USER MOD reduce.3.24.130724 H: found=0, std=0, add=944, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 945 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 114 ASN : amide:sc= 0.358 K(o=0.4,f=-5.7!) USER MOD Set 1.2: A 116 GLN : amide:sc= 0.0413 K(o=0.4,f=-5.8!) USER MOD Set 2.1: A 87 ASN : amide:sc= -0.122 K(o=-0.12,f=-4.7!) USER MOD Set 2.2: A 90 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 66 GLN : amide:sc= -0.921 K(o=-1.4,f=-3.6!) USER MOD Set 3.2: A 70 MET CE :methyl 142:sc= -0.523 (180deg=-0.826) USER MOD Set 4.1: A 27 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 40 MET CE :methyl 145:sc= -1.54 (180deg=-4.07!) USER MOD Set 5.1: A 16 ASN : amide:sc= -0.0682 K(o=-1.5,f=-5.1!) USER MOD Set 5.2: A 19 MET CE :methyl 177:sc= -1.15 (180deg=-0.787) USER MOD Set 5.3: A 48 MET CE :methyl 167:sc= -0.28 (180deg=0) USER MOD Single : A 7 SER OG : rot 24:sc= 0.0183 USER MOD Single : A 11 ASN : amide:sc= -0.064 K(o=-0.064,f=-7.4!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0874) 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=-1.4!) USER MOD Single : A 25 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0215) USER MOD Single : A 29 SER OG : rot -155:sc= 0.018 USER MOD Single : A 34 GLN : amide:sc= 0.581 K(o=0.58,f=-6!) USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot 72:sc= 0.0119 USER MOD Single : A 46 THR OG1 : rot 71:sc= 0.779 USER MOD Single : A 47 MET CE :methyl 178:sc= -1.17 (180deg=-1.22) USER MOD Single : A 49 SER OG : rot -37:sc= 1.14 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 68 MET CE :methyl -173:sc= -0.032 (180deg=-0.0567) USER MOD Single : A 69 ASN : amide:sc= 0.013 K(o=0.013,f=-1.2!) USER MOD Single : A 74 SER OG : rot 108:sc= 0.045 USER MOD Single : A 75 SER OG : rot 81:sc= 0.819 USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN :FLIP amide:sc= -0.453 F(o=-2.3,f=-0.45) USER MOD Single : A 94 LYS NZ :NH3+ 178:sc= 0.899 (180deg=0.897) USER MOD Single : A 95 THR OG1 : rot 81:sc= 1.24 USER MOD Single : A 99 SER OG : rot 70:sc= 1.18 USER MOD Single : A 100 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN : amide:sc= -0.0384 K(o=-0.038,f=-1.6!) USER MOD Single : A 108 SER OG : rot 78:sc= 0.27 USER MOD Single : A 109 THR OG1 : rot -68:sc= 1.39 USER MOD Single : A 110 MET CE :methyl 147:sc= -0.101 (180deg=-1.13) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 70:sc= 0.917 USER MOD Single : A 122 LYS NZ :NH3+ 167:sc=-0.00565 (180deg=-0.156) USER MOD Single : A 123 HIS : no HD1:sc= -0.199 X(o=-0.2,f=-0.0038) USER MOD Single : A 125 MET CE :methyl -157:sc= -0.105 (180deg=-0.985) USER MOD Single : A 126 THR OG1 : rot 67:sc= 0.298 USER MOD Single : A 127 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 134 GLN : amide:sc= -0.16 X(o=-0.16,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 82 N SER A 7 2.817 2.286 -7.773 1.00 0.00 N ATOM 83 CA SER A 7 3.937 2.391 -6.866 1.00 0.00 C ATOM 84 C SER A 7 5.162 1.903 -7.584 1.00 0.00 C ATOM 85 O SER A 7 5.630 0.793 -7.343 1.00 0.00 O ATOM 86 CB SER A 7 3.775 1.524 -5.601 1.00 0.00 C ATOM 87 OG SER A 7 2.624 1.928 -4.869 1.00 0.00 O ATOM 0 HA SER A 7 4.007 3.434 -6.556 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.687 0.474 -5.880 1.00 0.00 H new ATOM 0 HB3 SER A 7 4.663 1.613 -4.975 1.00 0.00 H new ATOM 0 HG SER A 7 1.994 2.376 -5.471 1.00 0.00 H new ATOM 93 N PRO A 8 5.702 2.722 -8.464 1.00 0.00 N ATOM 94 CA PRO A 8 6.891 2.346 -9.213 1.00 0.00 C ATOM 95 C PRO A 8 8.122 2.288 -8.354 1.00 0.00 C ATOM 96 O PRO A 8 8.619 1.208 -8.050 1.00 0.00 O ATOM 97 CB PRO A 8 7.024 3.421 -10.298 1.00 0.00 C ATOM 98 CG PRO A 8 6.261 4.629 -9.756 1.00 0.00 C ATOM 99 CD PRO A 8 5.209 4.063 -8.799 1.00 0.00 C ATOM 0 HA PRO A 8 6.794 1.342 -9.626 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.070 3.666 -10.484 1.00 0.00 H new ATOM 0 HB3 PRO A 8 6.603 3.081 -11.244 1.00 0.00 H new ATOM 0 HG2 PRO A 8 6.932 5.315 -9.238 1.00 0.00 H new ATOM 0 HG3 PRO A 8 5.793 5.190 -10.564 1.00 0.00 H new ATOM 0 HD2 PRO A 8 5.108 4.683 -7.908 1.00 0.00 H new ATOM 0 HD3 PRO A 8 4.227 4.019 -9.270 1.00 0.00 H new ATOM 107 N TRP A 9 8.644 3.464 -7.941 1.00 0.00 N ATOM 108 CA TRP A 9 9.817 3.486 -7.102 1.00 0.00 C ATOM 109 C TRP A 9 9.364 3.512 -5.665 1.00 0.00 C ATOM 110 O TRP A 9 10.166 3.346 -4.748 1.00 0.00 O ATOM 111 CB TRP A 9 10.688 4.732 -7.350 1.00 0.00 C ATOM 112 CG TRP A 9 11.270 4.768 -8.743 1.00 0.00 C ATOM 113 CD1 TRP A 9 10.725 5.304 -9.877 1.00 0.00 C ATOM 114 CD2 TRP A 9 12.547 4.225 -9.135 1.00 0.00 C ATOM 115 NE1 TRP A 9 11.565 5.123 -10.940 1.00 0.00 N ATOM 116 CE2 TRP A 9 12.690 4.467 -10.500 1.00 0.00 C ATOM 117 CE3 TRP A 9 13.532 3.580 -8.442 1.00 0.00 C ATOM 118 CZ2 TRP A 9 13.799 4.070 -11.179 1.00 0.00 C ATOM 119 CZ3 TRP A 9 14.659 3.179 -9.126 1.00 0.00 C ATOM 120 CH2 TRP A 9 14.792 3.420 -10.480 1.00 0.00 C ATOM 0 H TRP A 9 8.267 4.381 -8.179 1.00 0.00 H new ATOM 0 HA TRP A 9 10.414 2.603 -7.332 1.00 0.00 H new ATOM 0 HB2 TRP A 9 10.088 5.628 -7.188 1.00 0.00 H new ATOM 0 HB3 TRP A 9 11.498 4.755 -6.621 1.00 0.00 H new ATOM 0 HD1 TRP A 9 9.767 5.800 -9.926 1.00 0.00 H new ATOM 0 HE1 TRP A 9 11.387 5.424 -11.898 1.00 0.00 H new ATOM 0 HE3 TRP A 9 13.430 3.389 -7.384 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 13.899 4.259 -12.238 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 15.450 2.669 -8.596 1.00 0.00 H new ATOM 0 HH2 TRP A 9 15.684 3.095 -10.996 1.00 0.00 H new ATOM 131 N ALA A 10 8.049 3.737 -5.448 1.00 0.00 N ATOM 132 CA ALA A 10 7.506 3.807 -4.110 1.00 0.00 C ATOM 133 C ALA A 10 7.616 2.466 -3.440 1.00 0.00 C ATOM 134 O ALA A 10 7.909 2.388 -2.251 1.00 0.00 O ATOM 135 CB ALA A 10 6.028 4.236 -4.085 1.00 0.00 C ATOM 0 H ALA A 10 7.362 3.870 -6.190 1.00 0.00 H new ATOM 0 HA ALA A 10 8.089 4.561 -3.582 1.00 0.00 H new ATOM 0 HB1 ALA A 10 5.677 4.270 -3.054 1.00 0.00 H new ATOM 0 HB2 ALA A 10 5.928 5.223 -4.536 1.00 0.00 H new ATOM 0 HB3 ALA A 10 5.431 3.518 -4.648 1.00 0.00 H new ATOM 141 N ASN A 11 7.364 1.378 -4.197 1.00 0.00 N ATOM 142 CA ASN A 11 7.425 0.054 -3.624 1.00 0.00 C ATOM 143 C ASN A 11 8.857 -0.413 -3.746 1.00 0.00 C ATOM 144 O ASN A 11 9.366 -0.597 -4.851 1.00 0.00 O ATOM 145 CB ASN A 11 6.513 -0.949 -4.373 1.00 0.00 C ATOM 146 CG ASN A 11 6.474 -2.330 -3.723 1.00 0.00 C ATOM 147 OD1 ASN A 11 7.345 -2.695 -2.940 1.00 0.00 O ATOM 148 ND2 ASN A 11 5.432 -3.127 -4.061 1.00 0.00 N ATOM 0 H ASN A 11 7.122 1.407 -5.187 1.00 0.00 H new ATOM 0 HA ASN A 11 7.084 0.097 -2.589 1.00 0.00 H new ATOM 0 HB2 ASN A 11 5.501 -0.547 -4.417 1.00 0.00 H new ATOM 0 HB3 ASN A 11 6.861 -1.048 -5.401 1.00 0.00 H new ATOM 0 HD21 ASN A 11 5.354 -4.062 -3.661 1.00 0.00 H new ATOM 0 HD22 ASN A 11 4.725 -2.792 -4.715 1.00 0.00 H new ATOM 155 N PRO A 12 9.522 -0.615 -2.620 1.00 0.00 N ATOM 156 CA PRO A 12 10.914 -1.061 -2.611 1.00 0.00 C ATOM 157 C PRO A 12 11.131 -2.377 -3.296 1.00 0.00 C ATOM 158 O PRO A 12 12.147 -2.582 -3.951 1.00 0.00 O ATOM 159 CB PRO A 12 11.272 -1.179 -1.122 1.00 0.00 C ATOM 160 CG PRO A 12 10.268 -0.269 -0.432 1.00 0.00 C ATOM 161 CD PRO A 12 8.998 -0.432 -1.258 1.00 0.00 C ATOM 0 HA PRO A 12 11.538 -0.356 -3.161 1.00 0.00 H new ATOM 0 HB2 PRO A 12 11.187 -2.207 -0.771 1.00 0.00 H new ATOM 0 HB3 PRO A 12 12.297 -0.861 -0.931 1.00 0.00 H new ATOM 0 HG2 PRO A 12 10.110 -0.562 0.606 1.00 0.00 H new ATOM 0 HG3 PRO A 12 10.608 0.767 -0.422 1.00 0.00 H new ATOM 0 HD2 PRO A 12 8.409 -1.289 -0.932 1.00 0.00 H new ATOM 0 HD3 PRO A 12 8.353 0.443 -1.186 1.00 0.00 H new ATOM 169 N LYS A 13 10.167 -3.308 -3.152 1.00 0.00 N ATOM 170 CA LYS A 13 10.305 -4.612 -3.759 1.00 0.00 C ATOM 171 C LYS A 13 10.281 -4.461 -5.252 1.00 0.00 C ATOM 172 O LYS A 13 11.060 -5.094 -5.965 1.00 0.00 O ATOM 173 CB LYS A 13 9.169 -5.574 -3.370 1.00 0.00 C ATOM 174 CG LYS A 13 9.234 -5.980 -1.900 1.00 0.00 C ATOM 175 CD LYS A 13 8.063 -6.873 -1.478 1.00 0.00 C ATOM 176 CE LYS A 13 8.125 -8.266 -2.110 1.00 0.00 C ATOM 177 NZ LYS A 13 7.020 -9.108 -1.604 1.00 0.00 N ATOM 0 H LYS A 13 9.304 -3.169 -2.626 1.00 0.00 H new ATOM 0 HA LYS A 13 11.246 -5.030 -3.402 1.00 0.00 H new ATOM 0 HB2 LYS A 13 8.209 -5.100 -3.572 1.00 0.00 H new ATOM 0 HB3 LYS A 13 9.221 -6.466 -3.994 1.00 0.00 H new ATOM 0 HG2 LYS A 13 10.171 -6.505 -1.714 1.00 0.00 H new ATOM 0 HG3 LYS A 13 9.243 -5.083 -1.280 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.059 -6.971 -0.392 1.00 0.00 H new ATOM 0 HD3 LYS A 13 7.126 -6.393 -1.758 1.00 0.00 H new ATOM 0 HE2 LYS A 13 8.061 -8.184 -3.195 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.082 -8.734 -1.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 7.074 -10.050 -2.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 7.099 -9.200 -0.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 6.109 -8.667 -1.844 1.00 0.00 H new ATOM 191 N LYS A 14 9.371 -3.604 -5.758 1.00 0.00 N ATOM 192 CA LYS A 14 9.265 -3.403 -7.183 1.00 0.00 C ATOM 193 C LYS A 14 10.482 -2.661 -7.656 1.00 0.00 C ATOM 194 O LYS A 14 11.040 -2.968 -8.708 1.00 0.00 O ATOM 195 CB LYS A 14 8.018 -2.594 -7.581 1.00 0.00 C ATOM 196 CG LYS A 14 7.790 -2.563 -9.094 1.00 0.00 C ATOM 197 CD LYS A 14 6.546 -1.762 -9.478 1.00 0.00 C ATOM 198 CE LYS A 14 5.254 -2.439 -9.020 1.00 0.00 C ATOM 199 NZ LYS A 14 4.076 -1.682 -9.497 1.00 0.00 N ATOM 0 H LYS A 14 8.718 -3.057 -5.197 1.00 0.00 H new ATOM 0 HA LYS A 14 9.183 -4.387 -7.645 1.00 0.00 H new ATOM 0 HB2 LYS A 14 7.142 -3.023 -7.095 1.00 0.00 H new ATOM 0 HB3 LYS A 14 8.120 -1.573 -7.212 1.00 0.00 H new ATOM 0 HG2 LYS A 14 8.663 -2.130 -9.582 1.00 0.00 H new ATOM 0 HG3 LYS A 14 7.691 -3.583 -9.465 1.00 0.00 H new ATOM 0 HD2 LYS A 14 6.608 -0.767 -9.038 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.521 -1.631 -10.560 1.00 0.00 H new ATOM 0 HE2 LYS A 14 5.216 -3.460 -9.401 1.00 0.00 H new ATOM 0 HE3 LYS A 14 5.236 -2.504 -7.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.214 -2.074 -9.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 4.173 -0.682 -9.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 4.011 -1.757 -10.532 1.00 0.00 H new ATOM 213 N ALA A 15 10.920 -1.654 -6.871 1.00 0.00 N ATOM 214 CA ALA A 15 12.072 -0.864 -7.239 1.00 0.00 C ATOM 215 C ALA A 15 13.288 -1.746 -7.313 1.00 0.00 C ATOM 216 O ALA A 15 14.102 -1.602 -8.221 1.00 0.00 O ATOM 217 CB ALA A 15 12.381 0.259 -6.231 1.00 0.00 C ATOM 0 H ALA A 15 10.485 -1.385 -5.989 1.00 0.00 H new ATOM 0 HA ALA A 15 11.835 -0.411 -8.202 1.00 0.00 H new ATOM 0 HB1 ALA A 15 13.257 0.816 -6.564 1.00 0.00 H new ATOM 0 HB2 ALA A 15 11.527 0.933 -6.164 1.00 0.00 H new ATOM 0 HB3 ALA A 15 12.578 -0.176 -5.251 1.00 0.00 H new ATOM 223 N ASN A 16 13.447 -2.679 -6.350 1.00 0.00 N ATOM 224 CA ASN A 16 14.607 -3.539 -6.351 1.00 0.00 C ATOM 225 C ASN A 16 14.605 -4.391 -7.591 1.00 0.00 C ATOM 226 O ASN A 16 15.630 -4.536 -8.244 1.00 0.00 O ATOM 227 CB ASN A 16 14.665 -4.481 -5.131 1.00 0.00 C ATOM 228 CG ASN A 16 14.992 -3.734 -3.844 1.00 0.00 C ATOM 229 OD1 ASN A 16 15.521 -2.629 -3.869 1.00 0.00 O ATOM 230 ND2 ASN A 16 14.678 -4.360 -2.682 1.00 0.00 N ATOM 0 H ASN A 16 12.791 -2.840 -5.585 1.00 0.00 H new ATOM 0 HA ASN A 16 15.475 -2.881 -6.314 1.00 0.00 H new ATOM 0 HB2 ASN A 16 13.707 -4.990 -5.021 1.00 0.00 H new ATOM 0 HB3 ASN A 16 15.417 -5.251 -5.304 1.00 0.00 H new ATOM 0 HD21 ASN A 16 14.882 -3.911 -1.789 1.00 0.00 H new ATOM 0 HD22 ASN A 16 14.238 -5.280 -2.701 1.00 0.00 H new ATOM 237 N ALA A 17 13.438 -4.960 -7.963 1.00 0.00 N ATOM 238 CA ALA A 17 13.378 -5.808 -9.136 1.00 0.00 C ATOM 239 C ALA A 17 13.687 -4.987 -10.360 1.00 0.00 C ATOM 240 O ALA A 17 14.401 -5.430 -11.259 1.00 0.00 O ATOM 241 CB ALA A 17 11.994 -6.453 -9.333 1.00 0.00 C ATOM 0 H ALA A 17 12.553 -4.842 -7.470 1.00 0.00 H new ATOM 0 HA ALA A 17 14.108 -6.604 -8.989 1.00 0.00 H new ATOM 0 HB1 ALA A 17 12.007 -7.077 -10.226 1.00 0.00 H new ATOM 0 HB2 ALA A 17 11.752 -7.066 -8.465 1.00 0.00 H new ATOM 0 HB3 ALA A 17 11.242 -5.672 -9.447 1.00 0.00 H new ATOM 247 N PHE A 18 13.138 -3.756 -10.408 1.00 0.00 N ATOM 248 CA PHE A 18 13.336 -2.877 -11.537 1.00 0.00 C ATOM 249 C PHE A 18 14.799 -2.539 -11.667 1.00 0.00 C ATOM 250 O PHE A 18 15.376 -2.608 -12.748 1.00 0.00 O ATOM 251 CB PHE A 18 12.539 -1.566 -11.370 1.00 0.00 C ATOM 252 CG PHE A 18 12.604 -0.640 -12.536 1.00 0.00 C ATOM 253 CD1 PHE A 18 12.052 -1.019 -13.730 1.00 0.00 C ATOM 254 CD2 PHE A 18 13.185 0.603 -12.427 1.00 0.00 C ATOM 255 CE1 PHE A 18 12.077 -0.173 -14.813 1.00 0.00 C ATOM 256 CE2 PHE A 18 13.216 1.452 -13.510 1.00 0.00 C ATOM 257 CZ PHE A 18 12.661 1.065 -14.701 1.00 0.00 C ATOM 0 H PHE A 18 12.556 -3.364 -9.668 1.00 0.00 H new ATOM 0 HA PHE A 18 12.984 -3.394 -12.430 1.00 0.00 H new ATOM 0 HB2 PHE A 18 11.495 -1.814 -11.179 1.00 0.00 H new ATOM 0 HB3 PHE A 18 12.908 -1.043 -10.488 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.592 -1.992 -13.822 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.618 0.913 -11.488 1.00 0.00 H new ATOM 0 HE1 PHE A 18 11.638 -0.481 -15.750 1.00 0.00 H new ATOM 0 HE2 PHE A 18 13.678 2.424 -13.421 1.00 0.00 H new ATOM 0 HZ PHE A 18 12.683 1.732 -15.550 1.00 0.00 H new ATOM 267 N MET A 19 15.424 -2.144 -10.552 1.00 0.00 N ATOM 268 CA MET A 19 16.823 -1.786 -10.575 1.00 0.00 C ATOM 269 C MET A 19 17.675 -2.983 -10.913 1.00 0.00 C ATOM 270 O MET A 19 18.611 -2.868 -11.692 1.00 0.00 O ATOM 271 CB MET A 19 17.317 -1.200 -9.238 1.00 0.00 C ATOM 272 CG MET A 19 16.767 0.207 -8.988 1.00 0.00 C ATOM 273 SD MET A 19 17.443 0.987 -7.491 1.00 0.00 S ATOM 274 CE MET A 19 16.329 0.129 -6.345 1.00 0.00 C ATOM 0 H MET A 19 14.978 -2.069 -9.638 1.00 0.00 H new ATOM 0 HA MET A 19 16.919 -1.017 -11.341 1.00 0.00 H new ATOM 0 HB2 MET A 19 17.016 -1.857 -8.422 1.00 0.00 H new ATOM 0 HB3 MET A 19 18.407 -1.168 -9.237 1.00 0.00 H new ATOM 0 HG2 MET A 19 16.991 0.836 -9.850 1.00 0.00 H new ATOM 0 HG3 MET A 19 15.681 0.156 -8.904 1.00 0.00 H new ATOM 0 HE1 MET A 19 16.580 0.402 -5.320 1.00 0.00 H new ATOM 0 HE2 MET A 19 15.299 0.417 -6.555 1.00 0.00 H new ATOM 0 HE3 MET A 19 16.437 -0.948 -6.470 1.00 0.00 H new ATOM 284 N LYS A 20 17.351 -4.176 -10.368 1.00 0.00 N ATOM 285 CA LYS A 20 18.168 -5.347 -10.625 1.00 0.00 C ATOM 286 C LYS A 20 18.179 -5.689 -12.089 1.00 0.00 C ATOM 287 O LYS A 20 19.229 -6.036 -12.632 1.00 0.00 O ATOM 288 CB LYS A 20 17.687 -6.601 -9.873 1.00 0.00 C ATOM 289 CG LYS A 20 17.938 -6.524 -8.370 1.00 0.00 C ATOM 290 CD LYS A 20 19.422 -6.643 -8.007 1.00 0.00 C ATOM 291 CE LYS A 20 19.652 -6.657 -6.494 1.00 0.00 C ATOM 292 NZ LYS A 20 21.096 -6.775 -6.196 1.00 0.00 N ATOM 0 H LYS A 20 16.546 -4.337 -9.763 1.00 0.00 H new ATOM 0 HA LYS A 20 19.163 -5.078 -10.272 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.621 -6.739 -10.052 1.00 0.00 H new ATOM 0 HB3 LYS A 20 18.194 -7.477 -10.277 1.00 0.00 H new ATOM 0 HG2 LYS A 20 17.551 -5.579 -7.990 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.382 -7.319 -7.873 1.00 0.00 H new ATOM 0 HD2 LYS A 20 19.828 -7.556 -8.442 1.00 0.00 H new ATOM 0 HD3 LYS A 20 19.969 -5.810 -8.447 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.256 -5.744 -6.050 1.00 0.00 H new ATOM 0 HE3 LYS A 20 19.112 -7.490 -6.