE A 118 10.743 7.755 -21.184 1.00 0.00 C ATOM 1756 O ILE A 118 11.899 8.174 -21.207 1.00 0.00 O ATOM 1757 CB ILE A 118 10.193 5.419 -21.634 1.00 0.00 C ATOM 1758 CG1 ILE A 118 10.020 4.016 -21.027 1.00 0.00 C ATOM 1759 CG2 ILE A 118 11.393 5.475 -22.605 1.00 0.00 C ATOM 1760 CD1 ILE A 118 9.522 2.985 -22.043 1.00 0.00 C ATOM 0 H ILE A 118 8.446 6.010 -19.981 1.00 0.00 H new ATOM 0 HA ILE A 118 11.226 6.090 -19.900 1.00 0.00 H new ATOM 0 HB ILE A 118 9.282 5.648 -22.187 1.00 0.00 H new ATOM 0 HG12 ILE A 118 10.973 3.683 -20.617 1.00 0.00 H new ATOM 0 HG13 ILE A 118 9.316 4.069 -20.196 1.00 0.00 H new ATOM 0 HG21 ILE A 118 11.250 4.746 -23.403 1.00 0.00 H new ATOM 0 HG22 ILE A 118 11.467 6.474 -23.035 1.00 0.00 H new ATOM 0 HG23 ILE A 118 12.310 5.244 -22.063 1.00 0.00 H new ATOM 0 HD11 ILE A 118 9.419 2.015 -21.557 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.554 3.299 -22.435 1.00 0.00 H new ATOM 0 HD13 ILE A 118 10.237 2.906 -22.862 1.00 0.00 H new ATOM 1772 N THR A 119 9.717 8.442 -21.719 1.00 0.00 N ATOM 1773 CA THR A 119 9.924 9.709 -22.391 1.00 0.00 C ATOM 1774 C THR A 119 10.457 10.724 -21.416 1.00 0.00 C ATOM 1775 O THR A 119 11.394 11.454 -21.731 1.00 0.00 O ATOM 1776 CB THR A 119 8.656 10.268 -22.984 1.00 0.00 C ATOM 1777 OG1 THR A 119 8.125 9.360 -23.943 1.00 0.00 O ATOM 1778 CG2 THR A 119 8.963 11.617 -23.659 1.00 0.00 C ATOM 0 H THR A 119 8.746 8.131 -21.692 1.00 0.00 H new ATOM 0 HA THR A 119 10.632 9.517 -23.198 1.00 0.00 H new ATOM 0 HB THR A 119 7.921 10.414 -22.193 1.00 0.00 H new ATOM 0 HG1 THR A 119 7.750 8.580 -23.483 1.00 0.00 H new ATOM 0 HG21 THR A 119 8.048 12.025 -24.089 1.00 0.00 H new ATOM 0 HG22 THR A 119 9.357 12.313 -22.919 1.00 0.00 H new ATOM 0 HG23 THR A 119 9.701 11.470 -24.448 1.00 0.00 H new ATOM 1786 N GLU A 120 9.868 10.801 -20.202 1.00 0.00 N ATOM 1787 CA GLU A 120 10.311 11.782 -19.232 1.00 0.00 C ATOM 1788 C GLU A 120 11.733 11.493 -18.822 1.00 0.00 C ATOM 1789 O GLU A 120 12.544 12.408 -18.701 1.00 0.00 O ATOM 1790 CB GLU A 120 9.443 11.800 -17.958 1.00 0.00 C ATOM 1791 CG GLU A 120 8.039 12.373 -18.214 1.00 0.00 C ATOM 1792 CD GLU A 120 7.193 12.210 -16.956 1.00 0.00 C ATOM 1793 OE1 GLU A 120 7.651 11.509 -16.013 1.00 0.00 O ATOM 1794 OE2 GLU A 120 6.069 12.780 -16.926 1.00 0.00 O ATOM 0 H GLU A 120 9.103 10.203 -19.891 1.00 0.00 H new ATOM 0 HA GLU A 120 10.227 12.754 -19.718 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.353 10.786 -17.568 1.00 0.00 H