USER MOD reduce.3.24.130724 H: found=0, std=0, add=826, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 828 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: B 21 ASN : amide:sc= -1.64 K(o=-6.9,f=-4.5) USER MOD Set 1.2: B 52 ASN : amide:sc= -5.24! C(o=-6.9!,f=-13!) USER MOD Set 2.1: B 26 GLN : amide:sc= -8.42! K(o=-14!,f=-1.4) USER MOD Set 2.2: B 55 GLN : amide:sc= -5.5! K(o=-14!,f=-1.4) USER MOD Set 3.1: A 21 ASN : amide:sc= -3.44! K(o=-15!,f=-11) USER MOD Set 3.2: A 52 ASN : amide:sc= -11.2! C(o=-15!,f=-19!) USER MOD Set 4.1: A 26 GLN : amide:sc= -5.66! K(o=-15!,f=-3.3) USER MOD Set 4.2: A 55 GLN : amide:sc= -9.48! C(o=-15!,f=-3.3!) USER MOD Set 5.1: A 13 THR OG1 : rot 119:sc= -2.74 USER MOD Set 5.2: B 17 MET CE :methyl -119:sc= -11.8! (180deg=-11.8!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -3.83 K(o=-3.8,f=-10!) USER MOD Single : A 7 LYS NZ :NH3+ 162:sc= -0.269 (180deg=-0.858) USER MOD Single : A 18 ASN : amide:sc= -4.73 K(o=-4.7,f=-3.3) USER MOD Single : A 23 ASN : amide:sc= -2.77! C(o=-2.8!,f=-5.9!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= -2 (180deg=-2) USER MOD Single : A 33 SER OG : rot 73:sc= 1.11 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 GLN : amide:sc= -0.593 K(o=-0.59,f=0) USER MOD Single : A 41 SER OG : rot 114:sc= -0.754 USER MOD Single : A 43 ASN : amide:sc= -0.155 K(o=-0.16,f=-1.1) USER MOD Single : A 49 LYS NZ :NH3+ -174:sc= -0.981 (180deg=-1.08) USER MOD Single : A 50 LYS NZ :NH3+ -157:sc= -0.0838 (180deg=-0.632) USER MOD Single : B 6 ASN : amide:sc= -3.84! K(o=-3.8!,f=-0.44) USER MOD Single : B 7 LYS NZ :NH3+ -129:sc= 0.507 (180deg=-0.407) USER MOD Single : B 23 ASN : amide:sc= -2.99! C(o=-3!,f=-16!) USER MOD Single : B 24 SER OG : rot -80:sc= 0.724 USER MOD Single : B 32 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : B 33 SER OG : rot 86:sc= 0.209 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 40 GLN : amide:sc= -0.628 K(o=-0.63,f=-0.0017) USER MOD Single : B 41 SER OG : rot 150:sc= -1.11 USER MOD Single : B 43 ASN : amide:sc= -1.22! K(o=-1.2!,f=-0.16) USER MOD Single : B 49 LYS NZ :NH3+ 148:sc= 0.972 (180deg=-1.31!) USER MOD Single : B 50 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.176) USER MOD ----------------------------------------------------------------- ATOM 45 N LYS A 4 6.222 -10.630 7.333 1.00 0.00 N ATOM 46 CA LYS A 4 5.641 -9.650 8.252 1.00 0.00 C ATOM 47 C LYS A 4 5.896 -8.227 7.763 1.00 0.00 C ATOM 48 O LYS A 4 4.990 -7.394 7.775 1.00 0.00 O ATOM 49 CB LYS A 4 6.236 -9.828 9.653 1.00 0.00 C ATOM 50 CG LYS A 4 5.449 -8.973 10.652 1.00 0.00 C ATOM 51 CD LYS A 4 6.049 -9.121 12.054 1.00 0.00 C ATOM 52 CE LYS A 4 5.138 -8.427 13.070 1.00 0.00 C ATOM 53 NZ LYS A 4 5.345 -6.950 13.001 1.00 0.00 N ATOM 0 HA LYS A 4 4.564 -9.816 8.291 1.00 0.00 H new ATOM 0 HB2 LYS A 4 6.198 -10.877 9.946 1.00 0.00 H new ATOM 0 HB3 LYS A 4 7.286 -9.535 9.654 1.00 0.00 H new ATOM 0 HG2 LYS A 4 5.472 -7.927 10.346 1.00 0.00 H new ATOM 0 HG3 LYS A 4 4.403 -9.279 10.661 1.00 0.00 H new ATOM 0 HD2 LYS A 4 6.157 -10.176 12.306 1.00 0.00 H new ATOM 0 HD3 LYS A 4 7.046 -8.682 12.083 1.00 0.00 H new ATOM 0 HE2 LYS A 4 4.095 -8.668 12.863 1.00 0.00 H new ATOM 0 HE3 LYS A 4 5.356 -8.788 14.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 4.726 -6.480 13.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 6.337 -6.728 13.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 5.116 -6.612 12.044 1.00 0.00 H new ATOM 67 N PHE A 5 7.132 -7.956 7.337 1.00 0.00 N ATOM 68 CA PHE A 5 7.489 -6.631 6.848 1.00 0.00 C ATOM 69 C PHE A 5 6.673 -6.288 5.605 1.00 0.00 C ATOM 70 O PHE A 5 6.215 -5.163 5.460 1.00 0.00 O ATOM 71 CB PHE A 5 9.000 -6.548 6.552 1.00 0.00 C ATOM 72 CG PHE A 5 9.308 -7.073 5.160 1.00 0.00 C ATOM 73 CD1 PHE A 5 9.382 -8.450 4.930 1.00 0.00 C ATOM 74 CD2 PHE A 5 9.507 -6.175 4.100 1.00 0.00 C ATOM 75 CE1 PHE A 5 9.656 -8.932 3.644 1.00 0.00 C ATOM 76 CE2 PHE A 5 9.780 -6.658 2.816 1.00 0.00 C ATOM 77 CZ PHE A 5 9.855 -8.037 2.588 1.00 0.00 C ATOM 0 H PHE A 5 7.894 -8.634 7.322 1.00 0.00 H new ATOM 0 HA PHE A 5 7.258 -5.901 7.624 1.00 0.00 H new ATOM 0 HB2 PHE A 5 9.336 -5.514 6.638 1.00 0.00 H new ATOM 0 HB3 PHE A 5 9.552 -7.125 7.293 1.00 0.00 H new ATOM 0 HD1 PHE A 5 9.228 -9.142 5.744 1.00 0.00 H new ATOM 0 HD2 PHE A 5 9.449 -5.111 4.276 1.00 0.00 H new ATOM 0 HE1 PHE A 5 9.714 -9.996 3.468 1.00 0.00 H new ATOM 0 HE2 PHE A 5 9.933 -5.967 2.000 1.00 0.00 H new ATOM 0 HZ PHE A 5 10.067 -8.410 1.597 1.00 0.00 H new ATOM 87 N ASN A 6 6.493 -7.274 4.718 1.00 0.00 N ATOM 88 CA ASN A 6 5.719 -7.075 3.501 1.00 0.00 C ATOM 89 C ASN A 6 4.260 -6.840 3.846 1.00 0.00 C ATOM 90 O ASN A 6 3.620 -5.936 3.316 1.00 0.00 O ATOM 91 CB ASN A 6 5.831 -8.315 2.622 1.00 0.00 C ATOM 92 CG ASN A 6 5.197 -8.072 1.262 1.00 0.00 C ATOM 93 OD1 ASN A 6 5.132 -6.942 0.797 1.00 0.00 O ATOM 94 ND2 ASN A 6 4.715 -9.080 0.600 1.00 0.00 N ATOM 0 H ASN A 6 6.875 -8.214 4.826 1.00 0.00 H new ATOM 0 HA ASN A 6 6.108 -6.206 2.970 1.00 0.00 H new ATOM 0 HB2 ASN A 6 6.880 -8.584 2.496 1.00 0.00 H new ATOM 0 HB3 ASN A 6 5.342 -9.158 3.111 1.00 0.00 H new ATOM 0 HD21 ASN A 6 4.280 -8.931 -0.311 1.00 0.00 H new ATOM 0 HD22 ASN A 6 4.771 -10.021 0.991 1.00 0.00 H new ATOM 101 N LYS A 7 3.755 -7.661 4.764 1.00 0.00 N ATOM 102 CA LYS A 7 2.385 -7.550 5.218 1.00 0.00 C ATOM 103 C LYS A 7 2.210 -6.190 5.860 1.00 0.00 C ATOM 104 O LYS A 7 1.218 -5.518 5.638 1.00 0.00 O ATOM 105 CB LYS A 7 2.091 -8.686 6.217 1.00 0.00 C ATOM 106 CG LYS A 7 0.665 -8.599 6.785 1.00 0.00 C ATOM 107 CD LYS A 7 -0.359 -9.156 5.786 1.00 0.00 C ATOM 108 CE LYS A 7 -0.423 -10.679 5.868 1.00 0.00 C ATOM 109 NZ LYS A 7 -0.923 -11.091 7.211 1.00 0.00 N ATOM 0 H LYS A 7 4.284 -8.413 5.206 1.00 0.00 H new ATOM 0 HA LYS A 7 1.685 -7.642 4.388 1.00 0.00 H new ATOM 0 HB2 LYS A 7 2.226 -9.648 5.722 1.00 0.00 H new ATOM 0 HB3 LYS A 7 2.810 -8.645 7.035 1.00 0.00 H new ATOM 0 HG2 LYS A 7 0.607 -9.157 7.720 1.00 0.00 H new ATOM 0 HG3 LYS A 7 0.425 -7.562 7.017 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -1.343 -8.734 5.993 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -0.089 -8.853 4.774 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -1.081 -11.067 5.090 1.00 0.00 H new ATOM 0 HE3 LYS A 7 0.565 -11.104 5.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -1.253 -12.076 7.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -0.154 -11.011 7.