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 21.238 -6.783 -5.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 21.463 -7.658 -6.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 21.603 -5.966 -6.609 1.00 0.00 H new ATOM 306 N CYS A 21 17.023 -5.606 -12.779 1.00 0.00 N ATOM 307 CA CYS A 21 17.019 -5.970 -14.184 1.00 0.00 C ATOM 308 C CYS A 21 17.767 -4.939 -14.987 1.00 0.00 C ATOM 309 O CYS A 21 18.483 -5.289 -15.918 1.00 0.00 O ATOM 310 CB CYS A 21 15.612 -6.155 -14.801 1.00 0.00 C ATOM 311 SG CYS A 21 14.597 -4.652 -14.698 1.00 0.00 S ATOM 0 H CYS A 21 16.127 -5.304 -12.397 1.00 0.00 H new ATOM 0 HA CYS A 21 17.508 -6.943 -14.227 1.00 0.00 H new ATOM 0 HB2 CYS A 21 15.714 -6.449 -15.846 1.00 0.00 H new ATOM 0 HB3 CYS A 21 15.100 -6.970 -14.289 1.00 0.00 H new ATOM 316 N LEU A 22 17.631 -3.637 -14.645 1.00 0.00 N ATOM 317 CA LEU A 22 18.324 -2.611 -15.400 1.00 0.00 C ATOM 318 C LEU A 22 19.805 -2.749 -15.189 1.00 0.00 C ATOM 319 O LEU A 22 20.586 -2.629 -16.127 1.00 0.00 O ATOM 320 CB LEU A 22 17.931 -1.180 -14.990 1.00 0.00 C ATOM 321 CG LEU A 22 16.498 -0.811 -15.400 1.00 0.00 C ATOM 322 CD1 LEU A 22 16.084 0.536 -14.789 1.00 0.00 C ATOM 323 CD2 LEU A 22 16.333 -0.802 -16.931 1.00 0.00 C ATOM 0 H LEU A 22 17.061 -3.295 -13.871 1.00 0.00 H new ATOM 0 HA LEU A 22 18.040 -2.757 -16.442 1.00 0.00 H new ATOM 0 HB2 LEU A 22 18.032 -1.077 -13.910 1.00 0.00 H new ATOM 0 HB3 LEU A 22 18.626 -0.474 -15.444 1.00 0.00 H new ATOM 0 HG LEU A 22 15.833 -1.579 -15.006 1.00 0.00 H new ATOM 0 HD11 LEU A 22 15.065 0.776 -15.094 1.00 0.00 H new ATOM 0 HD12 LEU A 22 16.132 0.473 -13.702 1.00 0.00 H new ATOM 0 HD13 LEU A 22 16.760 1.317 -15.137 1.00 0.00 H new ATOM 0 HD21 LEU A 22 15.307 -0.537 -17.185 1.00 0.00 H new ATOM 0 HD22 LEU A 22 17.015 -0.071 -17.366 1.00 0.00 H new ATOM 0 HD23 LEU A 22 16.561 -1.792 -17.327 1.00 0.00 H new ATOM 335 N ILE A 23 20.220 -3.023 -13.936 1.00 0.00 N ATOM 336 CA ILE A 23 21.622 -3.152 -13.616 1.00 0.00 C ATOM 337 C ILE A 23 22.217 -4.289 -14.398 1.00 0.00 C ATOM 338 O ILE A 23 23.286 -4.151 -14.997 1.00 0.00 O ATOM 339 CB ILE A 23 21.825 -3.414 -12.147 1.00 0.00 C ATOM 340 CG1 ILE A 23 21.473 -2.153 -11.347 1.00 0.00 C ATOM 341 CG2 ILE A 23 23.276 -3.867 -11.906 1.00 0.00 C ATOM 342 CD1 ILE A 23 21.301 -2.434 -9.858 1.00 0.00 C ATOM 0 H ILE A 23 19.592 -3.156 -13.143 1.00 0.00 H new ATOM 0 HA ILE A 23 22.113 -2.214 -13.876 1.00 0.00 H new ATOM 0 HB ILE A 23 21.166 -4.213 -11.808 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.257 -1.409 -11.485 1.00 0.00 H new ATOM 0 HG13 ILE A 23 20.552 -1.722 -11.741 1.00 0.00 H new ATOM 0 HG21 ILE A 23 23.426 -4.057 -10.843 1.00 0.00 H new ATOM 0 HG22 ILE A 23 23.471 -4.780 -12.469 1.00 0.00 H new ATOM 0 HG23 ILE A 23 23.961 -3.085 -12.235 1.00 0.00 H new ATOM 0 HD11 ILE A 23 21.053 -1.508 -9.339 1.00 0.00 H new ATOM 0 HD12 ILE A 23 20.498 -3.157 -9.715 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.229 -2.838 -9.454 1.00 0.00 H new ATOM 354 N GLN A 24 21.535 -5.444 -14.416 1.00 0.00 N ATOM 355 CA GLN A 24 22.056 -6.586 -15.124 1.00 0.00 C ATOM 356 C GLN A 24 22.068 -6.312 -16.605 1.00 0.00 C ATOM 357 O GLN A 24 23.005 -6.698 -17.289 1.00 0.00 O ATOM 358 CB GLN A 24 21.248 -7.875 -14.872 1.00 0.00 C ATOM 359 CG GLN A 24 21.890 -9.116 -15.510 1.00 0.00 C ATOM 360 CD GLN A 24 21.061 -10.340 -15.137 1.00 0.00 C ATOM 361 OE1 GLN A 24 20.070 -10.242 -14.419 1.00 0.00 O ATOM 362 NE2 GLN A 24 21.475 -11.528 -15.638 1.00 0.00 N ATOM 0 H GLN A 24 20.639 -5.595 -13.953 1.00 0.00 H new ATOM 0 HA GLN A 24 23.066 -6.745 -14.746 1.00 0.00 H new ATOM 0 HB2 GLN A 24 21.152 -8.033 -13.798 1.00 0.00 H new ATOM 0 HB3 GLN A 24 20.240 -7.749 -15.267 1.00 0.00 H new ATOM 0 HG2 GLN A 24 21.933 -9.005 -16.593 1.00 0.00 H new ATOM 0 HG3 GLN A 24 22.916 -9.233 -15.160 1.00 0.00 H new ATOM 0 HE21 GLN A 24 22.304 -11.570 -16.231 1.00 0.00 H new ATOM 0 HE22 GLN A 24 20.958 -12.380 -15.422 1.00 0.00 H new ATOM 371 N LYS A 25 21.022 -5.640 -17.141 1.00 0.00 N ATOM 372 CA LYS A 25 20.984 -5.354 -18.565 1.00 0.00 C ATOM 373 C LYS A 25 22.149 -4.484 -18.931 1.00 0.00 C ATOM 374 O LYS A 25 22.734 -4.633 -19.999 1.00 0.00 O ATOM 375 CB LYS A 25 19.693 -4.651 -19.025 1.00 0.00 C ATOM 376 CG LYS A 25 18.491 -5.596 -19.051 1.00 0.00 C ATOM 377 CD LYS A 25 18.563 -6.581 -20.222 1.00 0.00 C ATOM 378 CE LYS A 25 17.349 -7.511 -20.289 1.00 0.00 C ATOM 379 NZ LYS A 25 17.370 -8.470 -19.162 1.00 0.00 N ATOM 0 H LYS A 25 20.220 -5.300 -16.611 1.00 0.00 H new ATOM 0 HA LYS A 25 21.024 -6.320 -19.068 1.00 0.00 H new ATOM 0 HB2 LYS A 25 19.480 -3.816 -18.358 1.00 0.00 H new ATOM 0 HB3 LYS A 25 19.845 -4.234 -20.020 1.00 0.00 H new ATOM 0 HG2 LYS A 25 18.444 -6.150 -18.113 1.00 0.00 H new ATOM 0 HG3 LYS A 25 17.573 -5.013 -19.123 1.00 0.00 H new ATOM 0 HD2 LYS A 25 18.640 -6.024 -21.156 1.00 0.00 H new ATOM 0 HD3 LYS A 25 19.469 -7.180 -20.132 1.00 0.00 H new ATOM 0 HE2 LYS A 25 16.431 -6.924 -20.258 1.00 0.00 H new ATOM 0 HE3 LYS A 25 17.349 -8.052 -21.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 16.598 -9.158 -19.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 18.281 -8.971 -19.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 17.245 -7.956 -18.267 1.00 0.00 H new ATOM 393 N ILE A 26 22.504 -3.532 -18.057 1.00 0.00 N ATOM 394 CA ILE A 26 23.615 -2.662 -18.338 1.00 0.00 C ATOM 395 C ILE A 26 24.873 -3.484 -18.431 1.00 0.00 C ATOM 396 O ILE A 26 25.688 -3.276 -19.326 1.00 0.00 O ATOM 397 CB ILE A 26 23.795 -1.589 -17.293 1.00 0.00 C ATOM 398 CG1 ILE A 26 22.628 -0.594 -17.386 1.00 0.00 C ATOM 399 CG2 ILE A 26 25.157 -0.896 -17.502 1.00 0.00 C ATOM 400 CD1 ILE A 26 22.584 0.385 -16.216 1.00 0.00 C ATOM 0 H ILE A 26 22.036 -3.359 -17.167 1.00 0.00 H new ATOM 0 HA ILE A 26 23.406 -2.160 -19.283 1.00 0.00 H new ATOM 0 HB ILE A 26 23.790 -2.023 -16.293 1.00 0.00 H new ATOM 0 HG12 ILE A 26 22.708 -0.034 -18.318 1.00 0.00 H new ATOM 0 HG13 ILE A 26 21.689 -1.146 -17.426 1.00 0.00 H new ATOM 0 HG21 ILE A 26 25.290 -0.120 -16.748 1.00 0.00 H new ATOM 0 HG22 ILE A 26 25.957 -1.631 -17.411 1.00 0.00 H new ATOM 0 HG23 ILE A 26 25.188 -0.447 -18.495 1.00 0.00 H new ATOM 0 HD11 ILE A 26 21.738 1.061 -16.339 1.00 0.00 H new ATOM 0 HD12 ILE A 26 22.474 -0.168 -15.283 1.00 0.00 H new ATOM 0 HD13 ILE A 26 23.509 0.962 -16.189 1.00 0.00 H new ATOM 412 N SER A 27 25.055 -4.464 -17.528 1.00 0.00 N ATOM 413 CA SER A 27 26.271 -5.251 -17.564 1.00 0.00 C ATOM 414 C SER A 27 26.156 -6.354 -18.581 1.00 0.00 C ATOM 415 O SER A 27 27.140 -7.038 -18.855 1.00 0.00 O ATOM 416 CB SER A 27 26.615 -5.899 -16.210 1.00 0.00 C ATOM 417 OG SER A 27 26.885 -4.897 -15.241 1.00 0.00 O ATOM 0 H SER A 27 24.393 -4.714 -16.793 1.00 0.00 H new ATOM 0 HA SER A 27 27.065 -4.551 -17.826 1.00 0.00 H new ATOM 0 HB2 SER A 27 25.786 -6.524 -15.877 1.00 0.00 H new ATOM 0 HB3 SER A 27 27.481 -6.551 -16.320 1.00 0.00 H new ATOM 0 HG SER A 27 27.101 -5.320 -14.384 1.00 0.00 H new ATOM 423 N VAL A 28 24.962 -6.570 -19.168 1.00 0.00 N ATOM 424 CA VAL A 28 24.825 -7.628 -20.140 1.00 0.00 C ATOM 425 C VAL A 28 25.205 -7.095 -21.493 1.00 0.00 C ATOM 426 O VAL A 28 25.515 -7.868 -22.397 1.00 0.00 O ATOM 427 CB VAL A 28 23.429 -8.227 -20.204 1.00 0.00 C ATOM 428 CG1 VAL A 28 22.587 -7.529 -21.294 1.00 0.00 C ATOM 429 CG2 VAL A 28 23.570 -9.739 -20.455 1.00 0.00 C ATOM 0 H VAL A 28 24.114 -6.035 -18.982 1.00 0.00 H new ATOM 0 HA VAL A 28 25.488 -8.435 -19.827 1.00 0.00 H new ATOM 0 HB VAL A 28 22.901 -8.072 -19.263 1.00 0.00 H new ATOM 0 HG11 VAL A 28 21.591 -7.972 -21.324 1.00 0.00 H new ATOM 0 HG12 VAL A 28 22.505 -6.466 -21.065 1.00 0.00 H new ATOM 0 HG13 VAL A 28 23.070 -7.655 -22.263 1.00 0.00 H new ATOM 0 HG21 VAL A 28 22.580 -10.193 -20.505 1.00 0.00 H new ATOM 0 HG22 VAL A 28 24.093 -9.904 -21.397 1.00 0.00 H new ATOM 0 HG23 VAL A 28 24.136 -10.192 -19.641 1.00 0.00 H new ATOM 439 N SER A 29 25.202 -5.747 -21.675 1.00 0.00 N ATOM 440 CA SER A 29 25.544 -5.208 -22.967 1.00 0.00 C ATOM 441 C SER A 29 27.038 -4.999 -23.004 1.00 0.00 C ATOM 442 O SER A 29 27.591 -4.248 -22.201 1.00 0.00 O ATOM 443 CB SER A 29 24.872 -3.855 -23.250 1.00 0.00 C ATOM 444 OG SER A 29 25.197 -3.401 -24.560 1.00 0.00 O ATOM 0 H SER A 29 24.973 -5.058 -20.958 1.00 0.00 H new ATOM 0 HA SER A 29 25.198 -5.915 -23.721 1.00 0.00 H new ATOM 0 HB2 SER A 29 23.791 -3.951 -23.150 1.00 0.00 H new ATOM 0 HB3 SER A 29 25.196 -3.120 -22.513 1.00 0.00 H new ATOM 0 HG SER A 29 25.126 -2.424 -24.595 1.00 0.00 H new ATOM 450 N PRO A 30 27.705 -5.648 -23.941 1.00 0.00 N ATOM 451 CA PRO A 30 29.149 -5.522 -24.091 1.00 0.00 C ATOM 452 C PRO A 30 29.546 -4.230 -24.739 1.00 0.00 C ATOM 453 O PRO A 30 30.727 -3.899 -24.822 1.00 0.00 O ATOM 454 CB PRO A 30 29.535 -6.711 -24.967 1.00 0.00 C ATOM 455 CG PRO A 30 28.302 -6.935 -25.837 1.00 0.00 C ATOM 456 CD PRO A 30 27.117 -6.551 -24.945 1.00 0.00 C ATOM 0 HA PRO A 30 29.655 -5.518 -23.125 1.00 0.00 H new ATOM 0 HB2 PRO A 30 30.417 -6.494 -25.570 1.00 0.00 H new ATOM 0 HB3 PRO A 30 29.767 -7.591 -24.368 1.00 0.00 H new ATOM 0 HG2 PRO A 30 28.336 -6.320 -26.736 1.00 0.00 H new ATOM 0 HG3 PRO A 30 28.231 -7.973 -26.163 1.00 0.00 H new ATOM 0 HD2 PRO A 30 26.332 -6.056 -25.516 1.00 0.00 H new ATOM 0 HD3 PRO A 30 26.668 -7.428 -24.479 1.00 0.00 H new ATOM 464 N VAL A 31 28.539 -3.479 -25.236 1.00 0.00 N ATOM 465 CA VAL A 31 28.788 -2.213 -25.886 1.00 0.00 C ATOM 466 C VAL A 31 29.363 -1.266 -24.869 1.00 0.00 C ATOM 467 O VAL A 31 30.282 -0.500 -25.163 1.00 0.00 O ATOM 468 CB VAL A 31 27.527 -1.595 -26.448 1.00 0.00 C ATOM 469 CG1 VAL A 31 27.840 -0.172 -26.951 1.00 0.00 C ATOM 470 CG2 VAL A 31 26.991 -2.510 -27.563 1.00 0.00 C ATOM 0 H VAL A 31 27.555 -3.743 -25.190 1.00 0.00 H new ATOM 0 HA VAL A 31 29.473 -2.391 -26.715 1.00 0.00 H new ATOM 0 HB VAL A 31 26.754 -1.505 -25.685 1.00 0.00 H new ATOM 0 HG11 VAL A 31 26.934 0.278 -27.357 1.00 0.00 H new ATOM 0 HG12 VAL A 31 28.206 0.434 -26.123 1.00 0.00 H new ATOM 0 HG13 VAL A 31 28.601 -0.221 -27.729 1.00 0.00 H new ATOM 0 HG21 VAL A 31 26.081 -2.080 -27.981 1.00 0.00 H new ATOM 0 HG22 VAL A 31 27.741 -2.604 -28.348 1.00 0.00 H new ATOM 0 HG23 VAL A 31 26.771 -3.495 -27.151 1.00 0.00 H new ATOM 480 N PHE A 32 28.824 -1.304 -23.635 1.00 0.00 N ATOM 481 CA PHE A 32 29.285 -0.410 -22.603 1.00 0.00 C ATOM 482 C PHE A 32 30.454 -1.073 -21.919 1.00 0.00 C ATOM 483 O PHE A 32 30.531 -2.299 -21.825 1.00 0.00 O ATOM 484 CB PHE A 32 28.209 -0.114 -21.531 1.00 0.00 C ATOM 485 CG PHE A 32 26.796 -0.236 -22.011 1.00 0.00 C ATOM 486 CD1 PHE A 32 25.859 -0.841 -21.209 1.00 0.00 C ATOM 487 CD2 PHE A 32 26.407 0.232 -23.250 1.00 0.00 C ATOM 488 CE1 PHE A 32 24.562 -0.983 -21.631 1.00 0.00 C ATOM 489 CE2 PHE A 32 25.104 0.090 -23.671 1.00 0.00 C ATOM 490 CZ PHE A 32 24.185 -0.521 -22.858 1.00 0.00 C ATOM 0 H PHE A 32 28.080 -1.941 -23.350 1.00 0.00 H new ATOM 0 HA PHE A 32 29.547 0.538 -23.073 1.00 0.00 H new ATOM 0 HB2 PHE A 32 28.354 -0.796 -20.693 1.00 0.00 H new ATOM 0 HB3 PHE A 32 28.363 0.896 -21.151 1.00 0.00 H new ATOM 0 HD1 PHE A 32 26.147 -1.209 -20.235 1.00 0.00 H new ATOM 0 HD2 PHE A 32 27.129 0.713 -23.893 1.00 0.00 H new ATOM 0 HE1 PHE A 32 23.837 -1.462 -20.990 1.00 0.00 H new ATOM 0 HE2 PHE A 32 24.806 0.460 -24.641 1.00 0.00 H new ATOM 0 HZ PHE A 32 23.163 -0.637 -23.189 1.00 0.00 H new ATOM 500 N PRO A 33 31.373 -0.268 -21.428 1.00 0.00 N ATOM 501 CA PRO A 33 32.553 -0.772 -20.743 1.00 0.00 C ATOM 502 C PRO A 33 32.251 -1.315 -19.377 1.00 0.00 C ATOM 503 O PRO A 33 31.309 -0.881 -18.714 1.00 0.00 O ATOM 504 CB PRO A 33 33.478 0.444 -20.653 1.00 0.00 C ATOM 505 CG PRO A 33 32.518 1.628 -20.617 1.00 0.00 C ATOM 506 CD PRO A 33 31.340 1.200 -21.493 1.00 0.00 C ATOM 0 HA PRO A 33 32.993 -1.612 -21.280 1.00 0.00 H new ATOM 0 HB2 PRO A 33 34.102 0.407 -19.760 1.00 0.00 H new ATOM 0 HB3 PRO A 33 34.150 0.500 -21.509 1.00 0.00 H new ATOM 0 HG2 PRO A 33 32.196 1.846 -19.599 1.00 0.00 H new ATOM 0 HG3 PRO A 33 32.990 2.532 -21.002 1.00 0.00 H new ATOM 0 HD2 PRO A 33 30.397 1.596 -21.117 1.00 0.00 H new ATOM 0 HD3 PRO A 33 31.451 1.558 -22.516 1.00 0.00 H new ATOM 514 N GLN A 34 33.080 -2.278 -18.913 1.00 0.00 N ATOM 515 CA GLN A 34 32.870 -2.874 -17.615 1.00 0.00 C ATOM 516 C GLN A 34 33.531 -2.004 -16.579 1.00 0.00 C ATOM 517 O GLN A 34 33.398 -2.243 -15.382 1.00 0.00 O ATOM 518 CB GLN A 34 33.475 -4.288 -17.498 1.00 0.00 C ATOM 519 CG GLN A 34 32.884 -5.274 -18.520 1.00 0.00 C ATOM 