new ATOM 0 HB3 GLU A 120 9.940 12.393 -17.191 1.00 0.00 H new ATOM 0 HG2 GLU A 120 8.107 13.426 -18.487 1.00 0.00 H new ATOM 0 HG3 GLU A 120 7.570 11.857 -19.051 1.00 0.00 H new ATOM 1801 N ILE A 121 12.068 10.203 -18.595 1.00 0.00 N ATOM 1802 CA ILE A 121 13.410 9.851 -18.185 1.00 0.00 C ATOM 1803 C ILE A 121 14.372 10.190 -19.289 1.00 0.00 C ATOM 1804 O ILE A 121 15.425 10.775 -19.046 1.00 0.00 O ATOM 1805 CB ILE A 121 13.555 8.385 -17.853 1.00 0.00 C ATOM 1806 CG1 ILE A 121 12.758 8.052 -16.578 1.00 0.00 C ATOM 1807 CG2 ILE A 121 15.055 8.060 -17.692 1.00 0.00 C ATOM 1808 CD1 ILE A 121 12.642 6.547 -16.332 1.00 0.00 C ATOM 0 H ILE A 121 11.428 9.415 -18.691 1.00 0.00 H new ATOM 0 HA ILE A 121 13.627 10.420 -17.281 1.00 0.00 H new ATOM 0 HB ILE A 121 13.150 7.771 -18.657 1.00 0.00 H new ATOM 0 HG12 ILE A 121 13.240 8.520 -15.720 1.00 0.00 H new ATOM 0 HG13 ILE A 121 11.759 8.482 -16.656 1.00 0.00 H new ATOM 0 HG21 ILE A 121 15.175 7.004 -17.452 1.00 0.00 H new ATOM 0 HG22 ILE A 121 15.577 8.282 -18.623 1.00 0.00 H new ATOM 0 HG23 ILE A 121 15.474 8.665 -16.888 1.00 0.00 H new ATOM 0 HD11 ILE A 121 12.071 6.370 -15.421 1.00 0.00 H new ATOM 0 HD12 ILE A 121 12.134 6.079 -17.175 1.00 0.00 H new ATOM 0 HD13 ILE A 121 13.638 6.118 -16.225 1.00 0.00 H new ATOM 1820 N LYS A 122 14.023 9.828 -20.540 1.00 0.00 N ATOM 1821 CA LYS A 122 14.895 10.085 -21.665 1.00 0.00 C ATOM 1822 C LYS A 122 15.084 11.569 -21.836 1.00 0.00 C ATOM 1823 O LYS A 122 16.195 12.036 -22.087 1.00 0.00 O ATOM 1824 CB LYS A 122 14.341 9.516 -22.988 1.00 0.00 C ATOM 1825 CG LYS A 122 15.290 9.735 -24.173 1.00 0.00 C ATOM 1826 CD LYS A 122 14.843 8.981 -25.432 1.00 0.00 C ATOM 1827 CE LYS A 122 13.585 9.577 -26.072 1.00 0.00 C ATOM 1828 NZ LYS A 122 13.878 10.910 -26.642 1.00 0.00 N ATOM 0 H LYS A 122 13.148 9.362 -20.779 1.00 0.00 H new ATOM 0 HA LYS A 122 15.841 9.589 -21.447 1.00 0.00 H new ATOM 0 HB2 LYS A 122 14.155 8.448 -22.870 1.00 0.00 H new ATOM 0 HB3 LYS A 122 13.381 9.984 -23.206 1.00 0.00 H new ATOM 0 HG2 LYS A 122 15.350 10.801 -24.394 1.00 0.00 H new ATOM 0 HG3 LYS A 122 16.293 9.410 -23.896 1.00 0.00 H new ATOM 0 HD2 LYS A 122 15.654 8.989 -26.161 1.00 0.00 H new ATOM 0 HD3 LYS A 122 14.655 7.938 -25.177 1.00 0.00 H new ATOM 0 HE2 LYS A 122 13.218 8.913 -26.854 1.00 0.00 H new ATOM 0 HE3 LYS A 122 12.794 9.659 -25.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 13.101 11.198 -27.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 13.976 11.603 -25.