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -1.711 -10.473 7.493 1.00 0.00 H new ATOM 123 N GLU A 8 3.209 -5.781 6.632 1.00 0.00 N ATOM 124 CA GLU A 8 3.169 -4.483 7.284 1.00 0.00 C ATOM 125 C GLU A 8 3.363 -3.365 6.268 1.00 0.00 C ATOM 126 O GLU A 8 2.684 -2.346 6.319 1.00 0.00 O ATOM 127 CB GLU A 8 4.235 -4.414 8.380 1.00 0.00 C ATOM 128 CG GLU A 8 4.214 -3.037 9.067 1.00 0.00 C ATOM 129 CD GLU A 8 5.416 -2.890 10.000 1.00 0.00 C ATOM 130 OE1 GLU A 8 5.443 -3.567 11.016 1.00 0.00 O ATOM 131 OE2 GLU A 8 6.295 -2.101 9.683 1.00 0.00 O ATOM 0 H GLU A 8 4.050 -6.327 6.820 1.00 0.00 H new ATOM 0 HA GLU A 8 2.189 -4.352 7.744 1.00 0.00 H new ATOM 0 HB2 GLU A 8 4.058 -5.197 9.117 1.00 0.00 H new ATOM 0 HB3 GLU A 8 5.220 -4.597 7.950 1.00 0.00 H new ATOM 0 HG2 GLU A 8 4.230 -2.248 8.315 1.00 0.00 H new ATOM 0 HG3 GLU A 8 3.290 -2.919 9.633 1.00 0.00 H new ATOM 138 N LEU A 9 4.262 -3.592 5.325 1.00 0.00 N ATOM 139 CA LEU A 9 4.516 -2.629 4.255 1.00 0.00 C ATOM 140 C LEU A 9 3.219 -2.431 3.504 1.00 0.00 C ATOM 141 O LEU A 9 2.846 -1.315 3.158 1.00 0.00 O ATOM 142 CB LEU A 9 5.619 -3.166 3.325 1.00 0.00 C ATOM 143 CG LEU A 9 5.773 -2.268 2.084 1.00 0.00 C ATOM 144 CD1 LEU A 9 6.599 -1.014 2.375 1.00 0.00 C ATOM 145 CD2 LEU A 9 6.468 -3.047 0.989 1.00 0.00 C ATOM 0 H LEU A 9 4.832 -4.436 5.275 1.00 0.00 H new ATOM 0 HA LEU A 9 4.859 -1.675 4.656 1.00 0.00 H new ATOM 0 HB2 LEU A 9 6.565 -3.213 3.865 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.377 -4.183 3.016 1.00 0.00 H new ATOM 0 HG LEU A 9 4.773 -1.958 1.781 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.679 -0.413 1.469 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.111 -0.430 3.156 1.00 0.00 H new ATOM 0 HD13 LEU A 9 7.596 -1.304 2.708 1.00 0.00 H new ATOM 0 HD21 LEU A 9 6.579 -2.415 0.108 1.00 0.00 H new ATOM 0 HD22 LEU A 9 7.452 -3.363 1.336 1.00 0.00 H new ATOM 0 HD23 LEU A 9 5.874 -3.925 0.734 1.00 0.00 H new ATOM 157 N GLY A 10 2.512 -3.526 3.304 1.00 0.00 N ATOM 158 CA GLY A 10 1.245 -3.475 2.651 1.00 0.00 C ATOM 159 C GLY A 10 0.199 -2.908 3.587 1.00 0.00 C ATOM 160 O GLY A 10 -0.667 -2.141 3.180 1.00 0.00 O ATOM 0 H GLY A 10 2.806 -4.460 3.591 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.314 -2.859 1.754 1.00 0.00 H new ATOM 0 HA3 GLY A 10 0.953 -4.475 2.329 1.00 0.00 H new ATOM 164 N TRP A 11 0.248 -3.319 4.847 1.00 0.00 N ATOM 165 CA TRP A 11 -0.747 -2.853 5.781 1.00 0.00 C ATOM 166 C TRP A 11 -0.629 -1.403 6.128 1.00 0.00 C ATOM 167 O TRP A 11 -1.615 -0.671 6.051 1.00 0.00 O ATOM 168 CB TRP A 11 -0.835 -3.691 7.042 1.00 0.00 C ATOM 169 CG TRP A 11 -2.296 -3.783 7.412 1.00 0.00 C ATOM 170 CD1 TRP A 11 -2.759 -3.801 8.669 1.00 0.00 C ATOM 171 CD2 TRP A 11 -3.492 -3.825 6.534 1.00 0.00 C ATOM 172 NE1 TRP A 11 -4.141 -3.893 8.639 1.00 0.00 N ATOM 173 CE2 TRP A 11 -4.636 -3.899 7.351 1.00 0.00 C ATOM 174 CE3 TRP A 11 -3.697 -3.819 5.126 1.00 0.00 C ATOM 175 CZ2 TRP A 11 -5.923 -3.957 6.808 1.00 0.00 C ATOM 176 CZ3 TRP A 11 -4.973 -3.873 4.580 1.00 0.00 C ATOM 177 CH2 TRP A 11 -6.094 -3.939 5.416 1.00 0.00 C ATOM 0 H TRP A 11 0.947 -3.955 5.230 1.00 0.00 H new ATOM 0 HA TRP A 11 -1.682 -2.976 5.234 1.00 0.00 H new ATOM 0 HB2 TRP A 11 -0.417 -4.684 6.875 1.00 0.00 H new ATOM 0 HB3 TRP A 11 -0.261 -3.235 7.849 1.00 0.00 H new ATOM 0 HD1 TRP A 11 -2.153 -3.752 9.561 1.00 0.00 H new ATOM 0 HE1 TRP A 11 -4.725 -3.950 9.473 1.00 0.00 H new ATOM 0 HE3 TRP A 11 -2.842 -3.771 4.468 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 -6.783 -4.015 7.459 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 -5.101 -3.864 3.508 1.00 0.00 H new ATOM 0 HH2 TRP A 11 -7.086 -3.976 4.991 1.00 0.00 H new ATOM 188 N ALA A 12 0.551 -0.980 6.516 1.00 0.00 N ATOM 189 CA ALA A 12 0.731 0.398 6.875 1.00 0.00 C ATOM 190 C ALA A 12 0.313 1.271 5.694 1.00 0.00 C ATOM 191 O ALA A 12 -0.332 2.294 5.873 1.00 0.00 O ATOM 192 CB ALA A 12 2.181 0.648 7.265 1.00 0.00 C ATOM 0 H ALA A 12 1.385 -1.562 6.589 1.00 0.00 H new ATOM 0 HA ALA A 12 0.111 0.649 7.735 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.309 1.696 7.536 1.00 0.00 H new ATOM 0 HB2 ALA A 12 2.443 0.019 8.115 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.831 0.409 6.423 1.00 0.00 H new ATOM 198 N THR A 13 0.626 0.803 4.483 1.00 0.00 N ATOM 199 CA THR A 13 0.227 1.497 3.265 1.00 0.00 C ATOM 200 C THR A 13 -1.283 1.684 3.256 1.00 0.00 C ATOM 201 O THR A 13 -1.767 2.781 3.004 1.00 0.00 O ATOM 202 CB THR A 13 0.663 0.648 2.074 1.00 0.00 C ATOM 203 OG1 THR A 13 2.052 0.797 1.903 1.00 0.00 O ATOM 204 CG2 THR A 13 -0.062 1.070 0.800 1.00 0.00 C ATOM 0 H THR A 13 1.155 -0.055 4.324 1.00 0.00 H new ATOM 0 HA THR A 13 0.695 2.480 3.212 1.00 0.00 H new ATOM 0 HB THR A 13 0.412 -0.394 2.270 1.00 0.00 H new ATOM 0 HG1 THR A 13 2.490 -0.073 2.009 1.00 0.00 H new ATOM 0 HG21 THR A 13 0.270 0.447 -0.031 1.00 0.00 H new ATOM 0 HG22 THR A 13 -1.137 0.951 0.936 1.00 0.00 H new ATOM 0 HG23 THR A 13 0.162 2.114 0.583 1.00 0.00 H new ATOM 212 N TRP A 14 -2.003 0.606 3.561 1.00 0.00 N ATOM 213 CA TRP A 14 -3.465 0.628 3.611 1.00 0.00 C ATOM 214 C TRP A 14 -3.971 1.528 4.725 1.00 0.00 C ATOM 215 O TRP A 14 -4.884 2.316 4.530 1.00 0.00 O ATOM 216 CB TRP A 14 -3.956 -0.782 3.895 1.00 0.00 C ATOM 217 CG TRP A 14 -5.418 -0.919 3.600 1.00 0.00 C ATOM 218 CD1 TRP A 14 -6.387 -0.986 4.542 1.00 0.00 C ATOM 219 CD2 TRP A 14 -6.093 -1.035 2.311 1.00 0.00 C ATOM 220 NE1 TRP A 14 -7.605 -1.170 3.920 1.00 0.00 N ATOM 221 CE2 TRP A 14 -7.476 -1.205 2.551 1.00 0.00 C ATOM 222 CE3 TRP A 14 -5.655 -1.021 0.970 1.00 0.00 C ATOM 223 CZ2 TRP A 14 -8.378 -1.364 1.506 1.00 0.00 C ATOM 224 CZ3 TRP A 14 -6.559 -1.180 -0.067 1.00 0.00 C ATOM 225 CH2 TRP A 14 -7.909 -1.355 0.196 1.00 0.00 C ATOM 0 H TRP A 14 -1.593 -0.302 3.779 1.00 0.00 H new ATOM 0 HA TRP A 14 -3.834 1.005 2.657 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -3.393 -1.494 3.292 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -3.769 -1.031 4.939 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -6.232 -0.908 5.608 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -8.492 -1.268 4.415 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -4.606 -0.885 0.750 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -9.431 -1.493 1.708 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -6.210 -1.168 -1.089 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -8.602 -1.485 -0.622 1.00 0.00 H new ATOM 236 N GLU A 15 -3.374 1.381 5.899 1.00 0.00 N ATOM 237 CA GLU A 15 -3.775 2.161 7.059 1.00 0.00 C ATOM 238 C GLU A 15 -3.580 3.652 6.777 1.00 0.00 C ATOM 239 O GLU A 15 -4.427 4.476 7.132 1.00 0.00 O ATOM 240 CB GLU A 15 -2.966 1.689 8.268 1.00 0.00 C ATOM 241 CG GLU A 15 -3.324 0.218 8.568 1.00 0.00 C ATOM 242 CD GLU A 15 -2.359 -0.365 9.598 1.00 0.00 C ATOM 243 OE1 GLU A 15 -2.621 -0.217 10.780 1.00 0.00 O ATOM 244 OE2 GLU