520 CD GLN A 34 33.783 -5.314 -19.752 1.00 0.00 C ATOM 521 OE1 GLN A 34 34.484 -4.353 -20.064 1.00 0.00 O ATOM 522 NE2 GLN A 34 33.763 -6.456 -20.481 1.00 0.00 N ATOM 0 H GLN A 34 33.884 -2.641 -19.425 1.00 0.00 H new ATOM 0 HA GLN A 34 31.793 -2.955 -17.466 1.00 0.00 H new ATOM 0 HB2 GLN A 34 34.554 -4.229 -17.638 1.00 0.00 H new ATOM 0 HB3 GLN A 34 33.305 -4.669 -16.491 1.00 0.00 H new ATOM 0 HG2 GLN A 34 32.804 -6.268 -18.080 1.00 0.00 H new ATOM 0 HG3 GLN A 34 31.876 -4.967 -18.800 1.00 0.00 H new ATOM 0 HE21 GLN A 34 33.170 -7.234 -20.194 1.00 0.00 H new ATOM 0 HE22 GLN A 34 34.341 -6.537 -21.317 1.00 0.00 H new ATOM 531 N GLN A 35 34.268 -0.970 -17.026 1.00 0.00 N ATOM 532 CA GLN A 35 34.934 -0.075 -16.107 1.00 0.00 C ATOM 533 C GLN A 35 33.887 0.664 -15.312 1.00 0.00 C ATOM 534 O GLN A 35 34.048 0.900 -14.114 1.00 0.00 O ATOM 535 CB GLN A 35 35.821 0.966 -16.820 1.00 0.00 C ATOM 536 CG GLN A 35 36.612 1.845 -15.841 1.00 0.00 C ATOM 537 CD GLN A 35 37.537 2.752 -16.641 1.00 0.00 C ATOM 538 OE1 GLN A 35 37.244 3.112 -17.778 1.00 0.00 O ATOM 539 NE2 GLN A 35 38.687 3.138 -16.036 1.00 0.00 N ATOM 0 H GLN A 35 34.407 -0.748 -18.012 1.00 0.00 H new ATOM 0 HA GLN A 35 35.579 -0.682 -15.472 1.00 0.00 H new ATOM 0 HB2 GLN A 35 36.517 0.451 -17.482 1.00 0.00 H new ATOM 0 HB3 GLN A 35 35.195 1.601 -17.447 1.00 0.00 H new ATOM 0 HG2 GLN A 35 35.931 2.441 -15.233 1.00 0.00 H new ATOM 0 HG3 GLN A 35 37.190 1.224 -15.157 1.00 0.00 H new ATOM 0 HE21 GLN A 35 38.898 2.819 -15.090 1.00 0.00 H new ATOM 0 HE22 GLN A 35 39.342 3.747 -16.527 1.00 0.00 H new ATOM 548 N GLU A 36 32.772 1.035 -15.976 1.00 0.00 N ATOM 549 CA GLU A 36 31.722 1.778 -15.318 1.00 0.00 C ATOM 550 C GLU A 36 30.906 0.852 -14.451 1.00 0.00 C ATOM 551 O GLU A 36 30.053 1.309 -13.695 1.00 0.00 O ATOM 552 CB GLU A 36 30.764 2.462 -16.312 1.00 0.00 C ATOM 553 CG GLU A 36 31.444 3.596 -17.096 1.00 0.00 C ATOM 554 CD GLU A 36 30.461 4.157 -18.119 1.00 0.00 C ATOM 555 OE1 GLU A 36 29.372 3.550 -18.299 1.00 0.00 O ATOM 556 OE2 GLU A 36 30.792 5.202 -18.738 1.00 0.00 O ATOM 0 H GLU A 36 32.593 0.826 -16.958 1.00 0.00 H new ATOM 0 HA GLU A 36 32.214 2.549 -14.725 1.00 0.00 H new ATOM 0 HB2 GLU A 36 30.380 1.720 -17.012 1.00 0.00 H new ATOM 0 HB3 GLU A 36 29.907 2.862 -15.770 1.00 0.00 H new ATOM 0 HG2 GLU A 36 31.767 4.383 -16.414 1.00 0.00 H new ATOM 0 HG3 GLU A 36 32.337 3.223 -17.598 1.00 0.00 H new ATOM 563 N LYS A 37 31.144 -0.477 -14.538 1.00 0.00 N ATOM 564 CA LYS A 37 30.385 -1.419 -13.739 1.00 0.00 C ATOM 565 C LYS A 37 30.650 -1.153 -12.278 1.00 0.00 C ATOM 566 O LYS A 37 29.735 -1.199 -11.457 1.00 0.00 O ATOM 567 CB LYS A 37 30.746 -2.890 -14.031 1.00 0.00 C ATOM 568 CG LYS A 37 29.895 -3.883 -13.231 1.00 0.00 C ATOM 569 CD LYS A 37 30.132 -5.337 -13.654 1.00 0.00 C ATOM 570 CE LYS A 37 31.526 -5.842 -13.276 1.00 0.00 C ATOM 571 NZ LYS A 37 31.668 -7.272 -13.633 1.00 0.00 N ATOM 0 H LYS A 37 31.846 -0.899 -15.147 1.00 0.00 H new ATOM 0 HA LYS A 37 29.335 -1.276 -13.996 1.00 0.00 H new ATOM 0 HB2 LYS A 37 30.619 -3.086 -15.096 1.00 0.00 H new ATOM 0 HB3 LYS A 37 31.799 -3.053 -13.800 1.00 0.00 H new ATOM 0 HG2 LYS A 37 30.120 -3.776 -12.170 1.00 0.00 H new ATOM 0 HG3 LYS A 37 28.841 -3.638 -13.360 1.00 0.00 H new ATOM 0 HD2 LYS A 37 29.380 -5.974 -13.188 1.00 0.00 H new ATOM 0 HD3 LYS A 37 29.999 -5.424 -14.732 1.00 0.00 H new ATOM 0 HE2 LYS A 37 32.285 -5.254 -13.792 1.00 0.00 H new ATOM 0 HE3 LYS A 37 31.691 -5.709 -12.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 32.619 -7.602 -13.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 30.955 -7.830 -13.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 31.531 -7.389 -14.657 1.00 0.00 H new ATOM 585 N GLU A 38 31.924 -0.874 -11.919 1.00 0.00 N ATOM 586 CA GLU A 38 32.266 -0.620 -10.534 1.00 0.00 C ATOM 587 C GLU A 38 31.549 0.624 -10.071 1.00 0.00 C ATOM 588 O GLU A 38 31.017 0.669 -8.960 1.00 0.00 O ATOM 589 CB GLU A 38 33.779 -0.412 -10.322 1.00 0.00 C ATOM 590 CG GLU A 38 34.152 -0.198 -8.844 1.00 0.00 C ATOM 591 CD GLU A 38 35.667 -0.065 -8.724 1.00 0.00 C ATOM 592 OE1 GLU A 38 36.358 -0.140 -9.776 1.00 0.00 O ATOM 593 OE2 GLU A 38 36.153 0.113 -7.577 1.00 0.00 O ATOM 0 H GLU A 38 32.708 -0.823 -12.570 1.00 0.00 H new ATOM 0 HA GLU A 38 31.964 -1.497 -9.962 1.00 0.00 H new ATOM 0 HB2 GLU A 38 34.317 -1.279 -10.706 1.00 0.00 H new ATOM 0 HB3 GLU A 38 34.107 0.450 -10.903 1.00 0.00 H new ATOM 0 HG2 GLU A 38 33.665 0.698 -8.459 1.00 0.00 H new ATOM 0 HG3 GLU A 38 33.800 -1.036 -8.242 1.00 0.00 H new ATOM 600 N ASP A 39 31.526 1.673 -10.923 1.00 0.00 N ATOM 601 CA ASP A 39 30.865 2.910 -10.563 1.00 0.00 C ATOM 602 C ASP A 39 29.388 2.647 -10.421 1.00 0.00 C ATOM 603 O ASP A 39 28.738 3.184 -9.528 1.00 0.00 O ATOM 604 CB ASP A 39 31.053 4.022 -11.617 1.00 0.00 C ATOM 605 CG ASP A 39 32.477 4.562 -11.643 1.00 0.00 C ATOM 606 OD1 ASP A 39 33.237 4.285 -10.679 1.00 0.00 O ATOM 607 OD2 ASP A 39 32.820 5.260 -12.634 1.00 0.00 O ATOM 0 H ASP A 39 31.956 1.672 -11.848 1.00 0.00 H new ATOM 0 HA ASP A 39 31.313 3.254 -9.630 1.00 0.00 H new ATOM 0 HB2 ASP A 39 30.797 3.632 -12.602 1.00 0.00 H new ATOM 0 HB3 ASP A 39 30.361 4.838 -11.408 1.00 0.00 H new ATOM 612 N MET A 40 28.831 1.802 -11.316 1.00 0.00 N ATOM 613 CA MET A 40 27.419 1.492 -11.287 1.00 0.00 C ATOM 614 C MET A 40 27.074 0.834 -9.976 1.00 0.00 C ATOM 615 O MET A 40 26.058 1.158 -9.366 1.00 0.00 O ATOM 616 CB MET A 40 27.003 0.547 -12.434 1.00 0.00 C ATOM 617 CG MET A 40 25.509 0.205 -12.423 1.00 0.00 C ATOM 618 SD MET A 40 24.969 -0.661 -13.929 1.00 0.00 S ATOM 619 CE MET A 40 25.848 -2.215 -13.590 1.00 0.00 C ATOM 0 H MET A 40 29.351 1.333 -12.058 1.00 0.00 H new ATOM 0 HA MET A 40 26.881 2.432 -11.407 1.00 0.00 H new ATOM 0 HB2 MET A 40 27.256 1.010 -13.388 1.00 0.00 H new ATOM 0 HB3 MET A 40 27.581 -0.375 -12.364 1.00 0.00 H new ATOM 0 HG2 MET A 40 25.290 -0.416 -11.555 1.00 0.00 H new ATOM 0 HG3 MET A 40 24.932 1.123 -12.311 1.00 0.00 H new ATOM 0 HE1 MET A 40 25.256 -3.055 -13.953 1.00 0.00 H new ATOM 0 HE2 MET A 40 26.813 -2.205 -14.097 1.00 0.00 H new ATOM 0 HE3 MET A 40 26.003 -2.318 -12.516 1.00 0.00 H new ATOM 629 N GLU A 41 27.919 -0.107 -9.509 1.00 0.00 N ATOM 630 CA GLU A 41 27.647 -0.793 -8.264 1.00 0.00 C ATOM 631 C GLU A 41 27.652 0.202 -7.132 1.00 0.00 C ATOM 632 O GLU A 41 26.832 0.118 -6.220 1.00 0.00 O ATOM 633 CB GLU A 41 28.683 -1.888 -7.941 1.00 0.00 C ATOM 634 CG GLU A 41 28.566 -3.102 -8.877 1.00 0.00 C ATOM 635 CD GLU A 41 29.737 -4.046 -8.625 1.00 0.00 C ATOM 636 OE1 GLU A 41 30.733 -3.608 -7.987 1.00 0.00 O ATOM 637 OE2 GLU A 41 29.651 -5.220 -9.069 1.00 0.00 O ATOM 0 H GLU A 41 28.778 -0.395 -9.978 1.00 0.00 H new ATOM 0 HA GLU A 41 26.674 -1.271 -8.377 1.00 0.00 H new ATOM 0 HB2 GLU A 41 29.686 -1.469 -8.018 1.00 0.00 H new ATOM 0 HB3 GLU A 41 28.552 -2.215 -6.909 1.00 0.00 H new ATOM 0 HG2 GLU A 41 27.623 -3.620 -8.704 1.00 0.00 H new ATOM 0 HG3 GLU A 41 28.564 -2.775 -9.917 1.00 0.00 H new ATOM 644 N SER A 42 28.590 1.172 -7.169 1.00 0.00 N ATOM 645 CA SER A 42 28.675 2.164 -6.116 1.00 0.00 C ATOM 646 C SER A 42 27.424 3.007 -6.123 1.00 0.00 C ATOM 647 O SER A 42 26.883 3.340 -5.069 1.00 0.00 O ATOM 648 CB SER A 42 29.880 3.112 -6.275 1.00 0.00 C ATOM 649 OG SER A 42 31.095 2.386 -6.143 1.00 0.00 O ATOM 0 H SER A 42 29.282 1.276 -7.911 1.00 0.00 H new ATOM 0 HA SER A 42 28.794 1.616 -5.181 1.00 0.00 H new ATOM 0 HB2 SER A 42 29.843 3.599 -7.249 1.00 0.00 H new ATOM 0 HB3 SER A 42 29.835 3.899 -5.523 1.00 0.00 H new ATOM 0 HG SER A 42 31.226 1.822 -6.933 1.00 0.00 H new ATOM 655 N ILE A 43 26.943 3.380 -7.330 1.00 0.00 N ATOM 656 CA ILE A 43 25.751 4.194 -7.446 1.00 0.00 C ATOM 657 C ILE A 43 24.575 3.433 -6.898 1.00 0.00 C ATOM 658 O ILE A 43 23.763 3.983 -6.162 1.00 0.00 O ATOM 659 CB ILE A 43 25.445 4.569 -8.873 1.00 0.00 C ATOM 660 CG1 ILE A 43 26.510 5.544 -9.402 1.00 0.00 C ATOM 661 CG2 ILE A 43 24.028 5.180 -8.934 1.00 0.00 C ATOM 662 CD1 ILE A 43 26.423 5.744 -10.914 1.00 0.00 C ATOM 0 H ILE A 43 27.370 3.124 -8.220 1.00 0.00 H new ATOM 0 HA ILE A 43 25.932 5.110 -6.884 1.00 0.00 H new ATOM 0 HB ILE A 43 25.470 3.685 -9.511 1.00 0.00 H new ATOM 0 HG12 ILE A 43 26.395 6.507 -8.904 1.00 0.00 H new ATOM 0 HG13 ILE A 43 27.501 5.169 -9.145 1.00 0.00 H new ATOM 0 HG21 ILE A 43 23.795 5.456 -9.962 1.00 0.00 H new ATOM 0 HG22 ILE A 43 23.301 4.449 -8.580 1.00 0.00 H new ATOM 0 HG23 ILE A 43 23.987 6.067 -8.302 1.00 0.00 H new ATOM 0 HD11 ILE A 43 27.197 6.441 -11.234 1.00 0.00 H new ATOM 0 HD12 ILE A 43 26.566 4.787 -11.416 1.00 0.00 H new ATOM 0 HD13 ILE A 43 25.443 6.146 -11.172 1.00 0.00 H new ATOM 674 N VAL A 44 24.466 2.133 -7.243 1.00 0.00 N ATOM 675 CA VAL A 44 23.346 1.331 -6.793 1.00 0.00 C ATOM 676 C VAL A 44 23.347 1.261 -5.287 1.00 0.00 C ATOM 677 O VAL A 44 22.302 1.411 -4.656 1.00 0.00 O ATOM 678 CB VAL A 44 23.386 -0.073 -7.337 1.00 0.00 C ATOM 679 CG1 VAL A 44 22.295 -0.915 -6.643 1.00 0.00 C ATOM 680 CG2 VAL A 44 23.187 0.004 -8.861 1.00 0.00 C ATOM 0 H VAL A 44 25.139 1.635 -7.825 1.00 0.00 H new ATOM 0 HA VAL A 44 22.441 1.812 -7.163 1.00 0.00 H new ATOM 0 HB VAL A 44 24.342 -0.557 -7.138 1.00 0.00 H new ATOM 0 HG11 VAL A 44 22.318 -1.933 -7.032 1.00 0.00 H new ATOM 0 HG12 VAL A 44 22.478 -0.933 -5.569 1.00 0.00 H new ATOM 0 HG13 VAL A 44 21.317 -0.475 -6.837 1.00 0.00 H new ATOM 0 HG21 VAL A 44 23.212 -1.001 -9.282 1.00 0.00 H new ATOM 0 HG22 VAL A 44 22.224 0.466 -9.079 1.00 0.00 H new ATOM 0 HG23 VAL A 44 23.984 0.602 -9.302 1.00 0.00 H new ATOM 690 N GLU A 45 24.527 1.038 -4.672 1.00 0.00 N ATOM 691 CA GLU A 45 24.598 0.950 -3.228 1.00 0.00 C ATOM 692 C GLU A 45 24.184 2.271 -2.635 1.00 0.00 C ATOM 693 O GLU A 45 23.505 2.319 -1.610 1.00 0.00 O ATOM 694 CB GLU A 45 26.011 0.614 -2.710 1.00 0.00 C ATOM 695 CG GLU A 45 26.423 -0.833 -3.026 1.00 0.00 C ATOM 696 CD GLU A 45 27.882 -1.038 -2.634 1.00 0.00 C ATOM 697 OE1 GLU A 45 28.579 -0.022 -2.370 1.00 0.00 O ATOM 698 OE2 GLU A 45 28.319 -2.219 -2.596 1.00 0.00 O ATOM 0 H GLU A 45 25.418 0.920 -5.155 1.00 0.00 H new ATOM 0 HA GLU A 45 23.932 0.141 -2.928 1.00 0.00 H new ATOM 0 HB2 GLU A 45 26.731 1.300 -3.157 1.00 0.00 H new ATOM 0 HB3 GLU A 45 26.047 0.772 -1.632 1.00 0.00 H new ATOM 0 HG2 GLU A 45 25.787 -1.531 -2.482 1.00 0.00 H new ATOM 0 HG3 GLU A 45 26.287 -1.038 -4.088 1.00 0.00 H new ATOM 705 N THR A 46 24.598 3.380 -3.277 1.00 0.00 N ATOM 706 CA THR A 46 24.262 4.700 -2.784 1.00 0.00 C ATOM 707 C THR A 46 22.776 4.906 -2.897 1.00 0.00 C ATOM 708 O THR A 46 22.156 5.471 -2.001 1.00 0.00 O ATOM 709 CB THR A 46 24.953 5.809 -3.536 1.00 0.00 C ATOM 710 OG1 THR A 46 26.364 5.658 -3.436 1.00 0.00 O ATOM 711 CG2 THR A 46 24.533 7.165 -2.939 1.00 0.00 C ATOM 0 H THR A 46 25.159 3.374 -4.129 1.00 0.00 H new ATOM 0 HA THR A 46 24.599 4.744 -1.748 1.00 0.00 H new ATOM 0 HB THR A 46 24.667 5.766 -4.587 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.648 4.883 -3.964 1.00 0.00 H new ATOM 0 HG21 THR A 46 25.030 7.970 -3.480 1.00 0.00 H new ATOM 0 HG22 THR A 46 23.453 7.282 -3.026 1.00 0.00 H new ATOM 0 HG23 THR A 46 24.818 7.204 -1.888 1.00 0.00 H new ATOM 719 N MET A 47 22.161 4.454 -4.011 1.00 0.00 N ATOM 720 CA MET A 47 20.735 4.625 -4.183 1.00 0.00 C ATOM 721 C MET A 47 20.019 3.883 -3.090 1.00 0.00 C ATOM 722 O MET A 47 19.031 4.368 -2.548 1.00 0.00 O ATOM 723 CB MET A 47 20.205 4.084 -5.523 1.00 0.00 C ATOM 724 CG MET A 47 20.638 4.924 -6.726 1.00 0.00 C ATOM 725 SD MET A 47 20.177 4.164 -8.312 1.00 0.00 S ATOM 726 CE MET A 47 18.390 4.413 -8.099 1.00 0.00 C ATOM 0 H MET A 47 22.633 3.979 -4.780 1.00 0.00 H new ATOM 0 HA MET A 47 20.551 5.699 -4.156 1.00 0.00 H new ATOM 0 HB2 MET A 47 20.555 3.061 -5.658 1.00 0.00 H new ATOM 0 HB3 MET A 47 19.116 4.047 -5.487 1.00 0.00 H new ATOM 0 HG2 MET A 47 20.185 5.913 -6.656 1.00 0.00 H new ATOM 0 HG3 MET A 47 21.718 5.066 -6.696 1.00 0.00 H new ATOM 0 HE1 MET A 47 17.864 4.051 -8.983 1.00 0.00 H new ATOM 0 HE2 MET A 47 18.048 3.863 -7.223 1.00 0.00 H new ATOM 0 HE3 MET A 47 18.184 5.475 -7.964 1.00 0.00 H new ATOM 736 N MET A 48 20.508 2.675 -2.743 1.00 0.00 N ATOM 737 CA MET A 48 19.870 1.894 -1.711 1.00 0.00 C ATOM 738 C MET A 48 19.981 2.625 -0.400 1.00 0.00 C ATOM 739 O MET A 48 19.033 2.647 0.387 1.00 0.00 O ATOM 740 CB MET A 48 20.496 0.500 -1.544 1.00 0.00 C ATOM 741 CG MET A 48 20.226 -0.396 -2.753 1.00 0.00 C ATOM 742 SD MET A 48 18.461 -0.796 -2.960 1.00 0.00 S ATOM 743 CE MET A 48 18.632 -1.475 -4.636 1.00 0.00 C ATOM 0 H MET A 48 21.329 2.241 -3.165 1.00 0.00 H new ATOM 0 HA MET A 48 18.830 1.759 -2.009 1.00 0.00 H new ATOM 0 HB2 MET A 48 21.572 0.600 -1.400 1.00 0.00 H new ATOM 0 HB3 MET A 48 20.097 0.028 -0.646 1.00 0.00 H new ATOM 0 HG2 MET A 48 20.589 0.099 -3.654 1.00 0.00 H new ATOM 0 HG3 MET A 48 20.793 -1.321 -2.647 1.00 0.00 H new ATOM 0 HE1 MET A 48 17.720 -2.006 -4.908 1.00 0.00 H new ATOM 0 HE2 MET A 48 18.803 -0.662 -5.342 1.00 0.00 H new ATOM 0 HE3 MET A 48 19.476 -2.165 -4.665 1.00 0.00 H new ATOM 753 N SER A 49 21.153 3.248 -0.125 1.00 0.00 N ATOM 754 CA SER A 49 21.310 3.968 1.124 1.00 0.00 C ATOM 755 C SER A 49 20.411 5.179 1.102 1.00 0.00 C ATOM 756 O SER A 49 19.881 5.588 2.133 1.00 0.00 O ATOM 757 CB SER A 49 22.759 4.425 1.411 1.00 0.00 C ATOM 758 OG SER A 49 23.212 5.369 0.444 1.00 0.00 O ATOM 0 H SER A 49 21.967 3.258 -0.739 1.00 0.00 H new ATOM 0 HA SER A 49 21.041 3.274 1.920 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.811 4.868 2.405 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.421 3.559 1.413 1.00 0.00 H new ATOM 0 HG SER A 49 22.866 5.124 -0.439 1.00 0.00 H new ATOM 764 N ALA A 50 20.227 5.782 -0.094 1.00 0.00 N ATOM 765 CA ALA A 50 19.384 6.951 -0.227 1.00 0.00 C ATOM 766 C ALA A 50 17.963 6.586 0.115 1.00 0.00 C ATOM 767 O ALA A 50 17.255 7.363 0.749 