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 14.764 10.868 -27.185 1.00 0.00 H new ATOM 1842 N HIS A 123 13.988 12.345 -21.720 1.00 0.00 N ATOM 1843 CA HIS A 123 14.066 13.781 -21.893 1.00 0.00 C ATOM 1844 C HIS A 123 14.972 14.378 -20.849 1.00 0.00 C ATOM 1845 O HIS A 123 15.856 15.170 -21.170 1.00 0.00 O ATOM 1846 CB HIS A 123 12.690 14.471 -21.782 1.00 0.00 C ATOM 1847 CG HIS A 123 12.738 15.959 -21.996 1.00 0.00 C ATOM 1848 ND1 HIS A 123 12.888 16.814 -20.912 1.00 0.00 N ATOM 1849 CD2 HIS A 123 12.654 16.672 -23.154 1.00 0.00 C ATOM 1850 CE1 HIS A 123 12.892 18.024 -21.441 1.00 0.00 C ATOM 1851 NE2 HIS A 123 12.752 17.995 -22.789 1.00 0.00 N ATOM 0 H HIS A 123 13.055 11.992 -21.509 1.00 0.00 H new ATOM 0 HA HIS A 123 14.456 13.949 -22.897 1.00 0.00 H new ATOM 0 HB2 HIS A 123 12.013 14.030 -22.513 1.00 0.00 H new ATOM 0 HB3 HIS A 123 12.271 14.268 -20.796 1.00 0.00 H new ATOM 0 HD2 HIS A 123 12.535 16.279 -24.153 1.00 0.00 H new ATOM 0 HE1 HIS A 123 12.995 18.932 -20.866 1.00 0.00 H new ATOM 0 HE2 HIS A 123 12.725 18.801 -23.414 1.00 0.00 H new ATOM 1859 N LEU A 124 14.773 14.010 -19.561 1.00 0.00 N ATOM 1860 CA LEU A 124 15.587 14.568 -18.501 1.00 0.00 C ATOM 1861 C LEU A 124 17.014 14.127 -18.669 1.00 0.00 C ATOM 1862 O LEU A 124 17.940 14.913 -18.487 1.00 0.00 O ATOM 1863 CB LEU A 124 15.121 14.136 -17.096 1.00 0.00 C ATOM 1864 CG LEU A 124 13.778 14.770 -16.691 1.00 0.00 C ATOM 1865 CD1 LEU A 124 13.223 14.127 -15.410 1.00 0.00 C ATOM 1866 CD2 LEU A 124 13.903 16.296 -16.536 1.00 0.00 C ATOM 0 H LEU A 124 14.066 13.342 -19.254 1.00 0.00 H new ATOM 0 HA LEU A 124 15.491 15.651 -18.577 1.00 0.00 H new ATOM 0 HB2 LEU A 124 15.028 13.050 -17.067 1.00 0.00 H new ATOM 0 HB3 LEU A 124 15.882 14.411 -16.366 1.00 0.00 H new ATOM 0 HG LEU A 124 13.068 14.577 -17.495 1.00 0.00 H new ATOM 0 HD11 LEU A 124 12.274 14.596 -15.149 1.00 0.00 H new ATOM 0 HD12 LEU A 124 13.068 13.061 -15.576 1.00 0.00 H new ATOM 0 HD13 LEU A 124 13.933 14.268 -14.595 1.00 0.00 H new ATOM 0 HD21 LEU A 124 12.937 16.713 -16.250 1.00 0.00 H new ATOM 0 HD22 LEU A 124 14.640 16.524 -15.766 1.00 0.00 H new ATOM 0 HD23 LEU A 124 14.220 16.733 -17.483 1.00 0.00 H new ATOM 1878 N MET A 125 17.217 12.850 -19.035 1.00 0.00 N ATOM 1879 CA MET A 125 18.552 12.320 -19.203 1.00 0.00 C ATOM 1880 C MET A 125 19.259 13.068 -20.302 1.00 0.00 C ATOM 1881 O MET A 125 20.406 13.483 -20.140 1.00 0.00 O ATOM 1882 CB MET A 125 18.537 