A 15 -1.369 -0.951 9.186 1.00 0.00 O ATOM 0 H GLU A 15 -2.610 0.728 6.073 1.00 0.00 H new ATOM 0 HA GLU A 15 -4.833 2.014 7.276 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.899 1.783 8.067 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -3.184 2.314 9.134 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -4.346 0.155 8.941 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.283 -0.368 7.650 1.00 0.00 H new ATOM 251 N ILE A 16 -2.494 3.975 6.072 1.00 0.00 N ATOM 252 CA ILE A 16 -2.218 5.354 5.662 1.00 0.00 C ATOM 253 C ILE A 16 -3.231 5.742 4.574 1.00 0.00 C ATOM 254 O ILE A 16 -3.723 6.870 4.525 1.00 0.00 O ATOM 255 CB ILE A 16 -0.779 5.444 5.099 1.00 0.00 C ATOM 256 CG1 ILE A 16 0.246 5.122 6.199 1.00 0.00 C ATOM 257 CG2 ILE A 16 -0.498 6.850 4.556 1.00 0.00 C ATOM 258 CD1 ILE A 16 1.632 4.875 5.582 1.00 0.00 C ATOM 0 H ILE A 16 -1.790 3.300 5.773 1.00 0.00 H new ATOM 0 HA ILE A 16 -2.306 6.031 6.512 1.00 0.00 H new ATOM 0 HB ILE A 16 -0.690 4.719 4.290 1.00 0.00 H new ATOM 0 HG12 ILE A 16 0.299 5.947 6.909 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -0.073 4.242 6.757 1.00 0.00 H new ATOM 0 HG21 ILE A 16 0.519 6.893 4.165 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -1.204 7.080 3.758 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -0.609 7.579 5.359 1.00 0.00 H new ATOM 0 HD11 ILE A 16 2.347 4.648 6.373 1.00 0.00 H new ATOM 0 HD12 ILE A 16 1.578 4.035 4.890 1.00 0.00 H new ATOM 0 HD13 ILE A 16 1.955 5.767 5.045 1.00 0.00 H new ATOM 270 N PHE A 17 -3.532 4.760 3.721 1.00 0.00 N ATOM 271 CA PHE A 17 -4.489 4.909 2.620 1.00 0.00 C ATOM 272 C PHE A 17 -5.888 5.182 3.176 1.00 0.00 C ATOM 273 O PHE A 17 -6.675 5.926 2.590 1.00 0.00 O ATOM 274 CB PHE A 17 -4.517 3.587 1.834 1.00 0.00 C ATOM 275 CG PHE A 17 -4.792 3.788 0.365 1.00 0.00 C ATOM 276 CD1 PHE A 17 -3.737 4.086 -0.513 1.00 0.00 C ATOM 277 CD2 PHE A 17 -6.087 3.615 -0.131 1.00 0.00 C ATOM 278 CE1 PHE A 17 -3.983 4.215 -1.879 1.00 0.00 C ATOM 279 CE2 PHE A 17 -6.333 3.734 -1.499 1.00 0.00 C ATOM 280 CZ PHE A 17 -5.280 4.035 -2.373 1.00 0.00 C ATOM 0 H PHE A 17 -3.115 3.831 3.775 1.00 0.00 H new ATOM 0 HA PHE A 17 -4.192 5.740 1.980 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -3.561 3.078 1.954 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -5.281 2.934 2.256 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -2.736 4.215 -0.130 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -6.898 3.389 0.545 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -3.175 4.453 -2.554 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.333 3.594 -1.883 1.00 0.00 H new ATOM 0 HZ PHE A 17 -5.470 4.128 -3.432 1.00 0.00 H new ATOM 290 N ASN A 18 -6.183 4.528 4.303 1.00 0.00 N ATOM 291 CA ASN A 18 -7.483 4.635 4.961 1.00 0.00 C ATOM 292 C ASN A 18 -7.544 5.788 5.968 1.00 0.00 C ATOM 293 O ASN A 18 -8.569 5.957 6.635 1.00 0.00 O ATOM 294 CB ASN A 18 -7.792 3.316 5.693 1.00 0.00 C ATOM 295 CG ASN A 18 -8.102 2.194 4.700 1.00 0.00 C ATOM 296 OD1 ASN A 18 -9.126 1.524 4.824 1.00 0.00 O ATOM 297 ND2 ASN A 18 -7.278 1.942 3.723 1.00 0.00 N ATOM 0 H ASN A 18 -5.527 3.911 4.782 1.00 0.00 H new ATOM 0 HA ASN A 18 -8.221 4.837 4.185 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -6.941 3.033 6.313 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -8.641 3.458 6.362 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -7.483 1.191 3.064 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -6.428 2.496 3.617 1.00 0.00 H new ATOM 304 N LEU A 19 -6.474 6.591 6.091 1.00 0.00 N ATOM 305 CA LEU A 19 -6.512 7.700 7.044 1.00 0.00 C ATOM 306 C LEU A 19 -7.473 8.773 6.529 1.00 0.00 C ATOM 307 O LEU A 19 -7.439 9.115 5.344 1.00 0.00 O ATOM 308 CB LEU A 19 -5.124 8.297 7.283 1.00 0.00 C ATOM 309 CG LEU A 19 -4.481 7.671 8.537 1.00 0.00 C ATOM 310 CD1 LEU A 19 -3.118 8.280 8.738 1.00 0.00 C ATOM 311 CD2 LEU A 19 -5.299 7.961 9.800 1.00 0.00 C ATOM 0 H LEU A 19 -5.606 6.496 5.563 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.863 7.316 8.002 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -4.490 8.120 6.414 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.202 9.377 7.406 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.431 6.593 8.381 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.652 7.845 9.622 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.497 8.079 7.865 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.217 9.357 8.872 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.813 7.503 10.661 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.365 9.038 9.951 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.301 7.548 9.687 1.00 0.00 H new ATOM 323 N PRO A 20 -8.355 9.278 7.366 1.00 0.00 N ATOM 324 CA PRO A 20 -9.375 10.286 6.960 1.00 0.00 C ATOM 325 C PRO A 20 -8.884 11.739 6.898 1.00 0.00 C ATOM 326 O PRO A 20 -9.724 12.644 6.890 1.00 0.00 O ATOM 327 CB PRO A 20 -10.465 10.145 8.048 1.00 0.00 C ATOM 328 CG PRO A 20 -10.008 9.074 8.984 1.00 0.00 C ATOM 329 CD PRO A 20 -8.510 8.965 8.794 1.00 0.00 C ATOM 0 HA PRO A 20 -9.702 10.090 5.939 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -10.606 11.087 8.578 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -11.425 9.884 7.602 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -10.253 9.327 10.016 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.499 8.127 8.763 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.967 9.668 9.426 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -8.140 7.968 9.035 1.00 0.00 H new ATOM 337 N ASN A 21 -7.561 12.002 6.872 1.00 0.00 N ATOM 338 CA ASN A 21 -7.129 13.417 6.839 1.00 0.00 C ATOM 339 C ASN A 21 -5.870 13.664 6.012 1.00 0.00 C ATOM 340 O ASN A 21 -5.457 14.816 5.857 1.00 0.00 O ATOM 341 CB ASN A 21 -6.913 13.934 8.267 1.00 0.00 C ATOM 342 CG ASN A 21 -8.213 13.871 9.064 1.00 0.00 C ATOM 343 OD1 ASN A 21 -9.076 14.735 8.916 1.00 0.00 O ATOM 344 ND2 ASN A 21 -8.410 12.888 9.899 1.00 0.00 N ATOM 0 H ASN A 21 -6.815 11.306 6.873 1.00 0.00 H new ATOM 0 HA ASN A 21 -7.934 13.963 6.347 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -6.147 13.338 8.763 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -6.548 14.961 8.236 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -9.280 12.836 10.429 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -7.694 12.172 10.022 1.00 0.00 H new ATOM 351 N LEU A 22 -5.267 12.614 5.476 1.00 0.00 N ATOM 352 CA LEU A 22 -4.060 12.784 4.665 1.00 0.00 C ATOM 353 C LEU A 22 -4.402 13.222 3.252 1.00 0.00 C ATOM 354 O LEU A 22 -5.470 12.888 2.732 1.00 0.00 O ATOM 355 CB LEU A 22 -3.271 11.484 4.614 1.00 0.00 C ATOM 