1.00 0.00 O ATOM 768 CB ALA A 50 19.397 7.542 -1.649 1.00 0.00 C ATOM 0 H ALA A 50 20.655 5.468 -0.965 1.00 0.00 H new ATOM 0 HA ALA A 50 19.782 7.703 0.455 1.00 0.00 H new ATOM 0 HB1 ALA A 50 18.747 8.416 -1.686 1.00 0.00 H new ATOM 0 HB2 ALA A 50 20.413 7.835 -1.912 1.00 0.00 H new ATOM 0 HB3 ALA A 50 19.040 6.794 -2.357 1.00 0.00 H new ATOM 774 N ILE A 51 17.511 5.381 -0.312 1.00 0.00 N ATOM 775 CA ILE A 51 16.153 4.954 -0.035 1.00 0.00 C ATOM 776 C ILE A 51 15.969 4.881 1.453 1.00 0.00 C ATOM 777 O ILE A 51 14.992 5.395 1.991 1.00 0.00 O ATOM 778 CB ILE A 51 15.827 3.592 -0.609 1.00 0.00 C ATOM 779 CG1 ILE A 51 15.794 3.640 -2.149 1.00 0.00 C ATOM 780 CG2 ILE A 51 14.482 3.114 -0.025 1.00 0.00 C ATOM 781 CD1 ILE A 51 14.706 4.565 -2.691 1.00 0.00 C ATOM 0 H ILE A 51 18.070 4.711 -0.839 1.00 0.00 H new ATOM 0 HA ILE A 51 15.488 5.680 -0.503 1.00 0.00 H new ATOM 0 HB ILE A 51 16.604 2.880 -0.332 1.00 0.00 H new ATOM 0 HG12 ILE A 51 16.764 3.973 -2.518 1.00 0.00 H new ATOM 0 HG13 ILE A 51 15.634 2.633 -2.536 1.00 0.00 H new ATOM 0 HG21 ILE A 51 14.237 2.133 -0.432 1.00 0.00 H new ATOM 0 HG22 ILE A 51 14.560 3.048 1.060 1.00 0.00 H new ATOM 0 HG23 ILE A 51 13.698 3.823 -0.290 1.00 0.00 H new ATOM 0 HD11 ILE A 51 14.732 4.558 -3.781 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.731 4.219 -2.349 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.878 5.579 -2.331 1.00 0.00 H new ATOM 793 N SER A 52 16.940 4.259 2.153 1.00 0.00 N ATOM 794 CA SER A 52 16.853 4.112 3.590 1.00 0.00 C ATOM 795 C SER A 52 16.856 5.471 4.234 1.00 0.00 C ATOM 796 O SER A 52 16.156 5.700 5.218 1.00 0.00 O ATOM 797 CB SER A 52 18.023 3.309 4.190 1.00 0.00 C ATOM 798 OG SER A 52 17.976 1.962 3.738 1.00 0.00 O ATOM 0 H SER A 52 17.780 3.859 1.735 1.00 0.00 H new ATOM 0 HA SER A 52 15.929 3.568 3.787 1.00 0.00 H new ATOM 0 HB2 SER A 52 18.971 3.764 3.903 1.00 0.00 H new ATOM 0 HB3 SER A 52 17.973 3.337 5.278 1.00 0.00 H new ATOM 0 HG SER A 52 18.725 1.461 4.124 1.00 0.00 H new ATOM 804 N GLY A 53 17.677 6.403 3.700 1.00 0.00 N ATOM 805 CA GLY A 53 17.760 7.733 4.263 1.00 0.00 C ATOM 806 C GLY A 53 16.427 8.422 4.160 1.00 0.00 C ATOM 807 O GLY A 53 16.006 9.097 5.095 1.00 0.00 O ATOM 0 H GLY A 53 18.277 6.244 2.891 1.00 0.00 H new ATOM 0 HA2 GLY A 53 18.069 7.676 5.307 1.00 0.00 H new ATOM 0 HA3 GLY A 53 18.519 8.312 3.737 1.00 0.00 H new ATOM 811 N VAL A 54 15.735 8.287 3.002 1.00 0.00 N ATOM 812 CA VAL A 54 14.450 8.938 2.838 1.00 0.00 C ATOM 813 C VAL A 54 13.467 8.334 3.807 1.00 0.00 C ATOM 814 O VAL A 54 12.758 9.052 4.512 1.00 0.00 O ATOM 815 CB VAL A 54 13.884 8.814 1.440 1.00 0.00 C ATOM 816 CG1 VAL A 54 12.436 9.346 1.432 1.00 0.00 C ATOM 817 CG2 VAL A 54 14.788 9.605 0.475 1.00 0.00 C ATOM 0 H VAL A 54 16.050 7.744 2.198 1.00 0.00 H new ATOM 0 HA VAL A 54 14.610 9.999 3.029 1.00 0.00 H new ATOM 0 HB VAL A 54 13.860 7.773 1.116 1.00 0.00 H new ATOM 0 HG11 VAL A 54 12.022 9.260 0.427 1.00 0.00 H new ATOM 0 HG12 VAL A 54 11.830 8.763 2.125 1.00 0.00 H new ATOM 0 HG13 VAL A 54 12.431 10.392 1.738 1.00 0.00 H new ATOM 0 HG21 VAL A 54 14.395 9.527 -0.539 1.00 0.00 H new ATOM 0 HG22 VAL A 54 14.812 10.653 0.775 1.00 0.00 H new ATOM 0 HG23 VAL A 54 15.798 9.196 0.505 1.00 0.00 H new ATOM 827 N SER A 55 13.405 6.987 3.867 1.00 0.00 N ATOM 828 CA SER A 55 12.481 6.348 4.772 1.00 0.00 C ATOM 829 C SER A 55 12.817 4.889 4.810 1.00 0.00 C ATOM 830 O SER A 55 13.387 4.347 3.869 1.00 0.00 O ATOM 831 CB SER A 55 11.007 6.488 4.345 1.00 0.00 C ATOM 832 OG SER A 55 10.152 5.900 5.320 1.00 0.00 O ATOM 0 H SER A 55 13.975 6.352 3.308 1.00 0.00 H new ATOM 0 HA SER A 55 12.582 6.834 5.742 1.00 0.00 H new ATOM 0 HB2 SER A 55 10.756 7.541 4.219 1.00 0.00 H new ATOM 0 HB3 SER A 55 10.854 6.006 3.379 1.00 0.00 H new ATOM 0 HG SER A 55 9.219 5.997 5.038 1.00 0.00 H new ATOM 916 N GLU A 62 5.428 11.768 -3.657 1.00 0.00 N ATOM 917 CA GLU A 62 5.675 12.074 -5.047 1.00 0.00 C ATOM 918 C GLU A 62 7.094 12.561 -5.175 1.00 0.00 C ATOM 919 O GLU A 62 7.773 12.276 -6.161 1.00 0.00 O ATOM 920 CB GLU A 62 4.733 13.164 -5.601 1.00 0.00 C ATOM 921 CG GLU A 62 4.950 13.434 -7.101 1.00 0.00 C ATOM 922 CD GLU A 62 3.926 14.459 -7.578 1.00 0.00 C ATOM 923 OE1 GLU A 62 3.081 14.899 -6.747 1.00 0.00 O ATOM 924 OE2 GLU A 62 3.972 14.817 -8.784 1.00 0.00 O ATOM 0 HA GLU A 62 5.496 11.166 -5.623 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.699 12.862 -5.437 1.00 0.00 H new ATOM 0 HB3 GLU A 62 4.887 14.088 -5.044 1.00 0.00 H new ATOM 0 HG2 GLU A 62 5.961 13.804 -7.274 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.848 12.509 -7.668 1.00 0.00 H new ATOM 931 N ALA A 63 7.570 13.330 -4.167 1.00 0.00 N ATOM 932 CA ALA A 63 8.918 13.854 -4.196 1.00 0.00 C ATOM 933 C ALA A 63 9.890 12.709 -4.235 1.00 0.00 C ATOM 934 O ALA A 63 10.899 12.765 -4.930 1.00 0.00 O ATOM 935 CB ALA A 63 9.260 14.700 -2.955 1.00 0.00 C ATOM 0 H ALA A 63 7.032 13.588 -3.340 1.00 0.00 H new ATOM 0 HA ALA A 63 8.987 14.489 -5.079 1.00 0.00 H new ATOM 0 HB1 ALA A 63 10.284 15.065 -3.034 1.00 0.00 H new ATOM 0 HB2 ALA A 63 8.577 15.547 -2.892 1.00 0.00 H new ATOM 0 HB3 ALA A 63 9.162 14.087 -2.059 1.00 0.00 H new ATOM 941 N THR A 64 9.599 11.638 -3.472 1.00 0.00 N ATOM 942 CA THR A 64 10.479 10.492 -3.427 1.00 0.00 C ATOM 943 C THR A 64 10.501 9.838 -4.780 1.00 0.00 C ATOM 944 O THR A 64 11.560 9.463 -5.280 1.00 0.00 O ATOM 945 CB THR A 64 10.035 9.455 -2.425 1.00 0.00 C ATOM 946 OG1 THR A 64 9.987 10.026 -1.124 1.00 0.00 O ATOM 947 CG2 THR A 64 11.028 8.279 -2.436 1.00 0.00 C ATOM 0 H THR A 64 8.766 11.558 -2.889 1.00 0.00 H new ATOM 0 HA THR A 64 11.463 10.857 -3.131 1.00 0.00 H new ATOM 0 HB THR A 64 9.040 9.098 -2.693 1.00 0.00 H new ATOM 0 HG1 THR A 64 9.696 9.347 -0.479 1.00 0.00 H new ATOM 0 HG21 THR A 64 10.710 7.528 -1.713 1.00 0.00 H new ATOM 0 HG22 THR A 64 11.056 7.836 -3.431 1.00 0.00 H new ATOM 0 HG23 THR A 64 12.022 8.640 -2.171 1.00 0.00 H new ATOM 955 N LEU A 65 9.317 9.695 -5.407 1.00 0.00 N ATOM 956 CA LEU A 65 9.227 9.046 -6.698 1.00 0.00 C ATOM 957 C LEU A 65 9.991 9.832 -7.726 1.00 0.00 C ATOM 958 O LEU A 65 10.729 9.269 -8.532 1.00 0.00 O ATOM 959 CB LEU A 65 7.773 8.946 -7.207 1.00 0.00 C ATOM 960 CG LEU A 65 6.915 7.966 -6.395 1.00 0.00 C ATOM 961 CD1 LEU A 65 5.431 8.072 -6.781 1.00 0.00 C ATOM 962 CD2 LEU A 65 7.425 6.530 -6.548 1.00 0.00 C ATOM 0 H LEU A 65 8.426 10.022 -5.032 1.00 0.00 H new ATOM 0 HA LEU A 65 9.637 8.045 -6.563 1.00 0.00 H new ATOM 0 HB2 LEU A 65 7.314 9.934 -7.174 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.781 8.633 -8.251 1.00 0.00 H new ATOM 0 HG LEU A 65 7.003 8.241 -5.344 1.00 0.00 H new ATOM 0 HD11 LEU A 65 4.850 7.365 -6.189 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.077 9.085 -6.589 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.313 7.841 -7.840 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.799 5.857 -5.962 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.386 6.240 -7.598 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.454 6.469 -6.193 1.00 0.00 H new ATOM 974 N GLN A 66 9.826 11.165 -7.711 1.00 0.00 N ATOM 975 CA GLN A 66 10.483 12.005 -8.684 1.00 0.00 C ATOM 976 C GLN A 66 11.965 12.041 -8.425 1.00 0.00 C ATOM 977 O GLN A 66 12.766 11.956 -9.357 1.00 0.00 O ATOM 978 CB GLN A 66 9.936 13.450 -8.659 1.00 0.00 C ATOM 979 CG GLN A 66 10.449 14.321 -9.819 1.00 0.00 C ATOM 980 CD GLN A 66 11.735 15.024 -9.392 1.00 0.00 C ATOM 981 OE1 GLN A 66 11.939 15.329 -8.222 1.00 0.00 O ATOM 982 NE2 GLN A 66 12.627 15.297 -10.373 1.00 0.00 N ATOM 0 H GLN A 66 9.246 11.665 -7.037 1.00 0.00 H new ATOM 0 HA GLN A 66 10.283 11.576 -9.666 1.00 0.00 H new ATOM 0 HB2 GLN A 66 8.847 13.418 -8.693 1.00 0.00 H new ATOM 0 HB3 GLN A 66 10.212 13.918 -7.714 1.00 0.00 H new ATOM 0 HG2 GLN A 66 10.633 13.704 -10.698 1.00 0.00 H new ATOM 0 HG3 GLN A 66 9.694 15.056 -10.098 1.00 0.00 H new ATOM 0 HE21 GLN A 66 12.424 15.029 -11.336 1.00 0.00 H new ATOM 0 HE22 GLN A 66 13.502 15.771 -10.149 1.00 0.00 H new ATOM 991 N ALA A 67 12.366 12.162 -7.144 1.00 0.00 N ATOM 992 CA ALA A 67 13.768 12.248 -6.813 1.00 0.00 C ATOM 993 C ALA A 67 14.481 10.971 -7.158 1.00 0.00 C ATOM 994 O ALA A 67 15.587 11.006 -7.679 1.00 0.00 O ATOM 995 CB ALA A 67 14.010 12.531 -5.319 1.00 0.00 C ATOM 0 H ALA A 67 11.734 12.200 -6.344 1.00 0.00 H new ATOM 0 HA ALA A 67 14.158 13.080 -7.399 1.00 0.00 H new ATOM 0 HB1 ALA A 67 15.082 12.585 -5.128 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.545 13.479 -5.048 1.00 0.00 H new ATOM 0 HB3 ALA A 67 13.575 11.730 -4.722 1.00 0.00 H new ATOM 1001 N MET A 68 13.870 9.804 -6.874 1.00 0.00 N ATOM 1002 CA MET A 68 14.537 8.549 -7.149 1.00 0.00 C ATOM 1003 C MET A 68 14.591 8.300 -8.628 1.00 0.00 C ATOM 1004 O MET A 68 15.608 7.836 -9.144 1.00 0.00 O ATOM 1005 CB MET A 68 13.847 7.342 -6.483 1.00 0.00 C ATOM 1006 CG MET A 68 14.503 6.947 -5.158 1.00 0.00 C ATOM 1007 SD MET A 68 14.503 8.289 -3.928 1.00 0.00 S ATOM 1008 CE MET A 68 16.311 8.414 -3.823 1.00 0.00 C ATOM 0 H MET A 68 12.939 9.720 -6.465 1.00 0.00 H new ATOM 0 HA MET A 68 15.539 8.643 -6.731 1.00 0.00 H new ATOM 0 HB2 MET A 68 12.798 7.579 -6.308 1.00 0.00 H new ATOM 0 HB3 MET A 68 13.873 6.492 -7.165 1.00 0.00 H new ATOM 0 HG2 MET A 68 13.981 6.084 -4.745 1.00 0.00 H new ATOM 0 HG3 MET A 68 15.531 6.637 -5.347 1.00 0.00 H new ATOM 0 HE1 MET A 68 16.582 9.103 -3.023 1.00 0.00 H new ATOM 0 HE2 MET A 68 16.732 7.431 -3.613 1.00 0.00 H new ATOM 0 HE3 MET A 68 16.706 8.784 -4.769 1.00 0.00 H new ATOM 1018 N ASN A 69 13.492 8.592 -9.351 1.00 0.00 N ATOM 1019 CA ASN A 69 13.475 8.353 -10.773 1.00 0.00 C ATOM 1020 C ASN A 69 14.522 9.235 -11.421 1.00 0.00 C ATOM 1021 O ASN A 69 15.255 8.802 -12.311 1.00 0.00 O ATOM 1022 CB ASN A 69 12.090 8.638 -11.398 1.00 0.00 C ATOM 1023 CG ASN A 69 12.030 8.291 -12.883 1.00 0.00 C ATOM 1024 OD1 ASN A 69 12.187 7.137 -13.267 1.00 0.00 O ATOM 1025 ND2 ASN A 69 11.793 9.315 -13.740 1.00 0.00 N ATOM 0 H ASN A 69 12.632 8.984 -8.968 1.00 0.00 H new ATOM 0 HA ASN A 69 13.693 7.299 -10.947 1.00 0.00 H new ATOM 0 HB2 ASN A 69 11.331 8.066 -10.865 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.846 9.692 -11.265 1.00 0.00 H new ATOM 0 HD21 ASN A 69 11.740 9.139 -14.743 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.668 10.262 -13.381 1.00 0.00 H new ATOM 1032 N MET A 70 14.618 10.506 -10.979 1.00 0.00 N ATOM 1033 CA MET A 70 15.590 11.411 -11.543 1.00 0.00 C ATOM 1034 C MET A 70 16.976 11.018 -11.093 1.00 0.00 C ATOM 1035 O MET A 70 17.927 11.106 -11.862 1.00 0.00 O ATOM 1036 CB MET A 70 15.356 12.883 -11.146 1.00 0.00 C ATOM 1037 CG MET A 70 16.392 13.835 -11.760 1.00 0.00 C ATOM 1038 SD MET A 70 16.072 15.586 -11.387 1.00 0.00 S ATOM 1039 CE MET A 70 14.816 15.805 -12.681 1.00 0.00 C ATOM 0 H MET A 70 14.035 10.906 -10.244 1.00 0.00 H new ATOM 0 HA MET A 70 15.484 11.335 -12.625 1.00 0.00 H new ATOM 0 HB2 MET A 70 14.358 13.186 -11.463 1.00 0.00 H new ATOM 0 HB3 MET A 70 15.386 12.971 -10.060 1.00 0.00 H new ATOM 0 HG2 MET A 70 17.383 13.568 -11.393 1.00 0.00 H new ATOM 0 HG3 MET A 70 16.405 13.698 -12.841 1.00 0.00 H new ATOM 0 HE1 MET A 70 14.022 16.453 -12.311 1.00 0.00 H new ATOM 0 HE2 MET A 70 15.274 16.258 -13.560 1.00 0.00 H new ATOM 0 HE3 MET A 70 14.397 14.835 -12.950 1.00 0.00 H new ATOM 1049 N ALA A 71 17.119 10.572 -9.825 1.00 0.00 N ATOM 1050 CA ALA A 71 18.426 10.247 -9.291 1.00 0.00 C ATOM 1051 C ALA A 71 19.087 9.130 -10.059 1.00 0.00 C ATOM 1052 O ALA A 71 20.291 9.191 -10.314 1.00 0.00 O ATOM 1053 CB ALA A 71 18.375 9.821 -7.814 1.00 0.00 C ATOM 0 H ALA A 71 16.346 10.436 -9.173 1.00 0.00 H new ATOM 0 HA ALA A 71 19.002 11.167 -9.387 1.00 0.00 H new ATOM 0 HB1 ALA A 71 19.382 9.589 -7.467 1.00 0.00 H new ATOM 0 HB2 ALA A 71 17.963 10.633 -7.215 1.00 0.00 H new ATOM 0 HB3 ALA A 71 17.744 8.938 -7.712 1.00 0.00 H new ATOM 1059 N PHE A 72 18.338 8.076 -10.457 1.00 0.00 N ATOM 1060 CA PHE A 72 18.978 6.977 -11.141 1.00 0.00 C ATOM 1061 C PHE A 72 19.294 7.392 -12.553 1.00 0.00 C ATOM 1062 O PHE A 72 20.377 7.102 -13.062 1.00 0.00 O ATOM 1063 CB PHE A 72 18.127 5.674 -11.158 1.00 0.00 C ATOM 1064 CG PHE A 72 17.351 5.407 -12.415 1.00 0.00 C ATOM 1065 CD1 PHE A 72 17.897 4.627 -13.408 1.00 0.00 C ATOM 1066 CD2 PHE A 72 16.093 5.932 -12.592 1.00 0.00 C ATOM 1067 CE1 PHE A 72 17.197 4.376 -14.564 1.00 0.00 C ATOM 1068 CE2 PHE A 72 15.390 5.681 -13.749 1.00 0.00 C ATOM 1069 CZ PHE A 72 15.943 4.904 -14.735 1.00 0.00 C ATOM 0 H PHE A 72 17.332 7.981 -10.315 1.00 0.00 H new ATOM 0 HA PHE A 72 19.887 6.744 -10.587 1.00 0.00 H new ATOM 0 HB2 PHE A 72 18.791 4.828 -10.979 1.00 0.00 H new ATOM 0 HB3 PHE A 72 17.426 5.711 -10.324 1.00 0.00 H new ATOM 0 HD1 PHE A 72 18.884 4.208 -13.278 1.00 0.00 H new ATOM 0 HD2 PHE A 72 15.653 6.545 -11.819 1.00 0.00 H new ATOM 0 HE1 PHE A 72 17.635 3.763 -15.338 1.00 0.00 H new ATOM 0 HE2 PHE A 72 14.402 6.096 -13.880 1.00 0.00 H new ATOM 0 HZ PHE A 72 15.392 4.709 -15.643 1.00 0.00 H new ATOM 1079 N ALA A 73 18.351 8.093 -13.222 1.00 0.00 N ATOM 1080 CA ALA A 73 18.572 8.495 -14.587 1.00 0.00 C ATOM 1081 C ALA A 73 19.716 9.470 -14.657 1.00 0.00 C ATOM 1082 O ALA A 73 20.556 9.381 -15.544 1.00 0.00 O ATOM 1083 CB ALA A 73 17.338 9.158 -15.223 1.00 0.00 C ATOM 0 H ALA A 73 17.454 8.377 -12.829 1.00 0.00 H new ATOM 0 HA ALA A 73 18.794 7.584 -15.143 1.00 0.00 H new ATOM 0 HB1 ALA A 73 17.565 9.439 -16.251 1.00 0.00 H new ATOM 0 HB2 ALA A 73 16.503 8.457 -15.215 1.00 0.00 H new ATOM 0 HB3 ALA A 73 17.070 10.048 -14.654 1.00 0.00 H new ATOM 1089 N SER A 74 19.768 10.429 -13.712 1.00 0.00 N ATOM 1090 CA SER A 74 20.815 11.428 -13.719 1.00 0.00 C ATOM 1091 C SER A 74 22.151 10.779 -13.482 1.00 0.00 C ATOM 1092 O SER A 74 23.126 11.101 -14.155 1.00 0.00 O ATOM 1093 CB SER A 74 20.618 12.510 -12.635 