10.816 -19.553 1.00 0.00 C ATOM 1883 CG MET A 125 19.932 10.232 -19.804 1.00 0.00 C ATOM 1884 SD MET A 125 20.442 10.334 -21.548 1.00 0.00 S ATOM 1885 CE MET A 125 19.330 9.021 -22.128 1.00 0.00 C ATOM 0 H MET A 125 16.469 12.181 -19.216 1.00 0.00 H new ATOM 0 HA MET A 125 19.075 12.445 -18.255 1.00 0.00 H new ATOM 0 HB2 MET A 125 18.063 10.267 -18.740 1.00 0.00 H new ATOM 0 HB3 MET A 125 17.923 10.664 -20.441 1.00 0.00 H new ATOM 0 HG2 MET A 125 20.658 10.762 -19.187 1.00 0.00 H new ATOM 0 HG3 MET A 125 19.946 9.189 -19.488 1.00 0.00 H new ATOM 0 HE1 MET A 125 19.881 8.335 -22.770 1.00 0.00 H new ATOM 0 HE2 MET A 125 18.932 8.476 -21.272 1.00 0.00 H new ATOM 0 HE3 MET A 125 18.508 9.463 -22.691 1.00 0.00 H new ATOM 1895 N THR A 126 18.578 13.263 -21.448 1.00 0.00 N ATOM 1896 CA THR A 126 19.188 13.946 -22.569 1.00 0.00 C ATOM 1897 C THR A 126 19.464 15.376 -22.191 1.00 0.00 C ATOM 1898 O THR A 126 20.523 15.914 -22.501 1.00 0.00 O ATOM 1899 CB THR A 126 18.310 13.955 -23.796 1.00 0.00 C ATOM 1900 OG1 THR A 126 18.031 12.621 -24.202 1.00 0.00 O ATOM 1901 CG2 THR A 126 19.033 14.702 -24.931 1.00 0.00 C ATOM 0 H THR A 126 17.618 12.956 -21.606 1.00 0.00 H new ATOM 0 HA THR A 126 20.104 13.405 -22.806 1.00 0.00 H new ATOM 0 HB THR A 126 17.371 14.458 -23.566 1.00 0.00 H new ATOM 0 HG1 THR A 126 17.404 12.211 -23.570 1.00 0.00 H new ATOM 0 HG21 THR A 126 18.402 14.711 -25.820 1.00 0.00 H new ATOM 0 HG22 THR A 126 19.237 15.727 -24.620 1.00 0.00 H new ATOM 0 HG23 THR A 126 19.972 14.198 -25.158 1.00 0.00 H new ATOM 1909 N MET A 127 18.502 16.026 -21.507 1.00 0.00 N ATOM 1910 CA MET A 127 18.656 17.413 -21.129 1.00 0.00 C ATOM 1911 C MET A 127 19.827 17.590 -20.198 1.00 0.00 C ATOM 1912 O MET A 127 20.630 18.506 -20.375 1.00 0.00 O ATOM 1913 CB MET A 127 17.403 17.974 -20.427 1.00 0.00 C ATOM 1914 CG MET A 127 17.535 19.456 -20.053 1.00 0.00 C ATOM 1915 SD MET A 127 16.030 20.127 -19.282 1.00 0.00 S ATOM 1916 CE MET A 127 16.246 19.248 -17.708 1.00 0.00 C ATOM 0 H MET A 127 17.622 15.602 -21.214 1.00 0.00 H new ATOM 0 HA MET A 127 18.818 17.960 -22.058 1.00 0.00 H new ATOM 0 HB2 MET A 127 16.540 17.846 -21.080 1.00 0.00 H new ATOM 0 HB3 MET A 127 17.209 17.394 -19.525 1.00 0.00 H new ATOM 0 HG2 MET A 127 18.374 19.580 -19.368 1.00 0.00 H new ATOM 0 HG3 MET A 127 17.767 20.033 -20.949 1.00 0.00 H new ATOM 0 HE1 MET A 127 15.621 19.710 -16.944 1.00 0.00 H new ATOM 0 HE2 MET A 127 15.956 18.204 -17.831 1.00 0.00 H new