356 CG LEU A 22 -2.873 11.070 6.030 1.00 0.00 C ATOM 357 CD1 LEU A 22 -2.094 9.771 5.965 1.00 0.00 C ATOM 358 CD2 LEU A 22 -1.986 12.140 6.666 1.00 0.00 C ATOM 0 H LEU A 22 -5.582 11.650 5.582 1.00 0.00 H new ATOM 0 HA LEU A 22 -3.455 13.561 5.132 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -3.871 10.701 4.150 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -2.381 11.611 3.998 1.00 0.00 H new ATOM 0 HG LEU A 22 -3.775 10.946 6.629 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.806 9.469 6.972 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.716 8.996 5.517 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -1.199 9.913 5.359 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.710 11.832 7.674 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.085 12.269 6.067 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -2.530 13.084 6.711 1.00 0.00 H new ATOM 370 N ASN A 23 -3.479 13.959 2.627 1.00 0.00 N ATOM 371 CA ASN A 23 -3.688 14.424 1.264 1.00 0.00 C ATOM 372 C ASN A 23 -3.045 13.435 0.295 1.00 0.00 C ATOM 373 O ASN A 23 -2.218 12.613 0.699 1.00 0.00 O ATOM 374 CB ASN A 23 -3.133 15.854 1.093 1.00 0.00 C ATOM 375 CG ASN A 23 -1.730 15.855 0.493 1.00 0.00 C ATOM 376 OD1 ASN A 23 -0.766 15.477 1.155 1.00 0.00 O ATOM 377 ND2 ASN A 23 -1.566 16.265 -0.732 1.00 0.00 N ATOM 0 H ASN A 23 -2.591 14.241 3.042 1.00 0.00 H new ATOM 0 HA ASN A 23 -4.754 14.471 1.044 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -3.802 16.428 0.452 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -3.113 16.353 2.062 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -0.634 16.273 -1.147 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -2.369 16.578 -1.277 1.00 0.00 H new ATOM 384 N GLY A 24 -3.449 13.501 -0.970 1.00 0.00 N ATOM 385 CA GLY A 24 -2.937 12.586 -1.989 1.00 0.00 C ATOM 386 C GLY A 24 -1.416 12.449 -1.943 1.00 0.00 C ATOM 387 O GLY A 24 -0.891 11.346 -2.064 1.00 0.00 O ATOM 0 H GLY A 24 -4.129 14.178 -1.316 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -3.391 11.605 -1.852 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -3.237 12.941 -2.975 1.00 0.00 H new ATOM 391 N VAL A 25 -0.712 13.567 -1.773 1.00 0.00 N ATOM 392 CA VAL A 25 0.750 13.540 -1.731 1.00 0.00 C ATOM 393 C VAL A 25 1.280 12.898 -0.457 1.00 0.00 C ATOM 394 O VAL A 25 2.199 12.089 -0.527 1.00 0.00 O ATOM 395 CB VAL A 25 1.313 14.951 -1.880 1.00 0.00 C ATOM 396 CG1 VAL A 25 2.845 14.912 -1.772 1.00 0.00 C ATOM 397 CG2 VAL A 25 0.916 15.489 -3.257 1.00 0.00 C ATOM 0 H VAL A 25 -1.124 14.494 -1.663 1.00 0.00 H new ATOM 0 HA VAL A 25 1.083 12.926 -2.568 1.00 0.00 H new ATOM 0 HB VAL A 25 0.917 15.594 -1.094 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.243 15.921 -1.879 1.00 0.00 H new ATOM 0 HG12 VAL A 25 3.131 14.510 -0.800 1.00 0.00 H new ATOM 0 HG13 VAL A 25 3.249 14.277 -2.560 1.00 0.00 H new ATOM 0 HG21 VAL A 25 1.310 16.498 -3.381 1.00 0.00 H new ATOM 0 HG22 VAL A 25 1.325 14.841 -4.032 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -0.171 15.512 -3.339 1.00 0.00 H new ATOM 407 N GLN A 26 0.724 13.255 0.706 1.00 0.00 N ATOM 408 CA GLN A 26 1.203 12.676 1.951 1.00 0.00 C ATOM 409 C GLN A 26 1.024 11.168 1.941 1.00 0.00 C ATOM 410 O GLN A 26 1.934 10.437 2.322 1.00 0.00 O ATOM 411 CB GLN A 26 0.488 13.307 3.144 1.00 0.00 C ATOM 412 CG GLN A 26 1.380 14.416 3.727 1.00 0.00 C ATOM 413 CD GLN A 26 0.518 15.529 4.285 1.00 0.00 C ATOM 414 OE1 GLN A 26 0.468 16.627 3.732 1.00 0.00 O ATOM 415 NE2 GLN A 26 -0.172 15.299 5.349 1.00 0.00 N ATOM 0 H GLN A 26 -0.038 13.925 0.805 1.00 0.00 H new ATOM 0 HA GLN A 26 2.268 12.887 2.046 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.472 13.719 2.834 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.281 12.552 3.902 1.00 0.00 H new ATOM 0 HG2 GLN A 26 2.016 14.008 4.512 1.00 0.00 H new ATOM 0 HG3 GLN A 26 2.040 14.808 2.954 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -0.124 14.386 5.800 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -0.766 16.030 5.740 1.00 0.00 H new ATOM 424 N VAL A 27 -0.128 10.707 1.459 1.00 0.00 N ATOM 425 CA VAL A 27 -0.375 9.267 1.379 1.00 0.00 C ATOM 426 C VAL A 27 0.651 8.636 0.438 1.00 0.00 C ATOM 427 O VAL A 27 1.260 7.614 0.758 1.00 0.00 O ATOM 428 CB VAL A 27 -1.800 8.985 0.875 1.00 0.00 C ATOM 429 CG1 VAL A 27 -2.022 7.469 0.797 1.00 0.00 C ATOM 430 CG2 VAL A 27 -2.822 9.592 1.846 1.00 0.00 C ATOM 0 H VAL A 27 -0.892 11.294 1.124 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.278 8.833 2.374 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.926 9.429 -0.112 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.032 7.267 0.440 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.299 7.030 0.109 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.893 7.031 1.787 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.831 9.390 1.486 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.694 9.148 2.833 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.668 10.669 1.910 1.00 0.00 H new ATOM 440 N LYS A 28 0.855 9.291 -0.706 1.00 0.00 N ATOM 441 CA LYS A 28 1.831 8.842 -1.697 1.00 0.00 C ATOM 442 C LYS A 28 3.240 8.876 -1.109 1.00 0.00 C ATOM 443 O LYS A 28 4.071 8.034 -1.430 1.00 0.00 O ATOM 444 CB LYS A 28 1.762 9.735 -2.949 1.00 0.00 C ATOM 445 CG LYS A 28 0.500 9.414 -3.761 1.00 0.00 C ATOM 446 CD LYS A 28 0.315 10.471 -4.854 1.00 0.00 C ATOM 447 CE LYS A 28 -1.036 10.261 -5.533 1.00 0.00 C ATOM 448 NZ LYS A 28 -1.209 11.269 -6.618 1.00 0.00 N ATOM 0 H LYS A 28 0.353 10.139 -0.969 1.00 0.00 H new ATOM 0 HA LYS A 28 1.594 7.816 -1.979 1.00 0.00 H new ATOM 0 HB2 LYS A 28 1.757 10.785 -2.656 1.00 0.00 H new ATOM 0 HB3 LYS A 28 2.648 9.580 -3.564 1.00 0.00 H new ATOM 0 HG2 LYS A 28 0.584 8.424 -4.208 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.372 9.395 -3.107 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.367 11.471 -4.422 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.119 10.398 -5.587 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.095 9.254 -5.945 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -1.840 10.355 -4.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -2.129 11.126 -7.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.170 12.226 -6.