1.00 0.00 C ATOM 1094 OG SER A 74 21.662 13.477 -12.690 1.00 0.00 O ATOM 0 H SER A 74 19.098 10.520 -12.949 1.00 0.00 H new ATOM 0 HA SER A 74 20.773 11.905 -14.698 1.00 0.00 H new ATOM 0 HB2 SER A 74 19.655 13.000 -12.775 1.00 0.00 H new ATOM 0 HB3 SER A 74 20.599 12.045 -11.650 1.00 0.00 H new ATOM 0 HG SER A 74 21.311 14.317 -13.052 1.00 0.00 H new ATOM 1100 N SER A 75 22.230 9.853 -12.504 1.00 0.00 N ATOM 1101 CA SER A 75 23.495 9.222 -12.187 1.00 0.00 C ATOM 1102 C SER A 75 23.986 8.401 -13.352 1.00 0.00 C ATOM 1103 O SER A 75 25.159 8.479 -13.722 1.00 0.00 O ATOM 1104 CB SER A 75 23.406 8.288 -10.967 1.00 0.00 C ATOM 1105 OG SER A 75 23.082 9.035 -9.801 1.00 0.00 O ATOM 0 H SER A 75 21.440 9.541 -11.939 1.00 0.00 H new ATOM 0 HA SER A 75 24.183 10.036 -11.961 1.00 0.00 H new ATOM 0 HB2 SER A 75 22.649 7.523 -11.140 1.00 0.00 H new ATOM 0 HB3 SER A 75 24.355 7.771 -10.825 1.00 0.00 H new ATOM 0 HG SER A 75 22.115 9.195 -9.773 1.00 0.00 H new ATOM 1111 N MET A 76 23.097 7.593 -13.970 1.00 0.00 N ATOM 1112 CA MET A 76 23.519 6.759 -15.073 1.00 0.00 C ATOM 1113 C MET A 76 23.832 7.623 -16.266 1.00 0.00 C ATOM 1114 O MET A 76 24.794 7.368 -16.990 1.00 0.00 O ATOM 1115 CB MET A 76 22.466 5.707 -15.473 1.00 0.00 C ATOM 1116 CG MET A 76 22.314 4.612 -14.406 1.00 0.00 C ATOM 1117 SD MET A 76 21.064 3.361 -14.829 1.00 0.00 S ATOM 1118 CE MET A 76 21.412 2.288 -13.401 1.00 0.00 C ATOM 0 H MET A 76 22.112 7.514 -13.719 1.00 0.00 H new ATOM 0 HA MET A 76 24.405 6.219 -14.739 1.00 0.00 H new ATOM 0 HB2 MET A 76 21.505 6.197 -15.629 1.00 0.00 H new ATOM 0 HB3 MET A 76 22.750 5.252 -16.422 1.00 0.00 H new ATOM 0 HG2 MET A 76 23.276 4.120 -14.262 1.00 0.00 H new ATOM 0 HG3 MET A 76 22.047 5.075 -13.456 1.00 0.00 H new ATOM 0 HE1 MET A 76 20.754 1.419 -13.430 1.00 0.00 H new ATOM 0 HE2 MET A 76 22.450 1.958 -13.438 1.00 0.00 H new ATOM 0 HE3 MET A 76 21.240 2.843 -12.479 1.00 0.00 H new ATOM 1128 N ALA A 77 23.017 8.675 -16.498 1.00 0.00 N ATOM 1129 CA ALA A 77 23.235 9.554 -17.625 1.00 0.00 C ATOM 1130 C ALA A 77 24.556 10.258 -17.469 1.00 0.00 C ATOM 1131 O ALA A 77 25.280 10.443 -18.440 1.00 0.00 O ATOM 1132 CB ALA A 77 22.142 10.629 -17.770 1.00 0.00 C ATOM 0 H ALA A 77 22.216 8.919 -15.916 1.00 0.00 H new ATOM 0 HA ALA A 77 23.216 8.925 -18.515 1.00 0.00 H new ATOM 0 HB1 ALA A 77 22.362 11.257 -18.633 1.00 0.00 H new ATOM 0 HB2 ALA A 77 21.174 10.147 -17.909 1.00 0.00 H new ATOM 0 HB3 ALA A 77 22.115 11.245 -16.871 1.00 0.00 H new ATOM 1138 N GLU A 78 24.901 10.663 -16.228 1.00 0.00 N ATOM 1139 CA GLU A 78 26.137 11.381 -15.997 1.00 0.00 C ATOM 1140 C GLU A 78 27.305 10.535 -16.424 1.00 0.00 C ATOM 1141 O GLU A 78 28.232 11.029 -17.060 1.00 0.00 O ATOM 1142 CB GLU A 78 26.336 11.762 -14.513 1.00 0.00 C ATOM 1143 CG GLU A 78 27.641 12.539 -14.248 1.00 0.00 C ATOM 1144 CD GLU A 78 27.592 13.882 -14.973 1.00 0.00 C ATOM 1145 OE1 GLU A 78 26.465 14.350 -15.294 1.00 0.00 O ATOM 1146 OE2 GLU A 78 28.684 14.460 -15.208 1.00 0.00 O ATOM 0 H GLU A 78 24.339 10.500 -15.393 1.00 0.00 H new ATOM 0 HA GLU A 78 26.078 12.299 -16.582 1.00 0.00 H new ATOM 0 HB2 GLU A 78 25.490 12.365 -14.184 1.00 0.00 H new ATOM 0 HB3 GLU A 78 26.334 10.854 -13.909 1.00 0.00 H new ATOM 0 HG2 GLU A 78 27.772 12.697 -13.177 1.00 0.00 H new ATOM 0 HG3 GLU A 78 28.498 11.959 -14.592 1.00 0.00 H new ATOM 1153 N LEU A 79 27.290 9.233 -16.078 1.00 0.00 N ATOM 1154 CA LEU A 79 28.392 8.368 -16.451 1.00 0.00 C ATOM 1155 C LEU A 79 28.453 8.241 -17.952 1.00 0.00 C ATOM 1156 O LEU A 79 29.532 8.248 -18.543 1.00 0.00 O ATOM 1157 CB LEU A 79 28.267 6.941 -15.878 1.00 0.00 C ATOM 1158 CG LEU A 79 28.453 6.885 -14.353 1.00 0.00 C ATOM 1159 CD1 LEU A 79 28.115 5.486 -13.812 1.00 0.00 C ATOM 1160 CD2 LEU A 79 29.872 7.311 -13.942 1.00 0.00 C ATOM 0 H LEU A 79 26.541 8.779 -15.554 1.00 0.00 H new ATOM 0 HA LEU A 79 29.289 8.830 -16.040 1.00 0.00 H new ATOM 0 HB2 LEU A 79 27.287 6.538 -16.134 1.00 0.00 H new ATOM 0 HB3 LEU A 79 29.009 6.299 -16.352 1.00 0.00 H new ATOM 0 HG LEU A 79 27.758 7.597 -13.908 1.00 0.00 H new ATOM 0 HD11 LEU A 79 28.254 5.471 -12.731 1.00 0.00 H new ATOM 0 HD12 LEU A 79 27.078 5.245 -14.048 1.00 0.00 H new ATOM 0 HD13 LEU A 79 28.773 4.749 -14.273 1.00 0.00 H new ATOM 0 HD21 LEU A 79 29.968 7.259 -12.857 1.00 0.00 H new ATOM 0 HD22 LEU A 79 30.600 6.643 -14.403 1.00 0.00 H new ATOM 0 HD23 LEU A 79 30.056 8.333 -14.274 1.00 0.00 H new ATOM 1172 N VAL A 80 27.278 8.120 -18.599 1.00 0.00 N ATOM 1173 CA VAL A 80 27.228 7.954 -20.036 1.00 0.00 C ATOM 1174 C VAL A 80 27.770 9.181 -20.733 1.00 0.00 C ATOM 1175 O VAL A 80 28.607 9.071 -21.629 1.00 0.00 O ATOM 1176 CB VAL A 80 25.822 7.710 -20.533 1.00 0.00 C ATOM 1177 CG1 VAL A 80 25.815 7.762 -22.070 1.00 0.00 C ATOM 1178 CG2 VAL A 80 25.343 6.350 -19.993 1.00 0.00 C ATOM 0 H VAL A 80 26.367 8.136 -18.141 1.00 0.00 H new ATOM 0 HA VAL A 80 27.840 7.082 -20.267 1.00 0.00 H new ATOM 0 HB VAL A 80 25.136 8.478 -20.176 1.00 0.00 H new ATOM 0 HG11 VAL A 80 24.803 7.587 -22.435 1.00 0.00 H new ATOM 0 HG12 VAL A 80 26.156 8.742 -22.402 1.00 0.00 H new ATOM 0 HG13 VAL A 80 26.481 6.994 -22.463 1.00 0.00 H new ATOM 0 HG21 VAL A 80 24.329 6.157 -20.342 1.00 0.00 H new ATOM 0 HG22 VAL A 80 26.006 5.562 -20.351 1.00 0.00 H new ATOM 0 HG23 VAL A 80 25.355 6.367 -18.903 1.00 0.00 H new ATOM 1188 N ILE A 81 27.323 10.387 -20.319 1.00 0.00 N ATOM 1189 CA ILE A 81 27.759 11.608 -20.971 1.00 0.00 C ATOM 1190 C ILE A 81 29.198 11.883 -20.642 1.00 0.00 C ATOM 1191 O ILE A 81 29.897 12.523 -21.409 1.00 0.00 O ATOM 1192 CB ILE A 81 26.963 12.820 -20.567 1.00 0.00 C ATOM 1193 CG1 ILE A 81 25.465 12.584 -20.823 1.00 0.00 C ATOM 1194 CG2 ILE A 81 27.495 14.037 -21.363 1.00 0.00 C ATOM 1195 CD1 ILE A 81 25.136 12.355 -22.299 1.00 0.00 C ATOM 0 H ILE A 81 26.671 10.525 -19.547 1.00 0.00 H new ATOM 0 HA ILE A 81 27.612 11.441 -22.038 1.00 0.00 H new ATOM 0 HB ILE A 81 27.077 13.014 -19.501 1.00 0.00 H new ATOM 0 HG12 ILE A 81 25.136 11.720 -20.246 1.00 0.00 H new ATOM 0 HG13 ILE A 81 24.901 13.443 -20.461 1.00 0.00 H new ATOM 0 HG21 ILE A 81 26.931 14.928 -21.086 1.00 0.00 H new ATOM 0 HG22 ILE A 81 28.550 14.189 -21.134 1.00 0.00 H new ATOM 0 HG23 ILE A 81 27.379 13.852 -22.431 1.00 0.00 H new ATOM 0 HD11 ILE A 81 24.064 12.195 -22.412 1.00 0.00 H new ATOM 0 HD12 ILE A 81 25.436 13.228 -22.878 1.00 0.00 H new ATOM 0 HD13 ILE A 81 25.674 11.478 -22.660 1.00 0.00 H new ATOM 1207 N ALA A 82 29.687 11.404 -19.492 1.00 0.00 N ATOM 1208 CA ALA A 82 31.056 11.689 -19.115 1.00 0.00 C ATOM 1209 C ALA A 82 32.013 11.190 -20.173 1.00 0.00 C ATOM 1210 O ALA A 82 32.967 11.885 -20.518 1.00 0.00 O ATOM 1211 CB ALA A 82 31.453 11.042 -17.776 1.00 0.00 C ATOM 0 H ALA A 82 29.163 10.833 -18.829 1.00 0.00 H new ATOM 0 HA ALA A 82 31.118 12.772 -19.012 1.00 0.00 H new ATOM 0 HB1 ALA A 82 32.489 11.290 -17.545 1.00 0.00 H new ATOM 0 HB2 ALA A 82 30.805 11.418 -16.984 1.00 0.00 H new ATOM 0 HB3 ALA A 82 31.347 9.960 -17.849 1.00 0.00 H new ATOM 1217 N GLU A 83 31.790 9.976 -20.717 1.00 0.00 N ATOM 1218 CA GLU A 83 32.700 9.460 -21.722 1.00 0.00 C ATOM 1219 C GLU A 83 32.153 9.696 -23.113 1.00 0.00 C ATOM 1220 O GLU A 83 32.915 9.758 -24.076 1.00 0.00 O ATOM 1221 CB GLU A 83 32.986 7.949 -21.562 1.00 0.00 C ATOM 1222 CG GLU A 83 31.755 7.059 -21.816 1.00 0.00 C ATOM 1223 CD GLU A 83 32.149 5.598 -21.610 1.00 0.00 C ATOM 1224 OE1 GLU A 83 33.317 5.343 -21.207 1.00 0.00 O ATOM 1225 OE2 GLU A 83 31.287 4.715 -21.865 1.00 0.00 O ATOM 0 H GLU A 83 31.011 9.363 -20.478 1.00 0.00 H new ATOM 0 HA GLU A 83 33.635 10.002 -21.579 1.00 0.00 H new ATOM 0 HB2 GLU A 83 33.780 7.663 -22.252 1.00 0.00 H new ATOM 0 HB3 GLU A 83 33.357 7.763 -20.554 1.00 0.00 H new ATOM 0 HG2 GLU A 83 30.947 7.331 -21.137 1.00 0.00 H new ATOM 0 HG3 GLU A 83 31.384 7.210 -22.830 1.00 0.00 H new ATOM 1232 N ASP A 84 30.818 9.847 -23.253 1.00 0.00 N ATOM 1233 CA ASP A 84 30.219 10.020 -24.566 1.00 0.00 C ATOM 1234 C ASP A 84 29.910 11.471 -24.821 1.00 0.00 C ATOM 1235 O ASP A 84 29.153 11.786 -25.739 1.00 0.00 O ATOM 1236 CB ASP A 84 28.911 9.226 -24.732 1.00 0.00 C ATOM 1237 CG ASP A 84 29.147 7.726 -24.749 1.00 0.00 C ATOM 1238 OD1 ASP A 84 30.303 7.307 -25.024 1.00 0.00 O ATOM 1239 OD2 ASP A 84 28.172 6.979 -24.489 1.00 0.00 O ATOM 0 H ASP A 84 30.155 9.851 -22.478 1.00 0.00 H new ATOM 0 HA ASP A 84 30.952 9.645 -25.280 1.00 0.00 H new ATOM 0 HB2 ASP A 84 28.231 9.476 -23.918 1.00 0.00 H new ATOM 0 HB3 ASP A 84 28.422 9.525 -25.659 1.00 0.00 H new ATOM 1244 N VAL A 85 30.475 12.394 -24.014 1.00 0.00 N ATOM 1245 CA VAL A 85 30.190 13.811 -24.174 1.00 0.00 C ATOM 1246 C VAL A 85 30.422 14.253 -25.599 1.00 0.00 C ATOM 1247 O VAL A 85 29.736 15.151 -26.088 1.00 0.00 O ATOM 1248 CB VAL A 85 31.011 14.693 -23.251 1.00 0.00 C ATOM 1249 CG1 VAL A 85 32.505 14.583 -23.616 1.00 0.00 C ATOM 1250 CG2 VAL A 85 30.482 16.137 -23.349 1.00 0.00 C ATOM 0 H VAL A 85 31.122 12.174 -23.257 1.00 0.00 H new ATOM 0 HA VAL A 85 29.140 13.930 -23.908 1.00 0.00 H new ATOM 0 HB VAL A 85 30.914 14.368 -22.215 1.00 0.00 H new ATOM 0 HG11 VAL A 85 33.090 15.218 -22.951 1.00 0.00 H new ATOM 0 HG12 VAL A 85 32.830 13.548 -23.509 1.00 0.00 H new ATOM 0 HG13 VAL A 85 32.652 14.905 -24.647 1.00 0.00 H new ATOM 0 HG21 VAL A 85 31.063 16.783 -22.691 1.00 0.00 H new ATOM 0 HG22 VAL A 85 30.574 16.489 -24.376 1.00 0.00 H new ATOM 0 HG23 VAL A 85 29.434 16.162 -23.049 1.00 0.00 H new ATOM 1260 N ASN A 86 31.385 13.633 -26.314 1.00 0.00 N ATOM 1261 CA ASN A 86 31.643 14.037 -27.678 1.00 0.00 C ATOM 1262 C ASN A 86 31.476 12.841 -28.575 1.00 0.00 C ATOM 1263 O ASN A 86 32.148 12.726 -29.597 1.00 0.00 O ATOM 1264 CB ASN A 86 33.059 14.617 -27.887 1.00 0.00 C ATOM 1265 CG ASN A 86 33.313 15.877 -27.057 1.00 0.00 C ATOM 1266 OD1 ASN A 86 32.232 16.501 -26.518 1.00 0.00 O flip ATOM 1267 ND2 ASN A 86 34.455 16.291 -26.883 1.00 0.00 N flip ATOM 0 H ASN A 86 31.972 12.874 -25.967 1.00 0.00 H new ATOM 0 HA ASN A 86 30.933 14.828 -27.918 1.00 0.00 H new ATOM 0 HB2 ASN A 86 33.799 13.860 -27.626 1.00 0.00 H new ATOM 0 HB3 ASN A 86 33.199 14.849 -28.943 1.00 0.00 H new ATOM 0 HD21 ASN A 86 35.245 15.800 -27.301 1.00 0.00 H new ATOM 0 HD22 ASN A 86 34.614 17.126 -26.320 1.00 0.00 H new ATOM 1274 N ASN A 87 30.563 11.913 -28.210 1.00 0.00 N ATOM 1275 CA ASN A 87 30.346 10.747 -29.028 1.00 0.00 C ATOM 1276 C ASN A 87 28.866 10.465 -29.008 1.00 0.00 C ATOM 1277 O ASN A 87 28.384 9.618 -28.253 1.00 0.00 O ATOM 1278 CB ASN A 87 31.096 9.498 -28.512 1.00 0.00 C ATOM 1279 CG ASN A 87 31.083 8.357 -29.525 1.00 0.00 C ATOM 1280 OD1 ASN A 87 30.231 8.302 -30.409 1.00 0.00 O ATOM 1281 ND2 ASN A 87 32.054 7.421 -29.397 1.00 0.00 N ATOM 0 H ASN A 87 29.987 11.965 -27.370 1.00 0.00 H new ATOM 0 HA ASN A 87 30.725 10.951 -30.029 1.00 0.00 H new ATOM 0 HB2 ASN A 87 32.127 9.765 -28.282 1.00 0.00 H new ATOM 0 HB3 ASN A 87 30.639 9.161 -27.582 1.00 0.00 H new ATOM 0 HD21 ASN A 87 32.095 6.637 -30.048 1.00 0.00 H new ATOM 0 HD22 ASN A 87 32.744 7.501 -28.650 1.00 0.00 H new ATOM 1288 N PRO A 88 28.130 11.170 -29.841 1.00 0.00 N ATOM 1289 CA PRO A 88 26.684 11.010 -29.923 1.00 0.00 C ATOM 1290 C PRO A 88 26.263 9.704 -30.531 1.00 0.00 C ATOM 1291 O PRO A 88 25.122 9.277 -30.372 1.00 0.00 O ATOM 1292 CB PRO A 88 26.220 12.185 -30.790 1.00 0.00 C ATOM 1293 CG PRO A 88 27.431 12.508 -31.656 1.00 0.00 C ATOM 1294 CD PRO A 88 28.639 12.183 -30.779 1.00 0.00 C ATOM 0 HA PRO A 88 26.239 11.003 -28.928 1.00 0.00 H new ATOM 0 HB2 PRO A 88 25.356 11.916 -31.397 1.00 0.00 H new ATOM 0 HB3 PRO A 88 25.927 13.039 -30.180 1.00 0.00 H new ATOM 0 HG2 PRO A 88 27.434 11.913 -32.569 1.00 0.00 H new ATOM 0 HG3 PRO A 88 27.433 13.555 -31.958 1.00 0.00 H new ATOM 0 HD2 PRO A 88 29.470 11.799 -31.370 1.00 0.00 H new ATOM 0 HD3 PRO A 88 29.002 13.067 -30.255 1.00 0.00 H new ATOM 1302 N ASP A 89 27.187 9.036 -31.254 1.00 0.00 N ATOM 1303 CA ASP A 89 26.863 7.773 -31.877 1.00 0.00 C ATOM 1304 C ASP A 89 26.622 6.766 -30.783 1.00 0.00 C ATOM 1305 O ASP A 89 25.683 5.973 -30.841 1.00 0.00 O ATOM 1306 CB ASP A 89 27.991 7.246 -32.791 1.00 0.00 C ATOM 1307 CG ASP A 89 27.566 6.025 -33.596 1.00 0.00 C ATOM 1308 OD1 ASP A 89 26.652 6.170 -34.448 1.00 0.00 O ATOM 1309 OD2 ASP A 89 28.154 4.936 -33.371 1.00 0.00 O ATOM 0 H ASP A 89 28.142 9.358 -31.409 1.00 0.00 H new ATOM 0 HA ASP A 89 25.983 7.923 -32.503 1.00 0.00 H new ATOM 0 HB2 ASP A 89 28.301 8.037 -33.473 1.00 0.00 H new ATOM 0 HB3 ASP A 89 28.859 6.992 -32.182 1.00 0.00 H new ATOM 1314 N SER A 90 27.492 6.789 -29.756 1.00 0.00 N ATOM 1315 CA SER A 90 27.369 5.876 -28.641 1.00 0.00 C ATOM 1316 C SER A 90 26.108 6.186 -27.889 1.00 0.00 C ATOM 1317 O SER A 90 25.441 5.287 -27.387 1.00 0.00 O ATOM 1318 CB SER A 90 28.545 5.958 -27.651 1.00 0.00 C ATOM 1319 OG SER A 90 29.738 5.495 -28.270 1.00 0.00 O ATOM 0 H SER A 90 28.280 7.433 -29.690 1.00 0.00 H new ATOM 0 HA SER A 90 27.359 4.871 -29.062 1.00 0.00 H new ATOM 0 HB2 SER A 90 28.676 6.986 -27.315 1.00 0.00 H new ATOM 0 HB3 SER A 90 28.329 5.359 -26.767 1.00 0.00 H new ATOM 0 HG SER A 90 30.481 5.553 -27.633 1.00 0.00 H new ATOM 1325 N ILE A 91 25.756 7.488 -27.792 1.00 0.00 N ATOM 1326 CA ILE A 91 24.572 7.894 -27.060 1.00 0.00 C ATOM 1327 C ILE A 91 23.360 7.259 -27.687 1.00 0.00 C ATOM 1328 O ILE A 91 22.502 6.727 -26.987 1.00 0.00 O ATOM 1329 CB ILE A 91 24.359 9.391 -27.073 1.00 0.00 C ATOM 1330 CG1 ILE A 91 25.494 10.110 -26.319 1.00 0.00 C ATOM 1331 CG2 ILE A 91 22.981 9.699 -26.453 1.00 0.00 C ATOM 1332 CD1 ILE A 91 25.573 9.713 -24.848 1.00 0.00 C ATOM 0 H ILE A 91 26.280 8.256 -28.212 1.00 0.00 H new ATOM 0 HA ILE A 91 24.716 7.574 -26.028 1.00 0.00 H new ATOM 0 HB ILE A 91 24.377 9.760 -28.099 1.00 0.00 H new ATOM 0 HG12 ILE A 91 26.445 9.885 -26.803 1.00 0.00 H new ATOM 0 HG13 ILE A 91 