ATOM 0 HE3 MET A 127 17.291 19.301 -17.402 1.00 0.00 H new ATOM 1926 N PHE A 128 19.964 16.712 -19.183 1.00 0.00 N ATOM 1927 CA PHE A 128 21.036 16.871 -18.226 1.00 0.00 C ATOM 1928 C PHE A 128 22.345 16.547 -18.884 1.00 0.00 C ATOM 1929 O PHE A 128 23.346 17.223 -18.653 1.00 0.00 O ATOM 1930 CB PHE A 128 20.892 15.969 -16.982 1.00 0.00 C ATOM 1931 CG PHE A 128 19.894 16.472 -15.987 1.00 0.00 C ATOM 1932 CD1 PHE A 128 18.772 15.732 -15.679 1.00 0.00 C ATOM 1933 CD2 PHE A 128 20.084 17.687 -15.364 1.00 0.00 C ATOM 1934 CE1 PHE A 128 17.857 16.199 -14.767 1.00 0.00 C ATOM 1935 CE2 PHE A 128 19.166 18.153 -14.450 1.00 0.00 C ATOM 1936 CZ PHE A 128 18.054 17.409 -14.152 1.00 0.00 C ATOM 0 H PHE A 128 19.354 15.911 -19.021 1.00 0.00 H new ATOM 0 HA PHE A 128 20.993 17.907 -17.891 1.00 0.00 H new ATOM 0 HB2 PHE A 128 20.601 14.968 -17.301 1.00 0.00 H new ATOM 0 HB3 PHE A 128 21.863 15.878 -16.495 1.00 0.00 H new ATOM 0 HD1 PHE A 128 18.611 14.778 -16.159 1.00 0.00 H new ATOM 0 HD2 PHE A 128 20.959 18.277 -15.594 1.00 0.00 H new ATOM 0 HE1 PHE A 128 16.981 15.612 -14.534 1.00 0.00 H new ATOM 0 HE2 PHE A 128 19.322 19.106 -13.967 1.00 0.00 H new ATOM 0 HZ PHE A 128 17.334 17.775 -13.434 1.00 0.00 H new ATOM 1946 N ALA A 129 22.367 15.493 -19.721 1.00 0.00 N ATOM 1947 CA ALA A 129 23.590 15.106 -20.373 1.00 0.00 C ATOM 1948 C ALA A 129 24.028 16.184 -21.326 1.00 0.00 C ATOM 1949 O ALA A 129 25.216 16.470 -21.439 1.00 0.00 O ATOM 1950 CB ALA A 129 23.468 13.786 -21.148 1.00 0.00 C ATOM 0 H ALA A 129 21.557 14.916 -19.946 1.00 0.00 H new ATOM 0 HA ALA A 129 24.326 14.961 -19.582 1.00 0.00 H new ATOM 0 HB1 ALA A 129 24.423 13.550 -21.617 1.00 0.00 H new ATOM 0 HB2 ALA A 129 23.192 12.985 -20.462 1.00 0.00 H new ATOM 0 HB3 ALA A 129 22.701 13.885 -21.917 1.00 0.00 H new ATOM 1956 N ALA A 130 23.070 16.804 -22.045 1.00 0.00 N ATOM 1957 CA ALA A 130 23.413 17.840 -22.994 1.00 0.00 C ATOM 1958 C ALA A 130 24.028 19.007 -22.269 1.00 0.00 C ATOM 1959 O ALA A 130 25.010 19.586 -22.730 1.00 0.00 O ATOM 1960 CB ALA A 130 22.195 18.358 -23.778 1.00 0.00 C ATOM 0 H ALA A 130 22.073 16.598 -21.977 1.00 0.00 H new ATOM 0 HA ALA A 130 24.112 17.394 -23.702 1.00 0.00 H new ATOM 0 HB1 ALA A 130 22.514 19.133 -24.475 1.00 0.00 H new ATOM 0 HB2 ALA A 130 21.743 17.536 -24.332 1.00 0.00 H new ATOM 0 HB3 ALA A 130 21.464 18.772 -23.083 1.00 0.00 H new ATOM 1966 N GLU A 131 23.456 19.380 -21.106 1.00 0.00 N ATOM 1967 CA GLU A 131 23.977 20.502 -20.354 1.00 0.00 C ATOM 1968 C GLU A 131 25.345 20.160 -19.831 1.00 0.00 C ATOM 1969 O GLU A 131 26.252 20.993 -19.844 1.00 0.00 O ATOM 1970 CB GLU A 131 23.090 20.888 -19.155 1.00 0.00 C ATOM 1971 CG GLU A 131 21.761 21.528 -19.590 1.00 0.00 C ATOM 1972 CD GLU A 131 20.867 21.708 -18.368 1.00 0.00 C ATOM 1973 OE1 GLU A 131 21.173 21.102 -17.306 1.00 0.00 O ATOM 1974 OE2 GLU A 131 19.862 22.458 -18.481 1.00 0.00 O ATOM 0 H GLU A 131 22.648 18.920 -20.686 1.00 0.00 H new ATOM 0 HA GLU A 131 24.006 21.350 -21.038 1.00 0.00 H new ATOM 0 HB2 GLU A 131 22.884 19.999 -18.558 1.00 0.00 H new ATOM 0 HB3 GLU A 131 23.632 21.583 -18.514 1.00 0.00 H new ATOM 0 HG2 GLU A 131 21.946 22.491 -20.065 1.00 0.00 H new ATOM 0 HG3 GLU A 131 21.265 20.898 -20.329 1.00 0.00 H new ATOM 1981 N ALA A 132 25.522 18.914 -19.347 1.00 0.00 N ATOM 1982 CA ALA A 132 26.797 18.499 -18.812 1.00 0.00 C ATOM 1983 C ALA A 132 27.826 18.499 -19.912 1.00 0.00 C ATOM 1984 O ALA A 132 28.964 18.907 -19.705 1.00 0.00 O ATOM 1985 CB ALA A 132 26.757 17.090 -18.199 1.00 0.00 C ATOM 0 H ALA A 132 24.796 18.198 -19.323 1.00 0.00 H new ATOM 0 HA ALA A 132 27.051 19.206 -18.023 1.00 0.00 H new ATOM 0 HB1 ALA A 132 27.744 16.833 -17.813 1.00 0.00 H new ATOM 0 HB2 ALA A 132 26.032 17.068 -17.385 1.00 0.00 H new ATOM 0 HB3 ALA A 132 26.467 16.369 -18.963 1.00 0.00 H new ATOM 1991 N ALA A 133 27.442 18.018 -21.114 1.00 0.00 N ATOM 1992 CA ALA A 133 28.363 17.969 -22.226 1.00 0.00 C ATOM 1993 C ALA A 133 28.750 19.367 -22.615 1.00 0.00 C ATOM 1994 O ALA A 133 29.902 19.623 -22.956 1.00 0.00 O ATOM 1995 CB ALA A 133 27.780 17.267 -23.464 1.00 0.00 C ATOM 0 H ALA A 133 26.507 17.666 -21.319 1.00 0.00 H new ATOM 0 HA ALA A 133 29.225 17.392 -21.892 1.00 0.00 H new ATOM 0 HB1 ALA A 133 28.521 17.264 -24.263 1.00 0.00 H new ATOM 0 HB2 ALA A 133 27.516 16.240 -23.210 1.00 0.00 H new ATOM 0 HB3 ALA A 133 26.889 17.799 -23.798 1.00 0.00 H new ATOM 2001 N GLN A 134 27.782 20.309 -22.591 1.00 0.00 N ATOM 2002 CA GLN A 134 28.080 21.675 -22.952 1.00 0.00 C ATOM 2003 C GLN A 134 29.078 22.218 -21.965 1.00 0.00 C ATOM 2004 O GLN A 134 30.014 22.927 -22.337 1.00 0.00 O ATOM 2005 CB GLN A 134 26.834 22.586 -22.930 1.00 0.00 C ATOM 2006 CG GLN A 134 27.130 24.011 -23.423 1.00 0.00 C ATOM 2007 CD GLN A 134 25.828 24.803 -23.432 1.00 0.00 C ATOM 2008 OE1 GLN A 134 24.762 24.279 -23.125 1.00 0.00 O ATOM 2009 NE2 GLN A 134 25.915 26.107 -23.793 1.00 0.00 N ATOM 0 H GLN A 134 26.812 