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.448 11.159 -7.319 1.00 0.00 H new ATOM 462 N ALA A 29 3.491 9.867 -0.252 1.00 0.00 N ATOM 463 CA ALA A 29 4.784 10.040 0.387 1.00 0.00 C ATOM 464 C ALA A 29 5.030 8.949 1.387 1.00 0.00 C ATOM 465 O ALA A 29 6.118 8.389 1.445 1.00 0.00 O ATOM 466 CB ALA A 29 4.833 11.374 1.111 1.00 0.00 C ATOM 0 H ALA A 29 2.800 10.569 0.014 1.00 0.00 H new ATOM 0 HA ALA A 29 5.549 10.005 -0.389 1.00 0.00 H new ATOM 0 HB1 ALA A 29 5.806 11.494 1.587 1.00 0.00 H new ATOM 0 HB2 ALA A 29 4.676 12.182 0.396 1.00 0.00 H new ATOM 0 HB3 ALA A 29 4.052 11.405 1.870 1.00 0.00 H new ATOM 472 N PHE A 30 4.002 8.640 2.166 1.00 0.00 N ATOM 473 CA PHE A 30 4.109 7.601 3.141 1.00 0.00 C ATOM 474 C PHE A 30 4.332 6.306 2.394 1.00 0.00 C ATOM 475 O PHE A 30 5.152 5.484 2.796 1.00 0.00 O ATOM 476 CB PHE A 30 2.853 7.546 4.001 1.00 0.00 C ATOM 477 CG PHE A 30 2.696 8.836 4.793 1.00 0.00 C ATOM 478 CD1 PHE A 30 3.779 9.358 5.526 1.00 0.00 C ATOM 479 CD2 PHE A 30 1.462 9.515 4.802 1.00 0.00 C ATOM 480 CE1 PHE A 30 3.624 10.540 6.246 1.00 0.00 C ATOM 481 CE2 PHE A 30 1.321 10.693 5.527 1.00 0.00 C ATOM 482 CZ PHE A 30 2.400 11.204 6.243 1.00 0.00 C ATOM 0 H PHE A 30 3.093 9.102 2.130 1.00 0.00 H new ATOM 0 HA PHE A 30 4.942 7.785 3.819 1.00 0.00 H new ATOM 0 HB2 PHE A 30 1.978 7.391 3.369 1.00 0.00 H new ATOM 0 HB3 PHE A 30 2.908 6.697 4.683 1.00 0.00 H new ATOM 0 HD1 PHE A 30 4.728 8.843 5.530 1.00 0.00 H new ATOM 0 HD2 PHE A 30 0.625 9.120 4.245 1.00 0.00 H new ATOM 0 HE1 PHE A 30 4.454 10.942 6.807 1.00 0.00 H new ATOM 0 HE2 PHE A 30 0.374 11.212 5.535 1.00 0.00 H new ATOM 0 HZ PHE A 30 2.287 12.122 6.800 1.00 0.00 H new ATOM 492 N ILE A 31 3.641 6.175 1.251 1.00 0.00 N ATOM 493 CA ILE A 31 3.817 5.014 0.401 1.00 0.00 C ATOM 494 C ILE A 31 5.243 5.002 -0.115 1.00 0.00 C ATOM 495 O ILE A 31 5.912 3.991 -0.086 1.00 0.00 O ATOM 496 CB ILE A 31 2.814 5.026 -0.779 1.00 0.00 C ATOM 497 CG1 ILE A 31 1.440 4.525 -0.284 1.00 0.00 C ATOM 498 CG2 ILE A 31 3.326 4.131 -1.937 1.00 0.00 C ATOM 499 CD1 ILE A 31 0.393 4.620 -1.397 1.00 0.00 C ATOM 0 H ILE A 31 2.965 6.857 0.907 1.00 0.00 H new ATOM 0 HA ILE A 31 3.624 4.112 0.982 1.00 0.00 H new ATOM 0 HB ILE A 31 2.716 6.044 -1.155 1.00 0.00 H new ATOM 0 HG12 ILE A 31 1.525 3.492 0.054 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.120 5.116 0.574 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.609 4.152 -2.757 1.00 0.00 H new ATOM 0 HG22 ILE A 31 4.288 4.504 -2.287 1.00 0.00 H new ATOM 0 HG23 ILE A 31 3.442 3.107 -1.582 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.567 4.262 -1.025 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.294 5.658 -1.716 1.00 0.00 H new ATOM 0 HD13 ILE A 31 0.705 4.008 -2.244 1.00 0.00 H new ATOM 511 N ASP A 32 5.697 6.142 -0.579 1.00 0.00 N ATOM 512 CA ASP A 32 7.045 6.254 -1.109 1.00 0.00 C ATOM 513 C ASP A 32 8.091 5.967 -0.038 1.00 0.00 C ATOM 514 O ASP A 32 9.095 5.307 -0.303 1.00 0.00 O ATOM 515 CB ASP A 32 7.236 7.650 -1.720 1.00 0.00 C ATOM 516 CG ASP A 32 6.389 7.810 -2.993 1.00 0.00 C ATOM 517 OD1 ASP A 32 6.045 6.806 -3.603 1.00 0.00 O ATOM 518 OD2 ASP A 32 6.094 8.942 -3.339 1.00 0.00 O ATOM 0 H ASP A 32 5.157 7.007 -0.603 1.00 0.00 H new ATOM 0 HA ASP A 32 7.182 5.505 -1.889 1.00 0.00 H new ATOM 0 HB2 ASP A 32 6.955 8.412 -0.993 1.00 0.00 H new ATOM 0 HB3 ASP A 32 8.288 7.808 -1.956 1.00 0.00 H new ATOM 523 N SER A 33 7.822 6.431 1.169 1.00 0.00 N ATOM 524 CA SER A 33 8.713 6.191 2.298 1.00 0.00 C ATOM 525 C SER A 33 8.702 4.695 2.611 1.00 0.00 C ATOM 526 O SER A 33 9.733 4.087 2.888 1.00 0.00 O ATOM 527 CB SER A 33 8.241 7.001 3.500 1.00 0.00 C ATOM 528 OG SER A 33 8.270 8.385 3.173 1.00 0.00 O ATOM 0 H SER A 33 6.992 6.978 1.397 1.00 0.00 H new ATOM 0 HA SER A 33 9.730 6.501 2.058 1.00 0.00 H new ATOM 0 HB2 SER A 33 7.231 6.703 3.780 1.00 0.00 H new ATOM 0 HB3 SER A 33 8.882 6.805 4.360 1.00 0.00 H new ATOM 0 HG SER A 33 7.539 8.590 2.553 1.00 0.00 H new ATOM 534 N LEU A 34 7.505 4.127 2.497 1.00 0.00 N ATOM 535 CA LEU A 34 7.262 2.696 2.684 1.00 0.00 C ATOM 536 C LEU A 34 8.099 1.918 1.674 1.00 0.00 C ATOM 537 O LEU A 34 8.857 1.016 2.026 1.00 0.00 O ATOM 538 CB LEU A 34 5.770 2.467 2.418 1.00 0.00 C ATOM 539 CG LEU A 34 4.993 2.277 3.717 1.00 0.00 C ATOM 540 CD1 LEU A 34 3.738 3.149 3.728 1.00 0.00 C ATOM 541 CD2 LEU A 34 4.582 0.826 3.812 1.00 0.00 C ATOM 0 H LEU A 34 6.662 4.654 2.269 1.00 0.00 H new ATOM 0 HA LEU A 34 7.531 2.365 3.687 1.00 0.00 H new ATOM 0 HB2 LEU A 34 5.362 3.317 1.870 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.643 1.589 1.785 1.00 0.00 H new ATOM 0 HG LEU A 34 5.623 2.563 4.560 1.00 0.00 H new ATOM 0 HD11 LEU A 34 3.198 2.998 4.663 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.023 4.197 3.638 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.097 2.874 2.891 1.00 0.00 H new ATOM 0 HD21 LEU A 34 4.024 0.666 4.734 1.00 0.00 H new ATOM 0 HD22 LEU A 34 3.954 0.569 2.959 1.00 0.00 H new ATOM 0 HD23 LEU A 34 5.471 0.195 3.811 1.00 0.00 H new ATOM 553 N ARG A 35 7.952 2.315 0.421 1.00 0.00 N ATOM 554 CA ARG A 35 8.686 1.713 -0.693 1.00 0.00 C ATOM 555 C ARG A 35 10.192 1.851 -0.483 1.00 0.00 C ATOM 556 O ARG A 35 10.953 0.905 -0.698 1.00 0.00 O ATOM 557 CB ARG A 35 8.303 2.437 -1.986 1.00 0.00 C ATOM 558 CG ARG A 35 6.825 2.211 -2.285 1.00 0.00 C ATOM 559 CD ARG A 35 6.365 3.118 -3.426 1.00 0.00 C ATOM 560 NE ARG A 35 6.943 2.682 -4.683 1.00 0.00 N ATOM 561 CZ ARG A 35 6.512 1.598 -5.313 1.00 0.00 C ATOM 562 NH1 ARG A 35 5.726 0.751 -4.706 1.00 0.00 N ATOM 563 NH2 ARG A 35 6.857 1.399 -6.547 1.00 0.00 N ATOM 0 H ARG A 35 7.320 3.065 0.141 1.00 0.00 H new ATOM 0 HA ARG A 35 8.431 0.655 -0.752 1.00 0.00 H new ATOM 0 HB2 ARG A 35 8.505 3.504 -1.890 1.00 0.00 H new ATOM 0 HB3 ARG A 35 8.911 2.070 -2.813 1.00 0.00 H new ATOM 0 HG2 ARG A 35 6.657 1.168 -2.552 1.00 0.00 H new ATOM 0 HG3 ARG A 35 6.233 2.411 -1.392 1.00 0.00 H new ATOM 0 HD2 ARG A 35 5.277 3.104 -3.494 1.00 0.00 H new ATOM 0 HD3 ARG A 35 6.658 4.148 -3.221 1.00 0.00 H new ATOM 0 HE ARG A 35 7.703 3.225 -5.094 1.00 0.00 H new ATOM 0 HH11 ARG A 35 5.440 0.921 -3.742 1.00 0.00 H new ATOM 0 HH12 ARG A 35 5.398 -0.081 -5.196 1.00 0.00 H new ATOM 0 HH21 ARG A 35 7.455 2.073 -7.024 1.00 0.00 H new ATOM 0 HH22 ARG A 35 6.530 0.568 -7.040 1.00 0.00 H new ATOM 577 N ASP A 36 10.602 3.046 -0.057 1.00 0.00 N ATOM 578 CA ASP A 36 12.007 3.343 0.195 1.00 0.00 C ATOM 579 C ASP A 36 12.525 2.535 1.375 1.00 0.00 C ATOM 580 O ASP A 36 13.663 2.059 1.366 1.00 0.00 O ATOM 581 CB ASP A 36 12.173 4.832 0.475 1.00 0.00 C ATOM 582 CG ASP A 36 13.656 5.191 0.585 1.00 0.00 C ATOM 583 OD1 ASP A 36 14.266 5.433 -0.444 1.00 0.00 O ATOM 584 OD2 ASP A 36 14.159 5.217 1.697 1.00 0.00 O ATOM 0 H ASP A 36 9.972 3.828 0.121 1.00 0.00 H new ATOM 0 HA ASP A 36 12.585 3.071 -0.689 1.00 0.00 H new ATOM 0 HB2 ASP A 36 11.710 5.413 -0.323 1.00 0.00 H new ATOM 0 HB3 ASP A 36 11.659 5.094 1.400 1.00 0.00 H new ATOM 589 N ASP A 37 11.673 2.390 2.387 1.00 0.00 N ATOM 590 