25.347 11.188 -26.392 1.00 0.00 H new ATOM 0 HG21 ILE A 91 22.813 10.776 -26.456 1.00 0.00 H new ATOM 0 HG22 ILE A 91 22.202 9.209 -27.037 1.00 0.00 H new ATOM 0 HG23 ILE A 91 22.953 9.330 -25.428 1.00 0.00 H new ATOM 0 HD11 ILE A 91 26.391 10.251 -24.369 1.00 0.00 H new ATOM 0 HD12 ILE A 91 24.635 9.963 -24.353 1.00 0.00 H new ATOM 0 HD13 ILE A 91 25.750 8.640 -24.770 1.00 0.00 H new ATOM 1344 N ALA A 92 23.262 7.298 -29.032 1.00 0.00 N ATOM 1345 CA ALA A 92 22.113 6.733 -29.703 1.00 0.00 C ATOM 1346 C ALA A 92 22.041 5.248 -29.449 1.00 0.00 C ATOM 1347 O ALA A 92 20.964 4.707 -29.195 1.00 0.00 O ATOM 1348 CB ALA A 92 22.147 6.951 -31.226 1.00 0.00 C ATOM 0 H ALA A 92 23.960 7.711 -29.650 1.00 0.00 H new ATOM 0 HA ALA A 92 21.241 7.246 -29.298 1.00 0.00 H new ATOM 0 HB1 ALA A 92 21.260 6.506 -31.677 1.00 0.00 H new ATOM 0 HB2 ALA A 92 22.166 8.020 -31.440 1.00 0.00 H new ATOM 0 HB3 ALA A 92 23.039 6.482 -31.641 1.00 0.00 H new ATOM 1354 N GLU A 93 23.195 4.552 -29.506 1.00 0.00 N ATOM 1355 CA GLU A 93 23.202 3.117 -29.304 1.00 0.00 C ATOM 1356 C GLU A 93 22.824 2.792 -27.880 1.00 0.00 C ATOM 1357 O GLU A 93 22.049 1.868 -27.632 1.00 0.00 O ATOM 1358 CB GLU A 93 24.584 2.483 -29.578 1.00 0.00 C ATOM 1359 CG GLU A 93 24.975 2.511 -31.067 1.00 0.00 C ATOM 1360 CD GLU A 93 23.946 1.725 -31.869 1.00 0.00 C ATOM 1361 OE1 GLU A 93 23.648 0.566 -31.479 1.00 0.00 O ATOM 1362 OE2 GLU A 93 23.447 2.276 -32.887 1.00 0.00 O ATOM 0 H GLU A 93 24.110 4.965 -29.688 1.00 0.00 H new ATOM 0 HA GLU A 93 22.481 2.706 -30.011 1.00 0.00 H new ATOM 0 HB2 GLU A 93 25.341 3.012 -28.999 1.00 0.00 H new ATOM 0 HB3 GLU A 93 24.579 1.450 -29.229 1.00 0.00 H new ATOM 0 HG2 GLU A 93 25.023 3.540 -31.424 1.00 0.00 H new ATOM 0 HG3 GLU A 93 25.967 2.080 -31.203 1.00 0.00 H new ATOM 1369 N LYS A 94 23.367 3.550 -26.903 1.00 0.00 N ATOM 1370 CA LYS A 94 23.068 3.288 -25.512 1.00 0.00 C ATOM 1371 C LYS A 94 21.628 3.606 -25.230 1.00 0.00 C ATOM 1372 O LYS A 94 20.971 2.897 -24.476 1.00 0.00 O ATOM 1373 CB LYS A 94 23.937 4.097 -24.530 1.00 0.00 C ATOM 1374 CG LYS A 94 25.392 3.624 -24.513 1.00 0.00 C ATOM 1375 CD LYS A 94 26.250 4.412 -23.523 1.00 0.00 C ATOM 1376 CE LYS A 94 27.699 3.925 -23.484 1.00 0.00 C ATOM 1377 NZ LYS A 94 28.478 4.725 -22.516 1.00 0.00 N ATOM 0 H LYS A 94 24.002 4.331 -27.065 1.00 0.00 H new ATOM 0 HA LYS A 94 23.285 2.231 -25.355 1.00 0.00 H new ATOM 0 HB2 LYS A 94 23.904 5.152 -24.804 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.519 4.015 -23.527 1.00 0.00 H new ATOM 0 HG2 LYS A 94 25.424 2.565 -24.255 1.00 0.00 H new ATOM 0 HG3 LYS A 94 25.814 3.721 -25.513 1.00 0.00 H new ATOM 0 HD2 LYS A 94 26.233 5.468 -23.793 1.00 0.00 H new ATOM 0 HD3 LYS A 94 25.816 4.330 -22.526 1.00 0.00 H new ATOM 0 HE2 LYS A 94 27.729 2.872 -23.205 1.00 0.00 H new ATOM 0 HE3 LYS A 94 28.144 4.005 -24.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 29.452 4.364 -22.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 28.490 5.720 -22.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 28.040 4.654 -21.575 1.00 0.00 H new ATOM 1391 N THR A 95 21.101 4.689 -25.834 1.00 0.00 N ATOM 1392 CA THR A 95 19.728 5.077 -25.591 1.00 0.00 C ATOM 1393 C THR A 95 18.813 3.981 -26.064 1.00 0.00 C ATOM 1394 O THR A 95 17.862 3.623 -25.374 1.00 0.00 O ATOM 1395 CB THR A 95 19.333 6.350 -26.297 1.00 0.00 C ATOM 1396 OG1 THR A 95 20.155 7.424 -25.858 1.00 0.00 O ATOM 1397 CG2 THR A 95 17.859 6.667 -25.983 1.00 0.00 C ATOM 0 H THR A 95 21.609 5.292 -26.481 1.00 0.00 H new ATOM 0 HA THR A 95 19.640 5.249 -24.518 1.00 0.00 H new ATOM 0 HB THR A 95 19.461 6.222 -27.372 1.00 0.00 H new ATOM 0 HG1 THR A 95 21.010 7.399 -26.337 1.00 0.00 H new ATOM 0 HG21 THR A 95 17.568 7.587 -26.491 1.00 0.00 H new ATOM 0 HG22 THR A 95 17.229 5.847 -26.328 1.00 0.00 H new ATOM 0 HG23 THR A 95 17.735 6.792 -24.907 1.00 0.00 H new ATOM 1405 N GLU A 96 19.078 3.419 -27.264 1.00 0.00 N ATOM 1406 CA GLU A 96 18.225 2.373 -27.784 1.00 0.00 C ATOM 1407 C GLU A 96 18.330 1.146 -26.910 1.00 0.00 C ATOM 1408 O GLU A 96 17.322 0.502 -26.621 1.00 0.00 O ATOM 1409 CB GLU A 96 18.589 1.962 -29.225 1.00 0.00 C ATOM 1410 CG GLU A 96 18.239 3.050 -30.252 1.00 0.00 C ATOM 1411 CD GLU A 96 18.752 2.628 -31.625 1.00 0.00 C ATOM 1412 OE1 GLU A 96 19.527 1.638 -31.696 1.00 0.00 O ATOM 1413 OE2 GLU A 96 18.370 3.293 -32.622 1.00 0.00 O ATOM 0 H GLU A 96 19.861 3.677 -27.865 1.00 0.00 H new ATOM 0 HA GLU A 96 17.212 2.776 -27.788 1.00 0.00 H new ATOM 0 HB2 GLU A 96 19.656 1.745 -29.279 1.00 0.00 H new ATOM 0 HB3 GLU A 96 18.063 1.042 -29.481 1.00 0.00 H new ATOM 0 HG2 GLU A 96 17.160 3.202 -30.285 1.00 0.00 H new ATOM 0 HG3 GLU A 96 18.686 4.000 -29.960 1.00 0.00 H new ATOM 1420 N ALA A 97 19.559 0.790 -26.467 1.00 0.00 N ATOM 1421 CA ALA A 97 19.733 -0.386 -25.640 1.00 0.00 C ATOM 1422 C ALA A 97 19.019 -0.203 -24.325 1.00 0.00 C ATOM 1423 O ALA A 97 18.361 -1.120 -23.832 1.00 0.00 O ATOM 1424 CB ALA A 97 21.212 -0.686 -25.338 1.00 0.00 C ATOM 0 H ALA A 97 20.417 1.301 -26.673 1.00 0.00 H new ATOM 0 HA ALA A 97 19.317 -1.222 -26.203 1.00 0.00 H new ATOM 0 HB1 ALA A 97 21.283 -1.578 -24.715 1.00 0.00 H new ATOM 0 HB2 ALA A 97 21.748 -0.853 -26.273 1.00 0.00 H new ATOM 0 HB3 ALA A 97 21.655 0.160 -24.812 1.00 0.00 H new ATOM 1430 N LEU A 98 19.139 0.995 -23.724 1.00 0.00 N ATOM 1431 CA LEU A 98 18.505 1.256 -22.451 1.00 0.00 C ATOM 1432 C LEU A 98 17.017 1.294 -22.626 1.00 0.00 C ATOM 1433 O LEU A 98 16.278 0.849 -21.755 1.00 0.00 O ATOM 1434 CB LEU A 98 18.949 2.583 -21.801 1.00 0.00 C ATOM 1435 CG LEU A 98 20.403 2.544 -21.299 1.00 0.00 C ATOM 1436 CD1 LEU A 98 20.886 3.943 -20.884 1.00 0.00 C ATOM 1437 CD2 LEU A 98 20.574 1.535 -20.149 1.00 0.00 C ATOM 0 H LEU A 98 19.666 1.780 -24.107 1.00 0.00 H new ATOM 0 HA LEU A 98 18.811 0.446 -21.789 1.00 0.00 H new ATOM 0 HB2 LEU A 98 18.841 3.391 -22.525 1.00 0.00 H new ATOM 0 HB3 LEU A 98 18.287 2.813 -20.966 1.00 0.00 H new ATOM 0 HG LEU A 98 21.026 2.208 -22.128 1.00 0.00 H new ATOM 0 HD11 LEU A 98 21.916 3.883 -20.534 1.00 0.00 H new ATOM 0 HD12 LEU A 98 20.832 4.615 -21.740 1.00 0.00 H new ATOM 0 HD13 LEU A 98 20.252 4.324 -20.083 1.00 0.00 H new ATOM 0 HD21 LEU A 98 21.613 1.533 -19.818 1.00 0.00 H new ATOM 0 HD22 LEU A 98 19.929 1.818 -19.317 1.00 0.00 H new ATOM 0 HD23 LEU A 98 20.302 0.538 -20.496 1.00 0.00 H new ATOM 1449 N SER A 99 16.536 1.841 -23.760 1.00 0.00 N ATOM 1450 CA SER A 99 15.110 1.925 -23.991 1.00 0.00 C ATOM 1451 C SER A 99 14.545 0.534 -24.025 1.00 0.00 C ATOM 1452 O SER A 99 13.461 0.283 -23.500 1.00 0.00 O ATOM 1453 CB SER A 99 14.746 2.615 -25.320 1.00 0.00 C ATOM 1454 OG SER A 99 15.134 3.982 -25.285 1.00 0.00 O ATOM 0 H SER A 99 17.115 2.221 -24.509 1.00 0.00 H new ATOM 0 HA SER A 99 14.694 2.524 -23.181 1.00 0.00 H new ATOM 0 HB2 SER A 99 15.242 2.110 -26.149 1.00 0.00 H new ATOM 0 HB3 SER A 99 13.673 2.538 -25.496 1.00 0.00 H new ATOM 0 HG SER A 99 16.112 4.045 -25.309 1.00 0.00 H new ATOM 1460 N GLN A 100 15.274 -0.404 -24.661 1.00 0.00 N ATOM 1461 CA GLN A 100 14.823 -1.759 -24.750 1.00 0.00 C ATOM 1462 C GLN A 100 14.783 -2.360 -23.369 1.00 0.00 C ATOM 1463 O GLN A 100 13.834 -3.061 -23.015 1.00 0.00 O ATOM 1464 CB GLN A 100 15.753 -2.612 -25.628 1.00 0.00 C ATOM 1465 CG GLN A 100 15.224 -4.027 -25.824 1.00 0.00 C ATOM 1466 CD GLN A 100 16.153 -4.775 -26.772 1.00 0.00 C ATOM 1467 OE1 GLN A 100 17.109 -4.214 -27.301 1.00 0.00 O ATOM 1468 NE2 GLN A 100 15.868 -6.081 -26.996 1.00 0.00 N ATOM 0 H GLN A 100 16.171 -0.224 -25.111 1.00 0.00 H new ATOM 0 HA GLN A 100 13.831 -1.751 -25.202 1.00 0.00 H new ATOM 0 HB2 GLN A 100 15.872 -2.133 -26.600 1.00 0.00 H new ATOM 0 HB3 GLN A 100 16.742 -2.656 -25.171 1.00 0.00 H new ATOM 0 HG2 GLN A 100 15.167 -4.544 -24.866 1.00 0.00 H new ATOM 0 HG3 GLN A 100 14.213 -3.998 -26.231 1.00 0.00 H new ATOM 0 HE21 GLN A 100 15.065 -6.514 -26.539 1.00 0.00 H new ATOM 0 HE22 GLN A 100 16.456 -6.631 -27.622 1.00 0.00 H new ATOM 1477 N ALA A 101 15.825 -2.090 -22.550 1.00 0.00 N ATOM 1478 CA ALA A 101 15.878 -2.639 -21.212 1.00 0.00 C ATOM 1479 C ALA A 101 14.743 -2.084 -20.392 1.00 0.00 C ATOM 1480 O ALA A 101 14.099 -2.810 -19.636 1.00 0.00 O ATOM 1481 CB ALA A 101 17.193 -2.308 -20.485 1.00 0.00 C ATOM 0 H ALA A 101 16.620 -1.503 -22.803 1.00 0.00 H new ATOM 0 HA ALA A 101 15.805 -3.722 -21.316 1.00 0.00 H new ATOM 0 HB1 ALA A 101 17.177 -2.745 -19.487 1.00 0.00 H new ATOM 0 HB2 ALA A 101 18.032 -2.718 -21.047 1.00 0.00 H new ATOM 0 HB3 ALA A 101 17.303 -1.226 -20.406 1.00 0.00 H new ATOM 1487 N LEU A 102 14.471 -0.771 -20.529 1.00 0.00 N ATOM 1488 CA LEU A 102 13.415 -0.145 -19.764 1.00 0.00 C ATOM 1489 C LEU A 102 12.088 -0.733 -20.157 1.00 0.00 C ATOM 1490 O LEU A 102 11.257 -1.021 -19.301 1.00 0.00 O ATOM 1491 CB LEU A 102 13.330 1.381 -19.988 1.00 0.00 C ATOM 1492 CG LEU A 102 14.502 2.159 -19.359 1.00 0.00 C ATOM 1493 CD1 LEU A 102 14.541 3.607 -19.869 1.00 0.00 C ATOM 1494 CD2 LEU A 102 14.443 2.125 -17.823 1.00 0.00 C ATOM 0 H LEU A 102 14.971 -0.143 -21.159 1.00 0.00 H new ATOM 0 HA LEU A 102 13.648 -0.329 -18.715 1.00 0.00 H new ATOM 0 HB2 LEU A 102 13.303 1.582 -21.059 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.393 1.750 -19.571 1.00 0.00 H new ATOM 0 HG LEU A 102 15.423 1.664 -19.667 1.00 0.00 H new ATOM 0 HD11 LEU A 102 15.378 4.132 -19.409 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.663 3.608 -20.952 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.610 4.110 -19.609 1.00 0.00 H new ATOM 0 HD21 LEU A 102 15.285 2.684 -17.414 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.510 2.575 -17.485 1.00 0.00 H new ATOM 0 HD23 LEU A 102 14.492 1.092 -17.480 1.00 0.00 H new ATOM 1506 N LYS A 103 11.868 -0.942 -21.473 1.00 0.00 N ATOM 1507 CA LYS A 103 10.613 -1.470 -21.942 1.00 0.00 C ATOM 1508 C LYS A 103 10.388 -2.845 -21.373 1.00 0.00 C ATOM 1509 O LYS A 103 9.306 -3.149 -20.871 1.00 0.00 O ATOM 1510 CB LYS A 103 10.586 -1.567 -23.472 1.00 0.00 C ATOM 1511 CG LYS A 103 9.266 -2.093 -24.029 1.00 0.00 C ATOM 1512 CD LYS A 103 9.291 -2.142 -25.552 1.00 0.00 C ATOM 1513 CE LYS A 103 7.987 -2.671 -26.151 1.00 0.00 C ATOM 1514 NZ LYS A 103 8.070 -2.692 -27.628 1.00 0.00 N ATOM 0 H LYS A 103 12.550 -0.749 -22.207 1.00 0.00 H new ATOM 0 HA LYS A 103 9.827 -0.789 -21.614 1.00 0.00 H new ATOM 0 HB2 LYS A 103 10.781 -0.581 -23.893 1.00 0.00 H new ATOM 0 HB3 LYS A 103 11.395 -2.220 -23.800 1.00 0.00 H new ATOM 0 HG2 LYS A 103 9.073 -3.090 -23.634 1.00 0.00 H new ATOM 0 HG3 LYS A 103 8.448 -1.454 -23.696 1.00 0.00 H new ATOM 0 HD2 LYS A 103 9.484 -1.142 -25.940 1.00 0.00 H new ATOM 0 HD3 LYS A 103 10.117 -2.774 -25.877 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.789 -3.675 -25.777 1.00 0.00 H new ATOM 0 HE3 LYS A 103 7.153 -2.043 -25.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 7.177 -3.053 -28.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 8.238 -1.728 -27.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 8.853 -3.309 -27.923 1.00 0.00 H new ATOM 1528 N GLN A 104 11.418 -3.710 -21.433 1.00 0.00 N ATOM 1529 CA GLN A 104 11.277 -5.060 -20.935 1.00 0.00 C ATOM 1530 C GLN A 104 11.099 -5.042 -19.441 1.00 0.00 C ATOM 1531 O GLN A 104 10.297 -5.802 -18.898 1.00 0.00 O ATOM 1532 CB GLN A 104 12.489 -5.950 -21.269 1.00 0.00 C ATOM 1533 CG GLN A 104 12.575 -6.276 -22.768 1.00 0.00 C ATOM 1534 CD GLN A 104 13.898 -6.981 -23.041 1.00 0.00 C ATOM 1535 OE1 GLN A 104 14.898 -6.733 -22.378 1.00 0.00 O ATOM 1536 NE2 GLN A 104 13.906 -7.885 -24.050 1.00 0.00 N ATOM 0 H GLN A 104 12.336 -3.488 -21.818 1.00 0.00 H new ATOM 0 HA GLN A 104 10.401 -5.481 -21.429 1.00 0.00 H new ATOM 0 HB2 GLN A 104 13.404 -5.447 -20.955 1.00 0.00 H new ATOM 0 HB3 GLN A 104 12.424 -6.878 -20.700 1.00 0.00 H new ATOM 0 HG2 GLN A 104 11.740 -6.911 -23.065 1.00 0.00 H new ATOM 0 HG3 GLN A 104 12.505 -5.362 -23.358 1.00 0.00 H new ATOM 0 HE21 GLN A 104 13.053 -8.065 -24.580 1.00 0.00 H new ATOM 0 HE22 GLN A 104 14.765 -8.386 -24.279 1.00 0.00 H new ATOM 1545 N CYS A 105 11.857 -4.178 -18.736 1.00 0.00 N ATOM 1546 CA CYS A 105 11.749 -4.120 -17.291 1.00 0.00 C ATOM 1547 C CYS A 105 10.393 -3.637 -16.867 1.00 0.00 C ATOM 1548 O CYS A 105 9.816 -4.190 -15.939 1.00 0.00 O ATOM 1549 CB CYS A 105 12.798 -3.215 -16.622 1.00 0.00 C ATOM 1550 SG CYS A 105 14.435 -4.001 -16.604 1.00 0.00 S ATOM 0 H CYS A 105 12.531 -3.531 -19.145 1.00 0.00 H new ATOM 0 HA CYS A 105 11.923 -5.145 -16.962 1.00 0.00 H new ATOM 0 HB2 CYS A 105 12.854 -2.265 -17.154 1.00 0.00 H new ATOM 0 HB3 CYS A 105 12.489 -2.990 -15.601 1.00 0.00 H new ATOM 1555 N PHE A 106 9.838 -2.596 -17.529 1.00 0.00 N ATOM 1556 CA PHE A 106 8.541 -2.090 -17.127 1.00 0.00 C ATOM 1557 C PHE A 106 7.492 -3.131 -17.408 1.00 0.00 C ATOM 1558 O PHE A 106 6.567 -3.319 -16.620 1.00 0.00 O ATOM 1559 CB PHE A 106 8.131 -0.790 -17.851 1.00 0.00 C ATOM 1560 CG PHE A 106 8.784 0.436 -17.295 1.00 0.00 C ATOM 1561 CD1 PHE A 106 9.646 1.186 -18.066 1.00 0.00 C ATOM 1562 CD2 PHE A 106 8.536 0.830 -15.997 1.00 0.00 C ATOM 1563 CE1 PHE A 106 10.247 2.308 -17.551 1.00 0.00 C ATOM 1564 CE2 PHE A 106 9.137 1.953 -15.482 1.00 0.00 C ATOM 1565 CZ PHE A 106 9.993 2.692 -16.259 1.00 0.00 C ATOM 0 H PHE A 106 10.266 -2.114 -18.319 1.00 0.00 H new ATOM 0 HA PHE A 106 8.618 -1.863 -16.064 1.00 0.00 H new ATOM 0 HB2 PHE A 106 8.382 -0.878 -18.908 1.00 0.00 H new ATOM 0 HB3 PHE A 106 7.049 -0.675 -17.789 1.00 0.00 H new ATOM 0 HD1 PHE A 106 9.850 0.889 -19.084 1.00 0.00 H new ATOM 0 HD2 PHE A 106 7.864 0.251 -15.380 1.00 0.00 H new ATOM 0 HE1 PHE A 106 10.920 2.889 -18.164 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.935 2.254 -14.465 1.00 0.00 H new ATOM 0 HZ PHE A 106 10.466 3.574 -15.854 1.00 0.00 H new ATOM 1575 N ARG A 107 7.618 -3.835 -18.549 1.00 0.00 N ATOM 1576 CA