20.135 -22.328 1.00 0.00 H new ATOM 0 HA GLN A 134 28.468 21.670 -23.971 1.00 0.00 H new ATOM 0 HB2 GLN A 134 26.056 22.145 -23.553 1.00 0.00 H new ATOM 0 HB3 GLN A 134 26.441 22.632 -21.914 1.00 0.00 H new ATOM 0 HG2 GLN A 134 27.861 24.492 -22.773 1.00 0.00 H new ATOM 0 HG3 GLN A 134 27.563 23.983 -24.423 1.00 0.00 H new ATOM 0 HE21 GLN A 134 26.819 26.508 -24.042 1.00 0.00 H new ATOM 0 HE22 GLN A 134 25.076 26.687 -23.816 1.00 0.00 H new ATOM 2018 N GLU A 135 28.889 21.895 -20.666 1.00 0.00 N ATOM 2019 CA GLU A 135 29.794 22.365 -19.646 1.00 0.00 C ATOM 2020 C GLU A 135 31.150 21.740 -19.861 1.00 0.00 C ATOM 2021 O GLU A 135 32.171 22.414 -19.749 1.00 0.00 O ATOM 2022 CB GLU A 135 29.323 22.013 -18.220 1.00 0.00 C ATOM 2023 CG GLU A 135 30.254 22.568 -17.129 1.00 0.00 C ATOM 2024 CD GLU A 135 29.682 22.216 -15.760 1.00 0.00 C ATOM 2025 OE1 GLU A 135 28.610 21.556 -15.710 1.00 0.00 O ATOM 2026 OE2 GLU A 135 30.316 22.605 -14.741 1.00 0.00 O ATOM 0 H GLU A 135 28.122 21.317 -20.323 1.00 0.00 H new ATOM 0 HA GLU A 135 29.832 23.451 -19.730 1.00 0.00 H new ATOM 0 HB2 GLU A 135 28.318 22.406 -18.067 1.00 0.00 H new ATOM 0 HB3 GLU A 135 29.260 20.929 -18.120 1.00 0.00 H new ATOM 0 HG2 GLU A 135 31.254 22.148 -17.238 1.00 0.00 H new ATOM 0 HG3 GLU A 135 30.350 23.649 -17.230 1.00 0.00 H new ATOM 2033 N ALA A 136 31.187 20.423 -20.184 1.00 0.00 N ATOM 2034 CA ALA A 136 32.448 19.741 -20.388 1.00 0.00 C ATOM 2035 C ALA A 136 33.159 20.348 -21.569 1.00 0.00 C ATOM 2036 O ALA A 136 34.377 20.511 -21.554 1.00 0.00 O ATOM 2037 CB ALA A 136 32.278 18.235 -20.658 1.00 0.00 C ATOM 0 H ALA A 136 30.361 19.837 -20.303 1.00 0.00 H new ATOM 0 HA ALA A 136 33.020 19.858 -19.468 1.00 0.00 H new ATOM 0 HB1 ALA A 136 33.257 17.779 -20.803 1.00 0.00 H new ATOM 0 HB2 ALA A 136 31.781 17.767 -19.808 1.00 0.00 H new ATOM 0 HB3 ALA A 136 31.675 18.092 -21.555 1.00 0.00 H new ATOM 2043 N ALA A 137 32.399 20.677 -22.633 1.00 0.00 N ATOM 2044 CA ALA A 137 32.980 21.259 -23.820 1.00 0.00 C ATOM 2045 C ALA A 137 33.585 22.595 -23.473 1.00 0.00 C ATOM 2046 O ALA A 137 34.642 22.955 -23.989 1.00 0.00 O ATOM 2047 CB ALA A 137 31.951 21.475 -24.943 1.00 0.00 C ATOM 0 H ALA A 137 31.389 20.543 -22.677 1.00 0.00 H new ATOM 0 HA ALA A 137 33.732 20.558 -24.182 1.00 0.00 H new ATOM 0 HB1 ALA A 137 32.445 21.915 -25.809 1.00 0.00 H new ATOM 0 HB2 ALA A 137 31.512 20.518 -25.223 1.00 0.00 H new ATOM 0 HB3 ALA A 137 31.166 22.146 -24.593 1.00 0.00 H new