CA ASP A 37 12.031 1.643 3.584 1.00 0.00 C ATOM 591 C ASP A 37 10.805 0.957 4.174 1.00 0.00 C ATOM 592 O ASP A 37 10.049 1.556 4.946 1.00 0.00 O ATOM 593 CB ASP A 37 12.682 2.571 4.622 1.00 0.00 C ATOM 594 CG ASP A 37 13.428 1.752 5.682 1.00 0.00 C ATOM 595 OD1 ASP A 37 12.819 0.870 6.267 1.00 0.00 O ATOM 596 OD2 ASP A 37 14.596 2.024 5.897 1.00 0.00 O ATOM 0 H ASP A 37 10.731 2.781 2.399 1.00 0.00 H new ATOM 0 HA ASP A 37 12.753 0.875 3.307 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.374 3.252 4.126 1.00 0.00 H new ATOM 0 HB3 ASP A 37 11.918 3.185 5.099 1.00 0.00 H new ATOM 601 N PRO A 38 10.602 -0.290 3.824 1.00 0.00 N ATOM 602 CA PRO A 38 9.455 -1.085 4.324 1.00 0.00 C ATOM 603 C PRO A 38 9.589 -1.436 5.802 1.00 0.00 C ATOM 604 O PRO A 38 8.603 -1.644 6.502 1.00 0.00 O ATOM 605 CB PRO A 38 9.441 -2.334 3.455 1.00 0.00 C ATOM 606 CG PRO A 38 10.561 -2.223 2.470 1.00 0.00 C ATOM 607 CD PRO A 38 11.452 -1.074 2.915 1.00 0.00 C ATOM 0 HA PRO A 38 8.524 -0.523 4.258 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.560 -3.227 4.069 1.00 0.00 H new ATOM 0 HB3 PRO A 38 8.486 -2.428 2.938 1.00 0.00 H new ATOM 0 HG2 PRO A 38 11.128 -3.153 2.428 1.00 0.00 H new ATOM 0 HG3 PRO A 38 10.173 -2.041 1.468 1.00 0.00 H new ATOM 0 HD2 PRO A 38 12.347 -1.437 3.420 1.00 0.00 H new ATOM 0 HD3 PRO A 38 11.785 -0.476 2.066 1.00 0.00 H new ATOM 615 N SER A 39 10.817 -1.475 6.280 1.00 0.00 N ATOM 616 CA SER A 39 11.055 -1.757 7.690 1.00 0.00 C ATOM 617 C SER A 39 10.482 -0.600 8.512 1.00 0.00 C ATOM 618 O SER A 39 10.177 -0.744 9.696 1.00 0.00 O ATOM 619 CB SER A 39 12.555 -1.907 7.965 1.00 0.00 C ATOM 620 OG SER A 39 13.128 -2.771 6.992 1.00 0.00 O ATOM 0 H SER A 39 11.658 -1.318 5.725 1.00 0.00 H new ATOM 0 HA SER A 39 10.570 -2.693 7.966 1.00 0.00 H new ATOM 0 HB2 SER A 39 13.041 -0.932 7.933 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.714 -2.310 8.965 1.00 0.00 H new ATOM 0 HG SER A 39 14.088 -2.867 7.165 1.00 0.00 H new ATOM 626 N GLN A 40 10.357 0.554 7.842 1.00 0.00 N ATOM 627 CA GLN A 40 9.844 1.777 8.456 1.00 0.00 C ATOM 628 C GLN A 40 8.345 1.976 8.205 1.00 0.00 C ATOM 629 O GLN A 40 7.793 2.981 8.615 1.00 0.00 O ATOM 630 CB GLN A 40 10.607 2.984 7.875 1.00 0.00 C ATOM 631 CG GLN A 40 11.232 3.813 9.000 1.00 0.00 C ATOM 632 CD GLN A 40 12.528 3.161 9.479 1.00 0.00 C ATOM 633 OE1 GLN A 40 12.656 2.825 10.656 1.00 0.00 O ATOM 634 NE2 GLN A 40 13.500 2.960 8.632 1.00 0.00 N ATOM 0 H GLN A 40 10.610 0.661 6.860 1.00 0.00 H new ATOM 0 HA GLN A 40 9.992 1.692 9.533 1.00 0.00 H new ATOM 0 HB2 GLN A 40 11.385 2.637 7.195 1.00 0.00 H new ATOM 0 HB3 GLN A 40 9.927 3.605 7.292 1.00 0.00 H new ATOM 0 HG2 GLN A 40 11.434 4.824 8.647 1.00 0.00 H new ATOM 0 HG3 GLN A 40 10.531 3.899 9.830 1.00 0.00 H new ATOM 0 HE21 GLN A 40 13.393 3.239 7.657 1.00 0.00 H new ATOM 0 HE22 GLN A 40 14.367 2.524 8.945 1.00 0.00 H new ATOM 643 N SER A 41 7.699 1.044 7.513 1.00 0.00 N ATOM 644 CA SER A 41 6.273 1.183 7.171 1.00 0.00 C ATOM 645 C SER A 41 5.402 1.568 8.365 1.00 0.00 C ATOM 646 O SER A 41 4.504 2.402 8.232 1.00 0.00 O ATOM 647 CB SER A 41 5.762 -0.151 6.644 1.00 0.00 C ATOM 648 OG SER A 41 6.625 -0.612 5.631 1.00 0.00 O ATOM 0 H SER A 41 8.131 0.184 7.175 1.00 0.00 H new ATOM 0 HA SER A 41 6.204 1.980 6.430 1.00 0.00 H new ATOM 0 HB2 SER A 41 5.711 -0.879 7.453 1.00 0.00 H new ATOM 0 HB3 SER A 41 4.751 -0.037 6.253 1.00 0.00 H new ATOM 0 HG SER A 41 7.076 -1.428 5.932 1.00 0.00 H new ATOM 654 N ALA A 42 5.672 0.979 9.521 1.00 0.00 N ATOM 655 CA ALA A 42 4.907 1.284 10.722 1.00 0.00 C ATOM 656 C ALA A 42 5.118 2.734 11.119 1.00 0.00 C ATOM 657 O ALA A 42 4.217 3.392 11.634 1.00 0.00 O ATOM 658 CB ALA A 42 5.381 0.392 11.859 1.00 0.00 C ATOM 0 H ALA A 42 6.412 0.290 9.653 1.00 0.00 H new ATOM 0 HA ALA A 42 3.849 1.111 10.522 1.00 0.00 H new ATOM 0 HB1 ALA A 42 4.811 0.617 12.760 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.233 -0.653 11.588 1.00 0.00 H new ATOM 0 HB3 ALA A 42 6.440 0.572 12.045 1.00 0.00 H new ATOM 664 N ASN A 43 6.332 3.201 10.872 1.00 0.00 N ATOM 665 CA ASN A 43 6.731 4.556 11.186 1.00 0.00 C ATOM 666 C ASN A 43 6.026 5.558 10.284 1.00 0.00 C ATOM 667 O ASN A 43 5.709 6.667 10.682 1.00 0.00 O ATOM 668 CB ASN A 43 8.235 4.658 10.969 1.00 0.00 C ATOM 669 CG ASN A 43 8.821 5.895 11.649 1.00 0.00 C ATOM 670 OD1 ASN A 43 8.091 6.736 12.177 1.00 0.00 O ATOM 671 ND2 ASN A 43 10.114 6.053 11.667 1.00 0.00 N ATOM 0 H ASN A 43 7.071 2.643 10.445 1.00 0.00 H new ATOM 0 HA ASN A 43 6.462 4.784 12.217 1.00 0.00 H new ATOM 0 HB2 ASN A 43 8.721 3.764 11.359 1.00 0.00 H new ATOM 0 HB3 ASN A 43 8.447 4.695 9.900 1.00 0.00 H new ATOM 0 HD21 ASN A 43 10.521 6.872 12.118 1.00 0.00 H new ATOM 0 HD22 ASN A 43 10.719 5.357 11.230 1.00 0.00 H new ATOM 678 N LEU A 44 5.820 5.132 9.058 1.00 0.00 N ATOM 679 CA LEU A 44 5.181 5.936 8.023 1.00 0.00 C ATOM 680 C LEU A 44 3.720 5.997 8.308 1.00 0.00 C ATOM 681 O LEU A 44 3.069 7.031 8.176 1.00 0.00 O ATOM 682 CB LEU A 44 5.513 5.280 6.694 1.00 0.00 C ATOM 683 CG LEU A 44 7.039 5.156 6.678 1.00 0.00 C ATOM 684 CD1 LEU A 44 7.518 4.248 5.570 1.00 0.00 C ATOM 685 CD2 LEU A 44 7.630 6.543 6.560 1.00 0.00 C ATOM 0 H LEU A 44 6.094 4.202 8.740 1.00 0.00 H new ATOM 0 HA LEU A 44 5.535 6.966 7.994 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.038 4.303 6.607 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.158 5.882 5.858 1.00 0.00 H new ATOM 0 HG LEU A 44 7.374 4.695 7.607 1.00 0.00 H new ATOM 0 HD11 LEU A 44 8.606 4.187 5.594 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.096 3.252 5.707 1.00 0.00 H new ATOM 0 HD13 LEU A 44 7.198 4.648 4.608 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.718 6.475 6.547 1.00 0.00 H new ATOM 0 HD22 LEU A 44 7.284 7.008 5.637 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.314 7.147 7.411 1.00 0.00 H new ATOM 697 N LEU A 45 3.257 4.879 8.800 1.00 0.00 N ATOM 698 CA LEU A 45 1.894 4.755 9.254 1.00 0.00 C ATOM 699 C LEU A 45 1.755 5.661 10.472 1.00 0.00 C ATOM 700 O LEU A 45 0.744 6.329 10.673 1.00 0.00 O ATOM 701 CB LEU A 45 1.612 3.292 9.611 1.00 0.00 C ATOM 702 CG LEU A 45 0.361 3.178 10.486 1.00 0.00 C ATOM 703 CD1 LEU A 45 -0.845 3.786 9.763 1.00 0.00 C ATOM 704 CD2 LEU A 45 0.111 1.699 10.786 1.00 0.00 C ATOM 0 H LEU A 45 3.812 4.029 8.898 1.00 0.00 H new ATOM 0 HA LEU A 45 1.177 5.049 8.487 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.478 2.710 8.699 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.469 2.869 10.136 1.00 0.00 H new ATOM 0 HG LEU A 45 0.508 3.723 11.418 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -1.729 3.699 10.394 