ARG A 107 6.654 -4.846 -18.913 1.00 0.00 C ATOM 1577 C ARG A 107 6.696 -5.980 -17.915 1.00 0.00 C ATOM 1578 O ARG A 107 5.663 -6.540 -17.557 1.00 0.00 O ATOM 1579 CB ARG A 107 6.917 -5.439 -20.313 1.00 0.00 C ATOM 1580 CG ARG A 107 5.805 -6.384 -20.781 1.00 0.00 C ATOM 1581 CD ARG A 107 6.131 -7.061 -22.117 1.00 0.00 C ATOM 1582 NE ARG A 107 7.241 -8.034 -21.894 1.00 0.00 N ATOM 1583 CZ ARG A 107 7.787 -8.713 -22.948 1.00 0.00 C ATOM 1584 NH1 ARG A 107 7.319 -8.505 -24.213 1.00 0.00 N ATOM 1585 NH2 ARG A 107 8.799 -9.602 -22.730 1.00 0.00 N ATOM 0 H ARG A 107 8.378 -3.711 -19.218 1.00 0.00 H new ATOM 0 HA ARG A 107 5.680 -4.357 -18.919 1.00 0.00 H new ATOM 0 HB2 ARG A 107 7.022 -4.626 -21.032 1.00 0.00 H new ATOM 0 HB3 ARG A 107 7.864 -5.979 -20.301 1.00 0.00 H new ATOM 0 HG2 ARG A 107 5.639 -7.148 -20.022 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.875 -5.824 -20.879 1.00 0.00 H new ATOM 0 HD2 ARG A 107 5.251 -7.572 -22.508 1.00 0.00 H new ATOM 0 HD3 ARG A 107 6.422 -6.317 -22.858 1.00 0.00 H new ATOM 0 HE ARG A 107 7.594 -8.193 -20.950 1.00 0.00 H new ATOM 0 HH11 ARG A 107 6.561 -7.842 -24.374 1.00 0.00 H new ATOM 0 HH12 ARG A 107 7.728 -9.012 -24.998 1.00 0.00 H new ATOM 0 HH21 ARG A 107 9.146 -9.758 -21.783 1.00 0.00 H new ATOM 0 HH22 ARG A 107 9.209 -10.110 -23.514 1.00 0.00 H new ATOM 1599 N SER A 108 7.905 -6.339 -17.435 1.00 0.00 N ATOM 1600 CA SER A 108 8.035 -7.460 -16.529 1.00 0.00 C ATOM 1601 C SER A 108 7.779 -7.049 -15.100 1.00 0.00 C ATOM 1602 O SER A 108 7.768 -7.909 -14.221 1.00 0.00 O ATOM 1603 CB SER A 108 9.438 -8.095 -16.574 1.00 0.00 C ATOM 1604 OG SER A 108 9.711 -8.591 -17.878 1.00 0.00 O ATOM 0 H SER A 108 8.780 -5.868 -17.664 1.00 0.00 H new ATOM 0 HA SER A 108 7.292 -8.185 -16.862 1.00 0.00 H new ATOM 0 HB2 SER A 108 10.189 -7.356 -16.294 1.00 0.00 H new ATOM 0 HB3 SER A 108 9.502 -8.906 -15.848 1.00 0.00 H new ATOM 0 HG SER A 108 9.947 -7.846 -18.469 1.00 0.00 H new ATOM 1610 N THR A 109 7.573 -5.744 -14.809 1.00 0.00 N ATOM 1611 CA THR A 109 7.344 -5.350 -13.435 1.00 0.00 C ATOM 1612 C THR A 109 5.971 -4.760 -13.309 1.00 0.00 C ATOM 1613 O THR A 109 5.054 -5.397 -12.795 1.00 0.00 O ATOM 1614 CB THR A 109 8.339 -4.336 -12.921 1.00 0.00 C ATOM 1615 OG1 THR A 109 8.558 -3.304 -13.876 1.00 0.00 O ATOM 1616 CG2 THR A 109 9.663 -5.055 -12.614 1.00 0.00 C ATOM 0 H THR A 109 7.564 -4.985 -15.491 1.00 0.00 H new ATOM 0 HA THR A 109 7.457 -6.254 -12.836 1.00 0.00 H new ATOM 0 HB THR A 109 7.942 -3.875 -12.017 1.00 0.00 H new ATOM 0 HG1 THR A 109 9.024 -3.673 -14.655 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.391 -4.334 -12.242 1.00 0.00 H new ATOM 0 HG22 THR A 109 9.494 -5.822 -11.859 1.00 0.00 H new ATOM 0 HG23 THR A 109 10.044 -5.519 -13.524 1.00 0.00 H new ATOM 1624 N MET A 110 5.808 -3.507 -13.773 1.00 0.00 N ATOM 1625 CA MET A 110 4.537 -2.832 -13.670 1.00 0.00 C ATOM 1626 C MET A 110 3.548 -3.466 -14.603 1.00 0.00 C ATOM 1627 O MET A 110 2.350 -3.485 -14.326 1.00 0.00 O ATOM 1628 CB MET A 110 4.625 -1.344 -14.044 1.00 0.00 C ATOM 1629 CG MET A 110 5.401 -0.516 -13.017 1.00 0.00 C ATOM 1630 SD MET A 110 5.681 1.191 -13.570 1.00 0.00 S ATOM 1631 CE MET A 110 3.925 1.649 -13.518 1.00 0.00 C ATOM 0 H MET A 110 6.545 -2.960 -14.217 1.00 0.00 H new ATOM 0 HA MET A 110 4.227 -2.918 -12.629 1.00 0.00 H new ATOM 0 HB2 MET A 110 5.105 -1.247 -15.018 1.00 0.00 H new ATOM 0 HB3 MET A 110 3.618 -0.939 -14.143 1.00 0.00 H new ATOM 0 HG2 MET A 110 4.852 -0.504 -12.075 1.00 0.00 H new ATOM 0 HG3 MET A 110 6.361 -0.993 -12.821 1.00 0.00 H new ATOM 0 HE1 MET A 110 3.831 2.699 -13.241 1.00 0.00 H new ATOM 0 HE2 MET A 110 3.479 1.492 -14.500 1.00 0.00 H new ATOM 0 HE3 MET A 110 3.410 1.032 -12.782 1.00 0.00 H new ATOM 1641 N GLY A 111 4.026 -3.996 -15.746 1.00 0.00 N ATOM 1642 CA GLY A 111 3.125 -4.602 -16.694 1.00 0.00 C ATOM 1643 C GLY A 111 2.468 -3.499 -17.463 1.00 0.00 C ATOM 1644 O GLY A 111 1.440 -3.698 -18.105 1.00 0.00 O ATOM 0 H GLY A 111 5.010 -4.008 -16.014 1.00 0.00 H new ATOM 0 HA2 GLY A 111 3.667 -5.267 -17.366 1.00 0.00 H new ATOM 0 HA3 GLY A 111 2.379 -5.208 -16.180 1.00 0.00 H new ATOM 1648 N THR A 112 3.071 -2.293 -17.412 1.00 0.00 N ATOM 1649 CA THR A 112 2.524 -1.158 -18.096 1.00 0.00 C ATOM 1650 C THR A 112 3.524 -0.771 -19.146 1.00 0.00 C ATOM 1651 O THR A 112 4.702 -0.584 -18.857 1.00 0.00 O ATOM 1652 CB THR A 112 2.310 0.014 -17.173 1.00 0.00 C ATOM 1653 OG1 THR A 112 1.427 -0.353 -16.123 1.00 0.00 O ATOM 1654 CG2 THR A 112 1.710 1.181 -17.966 1.00 0.00 C ATOM 0 H THR A 112 3.933 -2.105 -16.900 1.00 0.00 H new ATOM 0 HA THR A 112 1.552 -1.420 -18.514 1.00 0.00 H new ATOM 0 HB THR A 112 3.266 0.316 -16.745 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.293 0.412 -15.526 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.554 2.031 -17.301 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.393 1.467 -18.766 1.00 0.00 H new ATOM 0 HG23 THR A 112 0.756 0.876 -18.396 1.00 0.00 H new ATOM 1662 N VAL A 113 3.057 -0.633 -20.408 1.00 0.00 N ATOM 1663 CA VAL A 113 3.943 -0.292 -21.500 1.00 0.00 C ATOM 1664 C VAL A 113 3.945 1.209 -21.691 1.00 0.00 C ATOM 1665 O VAL A 113 4.226 1.711 -22.780 1.00 0.00 O ATOM 1666 CB VAL A 113 3.545 -0.971 -22.792 1.00 0.00 C ATOM 1667 CG1 VAL A 113 2.262 -0.314 -23.345 1.00 0.00 C ATOM 1668 CG2 VAL A 113 4.728 -0.899 -23.780 1.00 0.00 C ATOM 0 H VAL A 113 2.080 -0.755 -20.675 1.00 0.00 H new ATOM 0 HA VAL A 113 4.942 -0.643 -21.242 1.00 0.00 H new ATOM 0 HB VAL A 113 3.318 -2.024 -22.627 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.975 -0.803 -24.276 1.00 0.00 H new ATOM 0 HG12 VAL A 113 1.457 -0.418 -22.617 1.00 0.00 H new ATOM 0 HG13 VAL A 113 2.447 0.744 -23.533 1.00 0.00 H new ATOM 0 HG21 VAL A 113 4.451 -1.386 -24.715 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.977 0.144 -23.974 1.00 0.00 H new ATOM 0 HG23 VAL A 113 5.593 -1.404 -23.350 1.00 0.00 H new ATOM 1678 N ASN A 114 3.645 1.976 -20.619 1.00 0.00 N ATOM 1679 CA ASN A 114 3.632 3.417 -20.731 1.00 0.00 C ATOM 1680 C ASN A 114 5.055 3.858 -20.959 1.00 0.00 C ATOM 1681 O ASN A 114 5.951 3.552 -20.174 1.00 0.00 O ATOM 1682 CB ASN A 114 3.089 4.119 -19.465 1.00 0.00 C ATOM 1683 CG ASN A 114 2.858 5.608 -19.670 1.00 0.00 C ATOM 1684 OD1 ASN A 114 3.081 6.141 -20.752 1.00 0.00 O ATOM 1685 ND2 ASN A 114 2.395 6.304 -18.602 1.00 0.00 N ATOM 0 H ASN A 114 3.416 1.613 -19.694 1.00 0.00 H new ATOM 0 HA ASN A 114 2.969 3.693 -21.551 1.00 0.00 H new ATOM 0 HB2 ASN A 114 2.152 3.648 -19.168 1.00 0.00 H new ATOM 0 HB3 ASN A 114 3.793 3.975 -18.645 1.00 0.00 H new ATOM 0 HD21 ASN A 114 2.220 7.306 -18.683 1.00 0.00 H new ATOM 0 HD22 ASN A 114 2.221 5.826 -17.718 1.00 0.00 H new ATOM 1692 N ARG A 115 5.278 4.626 -22.049 1.00 0.00 N ATOM 1693 CA ARG A 115 6.605 5.081 -22.381 1.00 0.00 C ATOM 1694 C ARG A 115 6.794 6.465 -21.825 1.00 0.00 C ATOM 1695 O ARG A 115 7.735 7.162 -22.191 1.00 0.00 O ATOM 1696 CB ARG A 115 6.851 5.142 -23.901 1.00 0.00 C ATOM 1697 CG ARG A 115 6.837 3.757 -24.555 1.00 0.00 C ATOM 1698 CD ARG A 115 7.065 3.825 -26.066 1.00 0.00 C ATOM 1699 NE ARG A 115 7.015 2.437 -26.612 1.00 0.00 N ATOM 1700 CZ ARG A 115 7.186 2.215 -27.950 1.00 0.00 C ATOM 1701 NH1 ARG A 115 7.409 3.262 -28.795 1.00 0.00 N ATOM 1702 NH2 ARG A 115 7.134 0.943 -28.439 1.00 0.00 N ATOM 0 H ARG A 115 4.550 4.930 -22.695 1.00 0.00 H new ATOM 0 HA ARG A 115 7.309 4.367 -21.953 1.00 0.00 H new ATOM 0 HB2 ARG A 115 6.087 5.766 -24.364 1.00 0.00 H new ATOM 0 HB3 ARG A 115 7.812 5.620 -24.091 1.00 0.00 H new ATOM 0 HG2 ARG A 115 7.609 3.136 -24.101 1.00 0.00 H new ATOM 0 HG3 ARG A 115 5.881 3.273 -24.356 1.00 0.00 H new ATOM 0 HD2 ARG A 115 6.303 4.446 -26.537 1.00 0.00 H new ATOM 0 HD3 ARG A 115 8.029 4.284 -26.284 1.00 0.00 H new ATOM 0 HE ARG A 115 6.852 1.650 -25.984 1.00 0.00 H new ATOM 0 HH11 ARG A 115 7.449 4.213 -28.429 1.00 0.00 H new ATOM 0 HH12 ARG A 115 7.536 3.094 -29.793 1.00 0.00 H new ATOM 0 HH21 ARG A 115 6.968 0.160 -27.807 1.00 0.00 H new ATOM 0 HH22 ARG A 115 7.261 0.775 -29.437 1.00 0.00 H new ATOM 1716 N GLN A 116 5.883 6.904 -20.931 1.00 0.00 N ATOM 1717 CA GLN A 116 5.992 8.221 -20.347 1.00 0.00 C ATOM 1718 C GLN A 116 7.264 8.304 -19.542 1.00 0.00 C ATOM 1719 O GLN A 116 7.968 9.311 -19.587 1.00 0.00 O ATOM 1720 CB GLN A 116 4.814 8.557 -19.413 1.00 0.00 C ATOM 1721 CG GLN A 116 4.883 9.984 -18.848 1.00 0.00 C ATOM 1722 CD GLN A 116 3.642 10.227 -17.999 1.00 0.00 C ATOM 1723 OE1 GLN A 116 2.702 9.435 -18.005 1.00 0.00 O ATOM 1724 NE2 GLN A 116 3.638 11.349 -17.238 1.00 0.00 N ATOM 0 H GLN A 116 5.081 6.360 -20.613 1.00 0.00 H new ATOM 0 HA GLN A 116 5.988 8.935 -21.170 1.00 0.00 H new ATOM 0 HB2 GLN A 116 3.878 8.433 -19.958 1.00 0.00 H new ATOM 0 HB3 GLN A 116 4.798 7.846 -18.587 1.00 0.00 H new ATOM 0 HG2 GLN A 116 5.784 10.111 -18.247 1.00 0.00 H new ATOM 0 HG3 GLN A 116 4.936 10.711 -19.659 1.00 0.00 H new ATOM 0 HE21 GLN A 116 4.437 11.983 -17.260 1.00 0.00 H new ATOM 0 HE22 GLN A 116 2.836 11.559 -16.644 1.00 0.00 H new ATOM 1733 N PHE A 117 7.594 7.231 -18.785 1.00 0.00 N ATOM 1734 CA PHE A 117 8.790 7.244 -17.969 1.00 0.00 C ATOM 1735 C PHE A 117 9.982 7.285 -18.877 1.00 0.00 C ATOM 1736 O PHE A 117 10.927 8.030 -18.649 1.00 0.00 O ATOM 1737 CB PHE A 117 8.951 5.980 -17.103 1.00 0.00 C ATOM 1738 CG PHE A 117 7.825 5.742 -16.162 1.00 0.00 C ATOM 1739 CD1 PHE A 117 6.761 4.970 -16.559 1.00 0.00 C ATOM 1740 CD2 PHE A 117 7.834 6.277 -14.891 1.00 0.00 C ATOM 1741 CE1 PHE A 117 5.713 4.732 -15.702 1.00 0.00 C ATOM 1742 CE2 PHE A 117 6.786 6.040 -14.032 1.00 0.00 C ATOM 1743 CZ PHE A 117 5.726 5.268 -14.438 1.00 0.00 C ATOM 0 H PHE A 117 7.049 6.370 -18.735 1.00 0.00 H new ATOM 0 HA PHE A 117 8.710 8.111 -17.313 1.00 0.00 H new ATOM 0 HB2 PHE A 117 9.052 5.114 -17.758 1.00 0.00 H new ATOM 0 HB3 PHE A 117 9.877 6.059 -16.533 1.00 0.00 H new ATOM 0 HD1 PHE A 117 6.748 4.546 -17.552 1.00 0.00 H new ATOM 0 HD2 PHE A 117 8.667 6.884 -14.569 1.00 0.00 H new ATOM 0 HE1 PHE A 117 4.880 4.124 -16.023 1.00 0.00 H new ATOM 0 HE2 PHE A 117 6.797 6.462 -13.038 1.00 0.00 H new ATOM 0 HZ PHE A 117 4.903 5.082 -13.764 1.00 0.00 H new ATOM 1753 N ILE A 118 9.935 6.477 -19.955 1.00 0.00 N ATOM 1754 CA ILE A 118 11.036 6.406 -20.892 1.00 0.00 C ATOM 1755 C ILE A 118 11.235 7.762 -21.522 1.00 0.00 C ATOM 1756 O ILE A 118 12.361 8.243 -21.647 1.00 0.00 O ATOM 1757 CB ILE A 118 10.785 5.404 -21.993 1.00 0.00 C ATOM 1758 CG1 ILE A 118 10.748 3.981 -21.409 1.00 0.00 C ATOM 1759 CG2 ILE A 118 11.888 5.558 -23.060 1.00 0.00 C ATOM 1760 CD1 ILE A 118 10.231 2.944 -22.410 1.00 0.00 C ATOM 0 H ILE A 118 9.145 5.874 -20.184 1.00 0.00 H new ATOM 0 HA ILE A 118 11.919 6.090 -20.337 1.00 0.00 H new ATOM 0 HB ILE A 118 9.819 5.586 -22.463 1.00 0.00 H new ATOM 0 HG12 ILE A 118 11.750 3.699 -21.086 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.113 3.973 -20.523 1.00 0.00 H new ATOM 0 HG21 ILE A 118 11.720 4.840 -23.863 1.00 0.00 H new ATOM 0 HG22 ILE A 118 11.863 6.569 -23.466 1.00 0.00 H new ATOM 0 HG23 ILE A 118 12.862 5.374 -22.606 1.00 0.00 H new ATOM 0 HD11 ILE A 118 10.227 1.959 -21.944 1.00 0.00 H new ATOM 0 HD12 ILE A 118 9.218 3.206 -22.714 1.00 0.00 H new ATOM 0 HD13 ILE A 118 10.880 2.928 -23.285 1.00 0.00 H new ATOM 1772 N THR A 119 10.126 8.408 -21.929 1.00 0.00 N ATOM 1773 CA THR A 119 10.200 9.704 -22.569 1.00 0.00 C ATOM 1774 C THR A 119 10.781 10.711 -21.609 1.00 0.00 C ATOM 1775 O THR A 119 11.646 11.504 -21.982 1.00 0.00 O ATOM 1776 CB THR A 119 8.850 10.213 -23.008 1.00 0.00 C ATOM 1777 OG1 THR A 119 8.271 9.309 -23.941 1.00 0.00 O ATOM 1778 CG2 THR A 119 9.015 11.596 -23.661 1.00 0.00 C ATOM 0 H THR A 119 9.180 8.043 -21.820 1.00 0.00 H new ATOM 0 HA THR A 119 10.828 9.581 -23.451 1.00 0.00 H new ATOM 0 HB THR A 119 8.195 10.294 -22.140 1.00 0.00 H new ATOM 0 HG1 THR A 119 8.020 8.481 -23.481 1.00 0.00 H new ATOM 0 HG21 THR A 119 8.041 11.967 -23.979 1.00 0.00 H new ATOM 0 HG22 THR A 119 9.449 12.289 -22.940 1.00 0.00 H new ATOM 0 HG23 THR A 119 9.672 11.514 -24.527 1.00 0.00 H new ATOM 1786 N GLU A 120 10.316 10.706 -20.339 1.00 0.00 N ATOM 1787 CA GLU A 120 10.811 11.661 -19.369 1.00 0.00 C ATOM 1788 C GLU A 120 12.278 11.421 -19.126 1.00 0.00 C ATOM 1789 O GLU A 120 13.052 12.369 -19.020 1.00 0.00 O ATOM 1790 CB GLU A 120 10.079 11.581 -18.014 1.00 0.00 C ATOM 1791 CG GLU A 120 8.634 12.099 -18.098 1.00 0.00 C ATOM 1792 CD GLU A 120 7.928 11.839 -16.772 1.00 0.00 C ATOM 1793 OE1 GLU A 120 8.508 11.120 -15.915 1.00 0.00 O ATOM 1794 OE2 GLU A 120 6.789 12.354 -16.604 1.00 0.00 O ATOM 0 H GLU A 120 9.613 10.058 -19.984 1.00 0.00 H new ATOM 0 HA GLU A 120 10.632 12.650 -19.790 1.00 0.00 H new ATOM 0 HB2 GLU A 120 10.072 10.547 -17.668 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.628 12.162 -17.273 1.00 0.00 H new ATOM 0 HG2 GLU A 120 8.630 13.166 -18.322 1.00 0.00 H new ATOM 0 HG3 GLU A 120 8.103 11.601 -18.910 1.00 0.00 H new ATOM 1801 N ILE A 121 12.696 10.140 -19.031 1.00 0.00 N ATOM 1802 CA ILE A 121 14.088 9.831 -18.794 1.00 0.00 C ATOM 1803 C ILE A 121 14.908 10.333 -19.952 1.00 0.00 C ATOM 1804 O ILE A 121 15.960 10.935 -19.760 1.00 0.00 O ATOM 1805 CB ILE A 121 14.341 8.351 -18.631 1.00 0.00 C ATOM 1806 CG1 ILE A 121 13.714 7.855 -17.315 1.00 0.00 C ATOM 1807 CG2 ILE A 121 15.863 8.100 -18.670 1.00 0.00 C ATOM 1808 CD1 ILE A 121 13.668 6.329 -17.224 1.00 0.00 C ATOM 0 H ILE A 121 12.086 9.327 -19.116 1.00 0.00 H new ATOM 0 HA ILE A 121 14.371 10.320 -17.862 1.00 0.00 H new ATOM 0 HB ILE A 121 13.877 7.793 -19.444 1.00 0.00 H new ATOM 0 HG12 ILE A 121 14.285 8.248 -16.474 1.00 0.00 H new ATOM 0 HG13 ILE A 121 12.702 8.251 -17.227 1.00 0.00 H new ATOM 0 HG21 ILE A 121 16.059 7.034 -18.553 1.00 0.00 H new ATOM 0 HG22 ILE A 121 16.264 8.440 -19.625 1.00 0.00 H new ATOM 0 HG23 ILE A 121 16.343 8.648 -17.859 1.00 0.00 H new ATOM 0 HD11 ILE A 121 13.217 6.034 -16.277 1.00 0.00 H new ATOM 0 HD12 ILE A 121 13.074 5.933 -18.048 1.00 0.00 H new ATOM 0 HD13 ILE A 121 14.681 5.930 -17.283 1.00 0.00 H new ATOM 1820 N LYS A 122 14.434 10.094 -21.190 1.00 0.00 N ATOM 1821 CA LYS A 122 15.163 10.523 -22.366 1.00 0.00 C ATOM 1822 C LYS A 122 15.267 12.030 -22.381 1.00 0.00 C ATOM 1823 O LYS A 122 16.322 12.585 -22.695 1.00 0.00 O ATOM 1824 CB LYS A 122 14.495 10.071 -23.679 1.00 0.00 C ATOM 1825 CG LYS A 122 15.300 10.463 -24.923 1.00 0.00 C ATOM 1826 CD LYS A 122 14.757 9.819 -26.204 1.00 0.00 C ATOM 1827 CE LYS A 122 13.418 10.414 -26.653 1.00 0.00 C ATOM 1828 NZ LYS A 122 13.604 11.805 -27.119 1.00 0.00 N ATOM 0 H LYS A 122 13.557 9.610 -21.385 1.00 0.00 H new ATOM 0 HA LYS A 122 16.148 10.060 -22.309 1.00 0.00 H new ATOM 0 HB2 LYS A 122 14.367 8.989 -23.662 1.00 0.00 H new ATOM 0 HB3 LYS A 122 13.499 10.509 -23.744 1.00 0.00 H new ATOM 0 HG2 LYS A 122 15.287 11.547 -25.032 1.00 0.00 H new ATOM 0 HG3 LYS A 122 16.340 10.169 -24.786 1.00 0.00 H new ATOM 0 HD2 LYS A 122 15.488 9.940 -27.003 1.00 0.00 H new ATOM 0 HD3 LYS A 122 14.636 8.748 -26.042 1.00 0.00 H new ATOM 0 HE2 LYS A 122 12.994 9.809 -27.454 1.00 0.00 H new ATOM 0 HE3 LYS A 122 12.707 10.392 -25.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 12.749 12.121 -27.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 13.775 12.425 -26.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 14.419 11.849 -27.763 1.00 0.00 H new ATOM 1842 N HIS A 123 14.161 12.732 -22.053 1.00 0.00 N ATOM 1843 CA HIS A 123 14.179 14.180 -22.063 1.00 0.00 C ATOM 1844 C HIS A 123 15.121 14.685 -21.001 1.00 0.00 C ATOM 1845 O HIS A 123 15.883 15.619 -21.239 1.00 0.00 O ATOM 1846 CB HIS A 123 12.796 14.806 -21.800 1.00 0.00 C ATOM 1847 CG HIS A 123 11.845 14.673 -22.956 1.00 0.00 C ATOM 1848 ND1 HIS A 123 10.511 15.012 -22.796 1.00 0.00 N ATOM 1849 CD2 HIS A 123 12.081 14.257 -24.233 1.00 0.00 C ATOM 1850 CE1 HIS A 123 9.969 14.796 -23.981 1.00 0.00 C ATOM 1851 NE2 HIS A 123 10.871 14.340 -24.883 1.00 0.00 N ATOM 0 H HIS A 123 13.270 12.315 -21.785 1.00 0.00 H new ATOM 0 HA HIS A 123 14.502 14.473 -23.062 1.00 0.00 H new ATOM 0 HB2 HIS A 123 12.355 14.335 -20.921 1.00 0.00 H new ATOM 0 HB3 HIS A 123 12.924 15.863 -21.565 1.00 0.00 H new ATOM 0 HD2 HIS A 123 13.023 13.930 -24.648 1.00 0.00 H new ATOM 0 HE1 HIS A 123 8.926 14.964 -24.205 1.00 0.00 H new ATOM 0 HE2 HIS A 123 10.688 14.103 -25.858 1.00 0.00 H new ATOM 1859 N LEU A 124 15.096 14.068 -19.799 1.00 0.00 N ATOM 1860 CA LEU A 124 15.971 14.499 -18.730 1.00 0.00 C ATOM 1861 C LEU A 124 17.393 14.213 -19.118 1.00 0.00 C ATOM 1862 O LEU A 124 18.294 14.992 -18.828 1.00 0.00 O ATOM 1863 CB LEU A 124 15.686 13.808 -17.381 1.00 0.00 C ATOM 1864 CG LEU A 124 14.358 14.262 -16.752 1.00 0.00 C ATOM 1865 CD1 LEU A 124 13.994 13.397 -15.535 1.00 0.00 C ATOM 1866 CD2 LEU A 124 14.393 15.756 -16.385 1.00 0.00 C ATOM 0 H LEU A 124 14.485 13.286 -19.564 1.00 0.00 H new ATOM 0 HA LEU A 124 15.792 15.565 -18.591 1.00 0.00 H new ATOM 0 HB2 LEU A 124 15.664 12.728 -17.528 1.00 0.00 H new ATOM 0 HB3 LEU A 124 16.502 14.019 -16.690 1.00 0.00 H new ATOM 0 HG LEU A 124 13.577 14.126 -17.500 1.00 0.00 H new ATOM 0 HD11 LEU A 124 13.051 13.742 -15.112 1.00 0.00 H new ATOM 0 HD12 LEU A 124 13.894 12.357 -15.845 1.00 0.00 H new ATOM 0 HD13 LEU A 124 14.779 13.477 -14.783 1.00 0.00 H new ATOM 0 HD21 LEU A 124 13.439 16.044 -15.943 1.00 0.00 H new ATOM 0 HD22 LEU A 124 15.194 15.936 -15.668 1.00 0.00 H new ATOM 0 HD23 LEU A 124 14.570 16.347 -17.283 1.00 0.00 H new ATOM 1878 N MET A 125 17.616 13.068 -19.795 1.00 0.00 N ATOM 1879 CA MET A 125 18.945 12.686 -20.213 1.00 0.00 C ATOM 1880 C MET A 125 19.479 13.750 -21.133 1.00 0.00 C ATOM 1881 O MET A 125 20.638 14.139 -21.035 1.00 0.00 O ATOM 1882 CB MET A 125 18.956 11.349 -20.981 1.00 0.00 C ATOM 1883 CG MET A 125 20.367 10.856 -21.324 1.00 0.00 C ATOM 1884 SD MET A 125 20.357 9.333 -22.319 1.00 0.00 S ATOM 1885 CE MET A 125 19.686 8.276 -21.003 1.00 0.00 C ATOM 0 H MET A 125 16.884 12.406 -20.054 1.00 0.00 H new ATOM 0 HA MET A 125 19.555 12.572 -19.317 1.00 0.00 H new ATOM 0 HB2 MET A 125 18.449 10.591 -20.384 1.00 0.00 H new ATOM 0 HB3 MET A 125 18.385 11.463 -21.902 1.00 0.00 H new ATOM 0 HG2 MET A 125 20.898 11.637 -21.868 1.00 0.00 H new ATOM 0 HG3 MET A 125 20.920 10.679 -20.401 1.00 0.00 H new ATOM 0 HE1 MET A 125 19.952 7.237 -21.199 1.00 0.00 H new ATOM 0 HE2 MET A 125 20.102 8.582 -20.043 1.00 0.00 H new ATOM 0 HE3 MET A 125 18.601 8.374 -20.976 1.00 0.00 H new ATOM 1895 N THR A 126 18.628 14.241 -22.055 1.00 0.00 N ATOM 1896 CA THR A 126 19.048 15.259 -22.994 1.00 0.00 C ATOM 1897 C THR A 126 19.369 16.528 -22.245 1.00 0.00 C ATOM 1898 O THR A 126 20.363 17.192 -22.534 1.00 0.00 O ATOM 1899 CB THR A 126 17.989 15.581 -24.021 1.00 0.00 C ATOM 1900 OG1 THR A 126 17.664 14.413 -24.766 1.00 0.00 O ATOM 1901 CG2 THR A 126 18.517 16.672 -24.969 1.00 0.00 C ATOM 0 H THR A 126 17.658 13.942 -22.157 1.00 0.00 H new ATOM 0 HA THR A 126 19.921 14.865 -23.515 1.00 0.00 H new ATOM 0 HB THR A 126 17.092 15.938 -23.516 1.00 0.00 H new ATOM 0 HG1 THR A 126 17.227 13.762 -24.179 1.00 0.00 H new ATOM 0 HG21 THR A 126 17.756 16.908 -25.712 1.00 0.00 H new ATOM 0 HG22 THR A 126 18.754 17.568 -24.396 1.00 0.00 H new ATOM 0 HG23 THR A 126 19.416 16.314 -25.471 1.00 0.00 H new ATOM 1909 N MET A 127 18.523 16.898 -21.256 1.00 0.00 N ATOM 1910 CA MET A 127 18.743 18.118 -20.504 1.00 0.00 C ATOM 1911 C MET A 127 20.034 18.022 -19.733 1.00 0.00 C ATOM 1912 O MET A 127 20.803 18.983 -19.675 1.00 0.00 O ATOM 1913 CB MET A 127 17.621 18.404 -19.487 1.00 0.00 C ATOM 1914 CG MET A 127 16.290 18.764 -20.153 1.00 0.00 C ATOM 1915 SD MET A 127 14.946 18.996 -18.952 1.00 0.00 S ATOM 1916 CE MET A 127 13.649 19.215 -20.202 1.00 0.00 C ATOM 0 H MET A 127 17.699 16.367 -20.976 1.00 0.00 H new ATOM 0 HA MET A 127 18.769 18.925 -21.236 1.00 0.00 H new ATOM 0 HB2 MET A 127 17.479 17.528 -18.854 1.00 0.00 H new ATOM 0 HB3 MET A 127 17.928 19.222 -18.835 1.00 0.00 H new ATOM 0 HG2 MET A 127 16.414 19.678 -20.734 1.00 0.00 H new ATOM 0 HG3 MET A 127 16.014 17.976 -20.854 1.00 0.00 H new ATOM 0 HE1 MET A 127 12.691 19.380 -19.708 1.00 0.00 H new ATOM 0 HE2 MET A 127 13.888 20.076 -20.827 1.00 0.00 H new ATOM 0 HE3 MET A 127 13.588 18.321 -20.823 1.00 0.00 H new ATOM 1926 N PHE A 128 20.304 16.851 -19.123 1.00 0.00 N ATOM 1927 CA PHE A 128 21.509 16.689 -18.341 1.00 0.00 C ATOM 1928 C PHE A 128 22.684 16.642 -19.270 1.00 0.00 C ATOM 1929 O PHE A 128 23.761 17.133 -18.946 1.00 0.00 O ATOM 1930 CB PHE A 128 21.524 15.406 -17.484 1.00 0.00 C ATOM 1931 CG PHE A 128 20.687 15.498 -16.249 1.00 0.00 C ATOM 1932 CD1 PHE A 128 19.576 14.696 -16.087 1.00 0.00 C ATOM 1933 CD2 PHE A 128 21.013 16.395 -15.253 1.00 0.00 C ATOM 1934 CE1 PHE A 128 18.807 14.790 -14.950 1.00 0.00 C ATOM 1935 CE2 PHE A 128 20.243 16.487 -14.117 1.00 0.00 C ATOM 1936 CZ PHE A 128 19.141 15.685 -13.966 1.00 0.00 C ATOM 0 H PHE A 128 19.705 16.026 -19.165 1.00 0.00 H new ATOM 0 HA PHE A 128 21.554 17.537 -17.657 1.00 0.00 H new ATOM 0 HB2 PHE A 128 21.172 14.571 -18.090 1.00 0.00 H new ATOM 0 HB3 PHE A 128 22.552 15.182 -17.200 1.00 0.00 H new ATOM 0 HD1 PHE A 128 19.308 13.989 -16.858 1.00 0.00 H new ATOM 0 HD2 PHE A 128 21.879 17.030 -15.366 1.00 0.00 H new ATOM 0 HE1 PHE A 128 17.939 14.158 -14.832 1.00 0.00 H new ATOM 0 HE2 PHE A 128 20.507 17.192 -13.343 1.00 0.00 H new ATOM 0 HZ PHE A 128 18.537 15.758 -13.074 1.00 0.00 H new ATOM 1946 N ALA A 129 22.497 16.031 -20.456 1.00 0.00 N ATOM 1947 CA ALA A 129 23.563 15.920 -21.416 1.00 0.00 C ATOM 1948 C ALA A 129 23.993 17.290 -21.855 1.00 0.00 C ATOM 1949 O ALA A 129 25.182 17.558 -22.000 1.00 0.00 O ATOM 1950 CB ALA A 129 23.142 15.132 -22.666 1.00 0.00 C ATOM 0 H ALA A 129 21.614 15.615 -20.752 1.00 0.00 H new ATOM 0 HA ALA A 129 24.378 15.387 -20.925 1.00 0.00 H new ATOM 0 HB1 ALA A 129 23.980 15.076 -23.360 1.00 0.00 H new ATOM 0 HB2 ALA A 129 22.842 14.125 -22.377 1.00 0.00 H new ATOM 0 HB3 ALA A 129 22.304 15.636 -23.149 1.00 0.00 H new ATOM 1956 N ALA A 130 23.021 18.193 -22.089 1.00 0.00 N ATOM 1957 CA ALA A 130 23.345 19.531 -22.527 1.00 0.00 C ATOM 1958 C ALA A 130 24.118 20.245 -21.450 1.00 0.00 C ATOM 1959 O ALA A 130 25.094 20.940 -21.731 1.00 0.00 O ATOM 1960 CB ALA A 130 22.095 20.370 -22.852 1.00 0.00 C ATOM 0 H ALA A 130 22.024 18.008 -21.979 1.00 0.00 H new ATOM 0 HA ALA A 130 23.934 19.426 -23.438 1.00 0.00 H new ATOM 0 HB1 ALA A 130 22.399 21.365 -23.176 1.00 0.00 H new ATOM 0 HB2 ALA A 130 21.529 19.886 -23.648 1.00 0.00 H new ATOM 0 HB3 ALA A 130 21.471 20.453 -21.962 1.00 0.00 H new ATOM 1966 N GLU A 131 23.690 20.086 -20.182 1.00 0.00 N ATOM 1967 CA GLU A 131 24.357 20.752 -19.085 1.00 0.00 C ATOM 1968 C GLU A 131 25.747 20.194 -18.922 1.00 0.00 C ATOM 1969 O GLU A 131 26.708 20.940 -18.736 1.00 0.00 O ATOM 1970 CB GLU A 131 23.610 20.578 -17.746 1.00 0.00 C ATOM 1971 CG GLU A 131 24.276 21.337 -16.583 1.00 0.00 C ATOM 1972 CD GLU A 131 23.441 21.148 -15.321 1.00 0.00 C ATOM 1973 OE1 GLU A 131 22.411 20.423 -15.389 1.00 0.00 O ATOM 1974 OE2 GLU A 131 23.822 21.729 -14.273 1.00 0.00 O ATOM 0 H GLU A 131 22.895 19.507 -19.911 1.00 0.00 H new ATOM 0 HA GLU A 131 24.383 21.814 -19.330 1.00 0.00 H new ATOM 0 HB2 GLU A 131 22.584 20.927 -17.861 1.00 0.00 H new ATOM 0 HB3 GLU A 131 23.560 19.517 -17.499 1.00 0.00 H new ATOM 0 HG2 GLU A 131 25.289 20.966 -16.423 1.00 0.00 H new ATOM 0 HG3 GLU A 131 24.359 22.397 -16.824 1.00 0.00 H new ATOM 1981 N ALA A 132 25.876 18.855 -18.988 1.00 0.00 N ATOM 1982 CA ALA A 132 27.163 18.219 -18.822 1.00 0.00 C ATOM 1983 C ALA A 132 28.075 18.614 -19.952 1.00 0.00 C ATOM 1984 O ALA A 132 29.257 18.867 -19.743 1.00 0.00 O ATOM 1985 CB ALA A 132 27.068 16.683 -18.803 1.00 0.00 C ATOM 0 H ALA A 132 25.102 18.212 -19.154 1.00 0.00 H new ATOM 0 HA ALA A 132 27.553 18.552 -17.860 1.00 0.00 H new ATOM 0 HB1 ALA A 132 28.064 16.258 -18.676 1.00 0.00 H new ATOM 0 HB2 ALA A 132 26.431 16.368 -17.976 1.00 0.00 H new ATOM 0 HB3 ALA A 132 26.642 16.333 -19.743 1.00 0.00 H new ATOM 1991 N ALA A 133 27.539 18.661 -21.190 1.00 0.00 N ATOM 1992 CA ALA A 133 28.346 19.011 -22.337 1.00 0.00 C ATOM 1993 C ALA A 133 28.826 20.428 -22.207 1.00 0.00 C ATOM 1994 O ALA A 133 29.961 20.732 -22.562 1.00 0.00 O ATOM 1995 CB ALA A 133 27.592 18.879 -23.671 1.00 0.00 C ATOM 0 H ALA A 133 26.561 18.461 -21.401 1.00 0.00 H new ATOM 0 HA ALA A 133 29.179 18.308 -22.352 1.00 0.00 H new ATOM 0 HB1 ALA A 133 28.253 19.156 -24.492 1.00 0.00 H new ATOM 0 HB2 ALA A 133 27.263 17.848 -23.802 1.00 0.00 H new ATOM 0 HB3 ALA A 133 26.724 19.539 -23.665 1.00 0.00 H new ATOM 2001 N GLN A 134 27.963 21.337 -21.710 1.00 0.00 N ATOM 2002 CA GLN A 134 28.361 22.717 -21.567 1.00 0.00 C ATOM 2003 C GLN A 134 29.494 22.790 -20.578 1.00 0.00 C ATOM 2004 O GLN A 134 30.456 23.531 -20.775 1.00 0.00 O ATOM 2005 CB GLN A 134 27.218 23.621 -21.059 1.00 0.00 C ATOM 2006 CG GLN A 134 27.582 25.113 -21.069 1.00 0.00 C ATOM 2007 CD GLN A 134 27.851 25.543 -22.506 1.00 0.00 C ATOM 2008 OE1 GLN A 134 27.005 25.393 -23.381 1.00 0.00 O ATOM 2009 NE2 GLN A 134 29.067 26.087 -22.762 1.00 0.00 N ATOM 0 H GLN A 134 27.010 21.129 -21.412 1.00 0.00 H new ATOM 0 HA GLN A 134 28.655 23.075 -22.554 1.00 0.00 H new ATOM 0 HB2 GLN A 134 26.335 23.464 -21.679 1.00 0.00 H new ATOM 0 HB3 GLN A 134 26.952 23.325 -20.044 1.00 0.00 H new ATOM 0 HG2 GLN A 134 26.769 25.703 -20.644 1.00 0.00 H new ATOM 0 HG3 GLN A 134 28.462 25.291 -20.451 1.00 0.00 H new ATOM 0 HE21 GLN A 134 29.746 26.196 -22.008 1.00 0.00 H new ATOM 0 HE22 GLN A 134 29.303 26.387 -23.708 1.00 0.00 H new ATOM 2018 N GLU A 135 29.400 22.009 -19.478 1.00 0.00 N ATOM 2019 CA GLU A 135 30.441 22.019 -18.477 1.00 0.00 C ATOM 2020 C GLU A 135 31.695 21.407 -19.049 1.00 0.00 C ATOM 2021 O GLU A 135 32.796 21.893 -18.792 1.00 0.00 O ATOM 2022 CB GLU A 135 30.063 21.229 -17.208 1.00 0.00 C ATOM 2023 CG GLU A 135 28.964 21.926 -16.389 1.00 0.00 C ATOM 2024 CD GLU A 135 28.535 21.011 -15.246 1.00 0.00 C ATOM 2025 OE1 GLU A 135 28.928 19.814 -15.257 1.00 0.00 O ATOM 2026 OE2 GLU A 135 27.799 21.499 -14.350 1.00 0.00 O ATOM 0 H GLU A 135 28.621 21.381 -19.281 1.00 0.00 H new ATOM 0 HA GLU A 135 30.592 23.061 -18.196 1.00 0.00 H new ATOM 0 HB2 GLU A 135 29.724 20.232 -17.491 1.00 0.00 H new ATOM 0 HB3 GLU A 135 30.949 21.100 -16.586 1.00 0.00 H new ATOM 0 HG2 GLU A 135 29.333 22.873 -15.994 1.00 0.00 H new ATOM 0 HG3 GLU A 135 28.110 22.157 -17.026 1.00 0.00 H new ATOM 2033 N ALA A 136 31.558 20.313 -19.837 1.00 0.00 N ATOM 2034 CA ALA A 136 32.720 19.661 -20.402 1.00 0.00 C ATOM 2035 C ALA A 136 33.402 20.597 -21.364 1.00 0.00 C ATOM 2036 O ALA A 136 34.627 20.685 -21.393 1.00 0.00 O ATOM 2037 CB ALA A 136 32.371 18.371 -21.163 1.00 0.00 C ATOM 0 H ALA A 136 30.665 19.885 -20.081 1.00 0.00 H new ATOM 0 HA ALA A 136 33.369 19.399 -19.566 1.00 0.00 H new ATOM 0 HB1 ALA A 136 33.282 17.927 -21.564 1.00 0.00 H new ATOM 0 HB2 ALA A 136 31.892 17.666 -20.483 1.00 0.00 H new ATOM 0 HB3 ALA A 136 31.691 18.604 -21.982 1.00 0.00 H new ATOM 2043 N ALA A 137 32.605 21.310 -22.191 1.00 0.00 N ATOM 2044 CA ALA A 137 33.162 22.227 -23.155 1.00 0.00 C ATOM 2045 C ALA A 137 33.856 23.350 -22.431 1.00 0.00 C ATOM 2046 O ALA A 137 34.922 23.801 -22.849 1.00 0.00 O ATOM 2047 CB ALA A 137 32.094 22.833 -24.081 1.00 0.00 C ATOM 0 H ALA A 137 31.587 21.255 -22.195 1.00 0.00 H new ATOM 0 HA ALA A 137 33.860 21.659 -23.771 1.00 0.00 H new ATOM 0 HB1 ALA A 137 32.569 23.515 -24.786 1.00 0.00 H new ATOM 0 HB2 ALA A 137 31.593 22.035 -24.629 1.00 0.00 H new ATOM 0 HB3 ALA A 137 31.363 23.378 -23.485 1.00 0.00 H new