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.651 4.838 9.553 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -1.014 3.254 8.827 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.778 1.599 11.409 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.039 1.158 9.851 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.971 1.284 11.311 1.00 0.00 H new ATOM 716 N ALA A 46 2.827 5.685 11.255 1.00 0.00 N ATOM 717 CA ALA A 46 2.902 6.513 12.445 1.00 0.00 C ATOM 718 C ALA A 46 2.862 7.974 12.052 1.00 0.00 C ATOM 719 O ALA A 46 2.132 8.783 12.627 1.00 0.00 O ATOM 720 CB ALA A 46 4.222 6.252 13.173 1.00 0.00 C ATOM 0 H ALA A 46 3.665 5.131 11.080 1.00 0.00 H new ATOM 0 HA ALA A 46 2.059 6.272 13.093 1.00 0.00 H new ATOM 0 HB1 ALA A 46 4.275 6.875 14.066 1.00 0.00 H new ATOM 0 HB2 ALA A 46 4.278 5.202 13.460 1.00 0.00 H new ATOM 0 HB3 ALA A 46 5.055 6.493 12.513 1.00 0.00 H new ATOM 726 N GLU A 47 3.662 8.274 11.042 1.00 0.00 N ATOM 727 CA GLU A 47 3.766 9.602 10.501 1.00 0.00 C ATOM 728 C GLU A 47 2.449 10.010 9.897 1.00 0.00 C ATOM 729 O GLU A 47 2.038 11.155 9.987 1.00 0.00 O ATOM 730 CB GLU A 47 4.814 9.600 9.398 1.00 0.00 C ATOM 731 CG GLU A 47 6.232 9.682 9.955 1.00 0.00 C ATOM 732 CD GLU A 47 6.371 10.835 10.958 1.00 0.00 C ATOM 733 OE1 GLU A 47 6.049 11.957 10.598 1.00 0.00 O ATOM 734 OE2 GLU A 47 6.795 10.576 12.072 1.00 0.00 O ATOM 0 H GLU A 47 4.259 7.590 10.577 1.00 0.00 H new ATOM 0 HA GLU A 47 4.040 10.295 11.296 1.00 0.00 H new ATOM 0 HB2 GLU A 47 4.711 8.693 8.802 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.638 10.443 8.730 1.00 0.00 H new ATOM 0 HG2 GLU A 47 6.489 8.741 10.441 1.00 0.00 H new ATOM 0 HG3 GLU A 47 6.939 9.821 9.137 1.00 0.00 H new ATOM 741 N ALA A 48 1.801 9.048 9.276 1.00 0.00 N ATOM 742 CA ALA A 48 0.538 9.281 8.647 1.00 0.00 C ATOM 743 C ALA A 48 -0.501 9.581 9.700 1.00 0.00 C ATOM 744 O ALA A 48 -1.232 10.551 9.583 1.00 0.00 O ATOM 745 CB ALA A 48 0.181 8.049 7.858 1.00 0.00 C ATOM 0 H ALA A 48 2.141 8.089 9.198 1.00 0.00 H new ATOM 0 HA ALA A 48 0.584 10.138 7.975 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -0.780 8.198 7.366 1.00 0.00 H new ATOM 0 HB2 ALA A 48 0.948 7.863 7.107 1.00 0.00 H new ATOM 0 HB3 ALA A 48 0.116 7.193 8.530 1.00 0.00 H new ATOM 751 N LYS A 49 -0.521 8.771 10.758 1.00 0.00 N ATOM 752 CA LYS A 49 -1.438 9.011 11.861 1.00 0.00 C ATOM 753 C LYS A 49 -1.147 10.378 12.446 1.00 0.00 C ATOM 754 O LYS A 49 -2.046 11.061 12.915 1.00 0.00 O ATOM 755 CB LYS A 49 -1.290 7.927 12.931 1.00 0.00 C ATOM 756 CG LYS A 49 -1.921 6.628 12.420 1.00 0.00 C ATOM 757 CD LYS A 49 -1.807 5.534 13.486 1.00 0.00 C ATOM 758 CE LYS A 49 -2.442 4.243 12.956 1.00 0.00 C ATOM 759 NZ LYS A 49 -1.568 3.081 13.286 1.00 0.00 N ATOM 0 H LYS A 49 0.080 7.955 10.871 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.465 8.979 11.496 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.237 7.768 13.162 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.775 8.242 13.855 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.969 6.797 12.171 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.423 6.308 11.504 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.760 5.362 13.737 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.306 5.849 14.402 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.429 4.104 13.397 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.581 4.311 11.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.948 2.223 12.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -0.606 3.259 12.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.539 2.950 14.317 1.00 0.00 H new ATOM 773 N LYS A 50 0.123 10.782 12.378 1.00 0.00 N ATOM 774 CA LYS A 50 0.531 12.073 12.875 1.00 0.00 C ATOM 775 C LYS A 50 0.052 13.165 11.940 1.00 0.00 C ATOM 776 O LYS A 50 -0.452 14.199 12.379 1.00 0.00 O ATOM 777 CB LYS A 50 2.058 12.097 13.005 1.00 0.00 C ATOM 778 CG LYS A 50 2.530 13.364 13.727 1.00 0.00 C ATOM 779 CD LYS A 50 3.976 13.670 13.309 1.00 0.00 C ATOM 780 CE LYS A 50 4.938 12.623 13.890 1.00 0.00 C ATOM 781 NZ LYS A 50 4.892 12.669 15.380 1.00 0.00 N ATOM 0 H LYS A 50 0.879 10.224 11.981 1.00 0.00 H new ATOM 0 HA LYS A 50 0.087 12.250 13.855 1.00 0.00 H new ATOM 0 HB2 LYS A 50 2.393 11.216 13.553 1.00 0.00 H new ATOM 0 HB3 LYS A 50 2.511 12.049 12.015 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.881 14.203 13.478 1.00 0.00 H new ATOM 0 HG3 LYS A 50 2.472 13.226 14.807 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.052 13.678 12.222 1.00 0.00 H new ATOM 0 HD3 LYS A 50 4.258 14.664 13.656 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.663 11.628 13.539 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.953 12.815 13.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.774 12.276 15.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.786 13.655 15.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.085 12.109 15.720 1.00 0.00 H new ATOM 795 N LEU A 51 0.208 12.914 10.649 1.00 0.00 N ATOM 796 CA LEU A 51 -0.213 13.865 9.640 1.00 0.00 C ATOM 797 C LEU A 51 -1.726 13.935 9.600 1.00 0.00 C ATOM 798 O LEU A 51 -2.310 15.011 9.490 1.00 0.00 O ATOM 799 CB LEU A 51 0.332 13.470 8.259 1.00 0.00 C ATOM 800 CG LEU A 51 1.663 14.183 7.968 1.00 0.00 C ATOM 801 CD1 LEU A 51 1.517 15.699 8.160 1.00 0.00 C ATOM 802 CD2 LEU A 51 2.768 13.640 8.887 1.00 0.00 C ATOM 0 H LEU A 51 0.623 12.059 10.279 1.00 0.00 H new ATOM 0 HA LEU A 51 0.186 14.846 9.899 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.477 12.390 8.216 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.397 13.725 7.490 1.00 0.00 H new ATOM 0 HG LEU A 51 1.937 13.989 6.931 1.00 0.00 H new ATOM 0 HD11 LEU A 51 2.469 16.186 7.949 1.00 0.00 H new ATOM 0 HD12 LEU A 51 0.756 16.080 7.479 1.00 0.00 H new ATOM 0 HD13 LEU A 51 1.222 15.909 9.188 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.705 14.153 8.671 1.00 0.00 H new ATOM 0 HD22 LEU A 51 2.492 13.811 9.928 1.00 0.00 H new ATOM 0 HD23 LEU A 51 2.891 12.571 8.715 1.00 0.00 H new ATOM 814 N ASN A 52 -2.343 12.768 9.710 1.00 0.00 N ATOM 815 CA ASN A 52 -3.779 12.657 9.711 1.00 0.00 C ATOM 816 C ASN A 52 -4.337 13.383 10.916 1.00 0.00 C ATOM 817 O ASN A 52 -5.287 14.155 10.806 1.00 0.00 O ATOM 818 CB ASN A 52 -4.162 11.185 9.788 1.00 0.00 C ATOM 819 CG ASN A 52 -5.669 11.033 9.838 1.00 0.00 C ATOM 820 OD1 ASN A 52 -6.311 10.975 8.800 1.00 0.00 O ATOM 821 ND2 ASN A 52 -6.275 10.968 10.991 1.00 0.00 N ATOM 0 H ASN A 52 -1.855 11.877 9.801 1.00 0.00 H new ATOM 0 HA ASN A 52 -4.185 13.098 8.800 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -3.765 10.654 8.923 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.715 10.732 10.673 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -7.289 10.868 11.029 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -5.735 11.017 11.855 1.00 0.00 H new ATOM 828 N ASP A 53 -3.715 13.133 12.066 1.00 0.00 N ATOM 829 CA ASP A 53 -4.135 13.772 13.297 1.00 0.00 C ATOM 830 C ASP A 53 -3.916 15.274 13.207 1.00 0.00 C ATOM 831 O ASP A 53 -4.749 16.065 13.650 1.00 0.00 O ATOM 832 CB ASP A 53 -3.370 13.195 14.496 1.00 0.00 C ATOM 833 CG ASP A 53 -3.812 11.754 14.812 1.00 0.00 C ATOM 834 OD1 ASP A 53 -4.759 11.273 14.200 1.00 0.00 O ATOM 835 OD2 ASP A 53 -3.182 11.145 15.660 1.00 0.00 O ATOM 0 H ASP A 53 -2.924 12.496 12.165 1.00 0.00 H new ATOM 0 HA ASP A 53 -5.198 13.577 13.442 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -2.300 13.210 14.287 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -3.533 13.826 15.370 1.00 0.00 H new ATOM 840 N ALA A 54 -2.789 15.655 12.608 1.00 0.00 N ATOM 841 CA ALA A 54 -2.457 17.057 12.431 1.00 0.00 C ATOM 842 C ALA A 54 -3.467 17.711 11.494 1.00 0.00 C ATOM 843 O ALA A 54 -3.875 18.855 11.702 1.00 0.00 O ATOM 844 CB ALA A 54 -1.050 17.180 11.844 1.00 0.00 C ATOM 0 H ALA A 54 -2.093 15.007 12.239 1.00 0.00 H new ATOM 0 HA ALA A 54 -2.489 17.560 13.397 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -0.802 18.233 11.712 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.331 16.720 12.522 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -1.013 16.674 10.879 1.00 0.00 H new ATOM 850 N GLN A 55 -3.873 16.957 10.468 1.00 0.00 N ATOM 851 CA GLN A 55 -4.847 17.441 9.494 1.00 0.00 C ATOM 852 C GLN A 55 -6.277 17.232 9.993 1.00 0.00 C ATOM 853 O GLN A 55 -7.233 17.695 9.367 1.00 0.00 O ATOM 854 CB GLN A 55 -4.632 16.703 8.174 1.00 0.00 C ATOM 855 CG GLN A 55 -3.366 17.240 7.495 1.00 0.00 C ATOM 856 CD GLN A 55 -2.967 16.327 6.346 1.00 0.00 C ATOM 857 OE1 GLN A 55 -3.106 16.687 5.178 1.00 0.00 O ATOM 858 NE2 GLN A 55 -2.479 15.155 6.615 1.00 0.00 N ATOM 0 H GLN A 55 -3.540 16.009 10.293 1.00 0.00 H new ATOM 0 HA GLN A 55 -4.704 18.512 9.348 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -4.536 15.632 8.354 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -5.495 16.841 7.522 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -3.542 18.250 7.124 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -2.554 17.304 8.219 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -2.365 14.860 7.585 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -2.209 14.529 5.857 1.00 0.00 H new ATOM 867 N ALA A 56 -6.412 16.542 11.127 1.00 0.00 N ATOM 868 CA ALA A 56 -7.727 16.283 11.714 1.00 0.00 C ATOM 869 C ALA A 56 -8.214 17.504 12.481 1.00 0.00 C ATOM 870 O ALA A 56 -7.439 18.421 12.763 1.00 0.00 O ATOM 871 CB ALA A 56 -7.668 15.067 12.646 1.00 0.00 C ATOM 0 H ALA A 56 -5.630 16.154 11.655 1.00 0.00 H new ATOM 0 HA ALA A 56 -8.428 16.072 10.907 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -8.654 14.888 13.074 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.354 14.190 12.080 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.954 15.257 13.447 1.00 0.00 H new ATOM 981 N PHE B 5 -10.054 -12.093 1.858 1.00 0.00 N ATOM 982 CA PHE B 5 -8.880 -11.567 1.192 1.00 0.00 C ATOM 983 C PHE B 5 -8.338 -10.334 1.886 1.00 0.00 C ATOM 984 O PHE B 5 -7.440 -9.702 1.368 1.00 0.00 O ATOM 985 CB PHE B 5 -9.218 -11.245 -0.266 1.00 0.00 C ATOM 986 CG PHE B 5 -9.303 -12.545 -1.012 1.00 0.00 C ATOM 987 CD1 PHE B 5 -10.393 -13.390 -0.798 1.00 0.00 C ATOM 988 CD2 PHE B 5 -8.280 -12.918 -1.890 1.00 0.00 C ATOM 989 CE1 PHE B 5 -10.461 -14.618 -1.461 1.00 0.00 C ATOM 990 CE2 PHE B 5 -8.351 -14.140 -2.558 1.00 0.00 C ATOM 991 CZ PHE B 5 -9.438 -14.992 -2.342 1.00 0.00 C ATOM 0 HA PHE B 5 -8.103 -12.330 1.232 1.00 0.00 H new ATOM 0 HB2 PHE B 5 -10.163 -10.705 -0.329 1.00 0.00 H new ATOM 0 HB3 PHE B 5 -8.454 -10.602 -0.703 1.00 0.00 H new ATOM 0 HD1 PHE B 5 -11.182 -13.095 -0.122 1.00 0.00 H new ATOM 0 HD2 PHE B 5 -7.438 -12.261 -2.050 1.00 0.00 H new ATOM 0 HE1 PHE B 5 -11.300 -15.277 -1.295 1.00 0.00 H new ATOM 0 HE2 PHE B 5 -7.566 -14.428 -3.242 1.00 0.00 H new ATOM 0 HZ PHE B 5 -9.489 -15.941 -2.855 1.00 0.00 H new ATOM 1001 N ASN B 6 -8.856 -9.999 3.061 1.00 0.00 N ATOM 1002 CA ASN B 6 -8.334 -8.841 3.789 1.00 0.00 C ATOM 1003 C ASN B 6 -6.873 -9.103 4.102 1.00 0.00 C ATOM 1004 O ASN B 6 -6.019 -8.263 3.845 1.00 0.00 O ATOM 1005 CB ASN B 6 -9.141 -8.610 5.069 1.00 0.00 C ATOM 1006 CG ASN B 6 -10.586 -8.256 4.712 1.00 0.00 C ATOM 1007 OD1 ASN B 6 -11.404 -8.032 5.598 1.00 0.00 O ATOM 1008 ND2 ASN B 6 -10.947 -8.194 3.457 1.00 0.00 N ATOM 0 H ASN B 6 -9.617 -10.495 3.524 1.00 0.00 H new ATOM 0 HA ASN B 6 -8.422 -7.939 3.184 1.00 0.00 H new ATOM 0 HB2 ASN B 6 -9.119 -9.505 5.691 1.00 0.00 H new ATOM 0 HB3 ASN B 6 -8.693 -7.806 5.652 1.00 0.00 H new ATOM 0 HD21 ASN B 6 -11.909 -7.959 3.214 1.00 0.00 H new ATOM 0 HD22 ASN B 6 -10.266 -8.380 2.721 1.00 0.00 H new ATOM 1015 N LYS B 7 -6.598 -10.318 4.577 1.00 0.00 N ATOM 1016 CA LYS B 7 -5.231 -10.745 4.849 1.00 0.00 C ATOM 1017 C LYS B 7 -4.449 -10.779 3.540 1.00 0.00 C ATOM 1018 O LYS B 7 -3.307 -10.323 3.464 1.00 0.00 O ATOM 1019 CB LYS B 7 -5.256 -12.148 5.477 1.00 0.00 C ATOM 1020 CG LYS B 7 -3.829 -12.704 5.608 1.00 0.00 C ATOM 1021 CD LYS B 7 -3.882 -14.145 6.131 1.00 0.00 C ATOM 1022 CE LYS B 7 -2.491 -14.781 6.037 1.00 0.00 C ATOM 1023 NZ LYS B 7 -2.151 -15.022 4.604 1.00 0.00 N ATOM 0 H LYS B 7 -7.307 -11.023 4.781 1.00 0.00 H new ATOM 0 HA LYS B 7 -4.753 -10.049 5.539 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -5.728 -12.105 6.459 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -5.859 -12.817 4.863 1.00 0.00 H new ATOM 0 HG2 LYS B 7 -3.327 -12.676 4.641 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -3.247 -12.081 6.287 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -4.227 -14.154 7.165 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -4.598 -14.727 5.550 1.00 0.00 H new ATOM 0 HE2 LYS B 7 -1.748 -14.126 6.493 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -2.471 -15.720 6.590 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -1.842 -16.007 4.482 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -2.989 -14.846 4.014 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -1.385 -14.380 4.316 1.00 0.00 H new ATOM 1037 N GLU B 8 -5.096 -11.340 2.518 1.00 0.00 N ATOM 1038 CA GLU B 8 -4.503 -11.472 1.193 1.00 0.00 C ATOM 1039 C GLU B 8 -4.265 -10.100 0.557 1.00 0.00 C ATOM 1040 O GLU B 8 -3.285 -9.898 -0.166 1.00 0.00 O ATOM 1041 CB GLU B 8 -5.450 -12.295 0.295 1.00 0.00 C ATOM 1042 CG GLU B 8 -5.749 -13.666 0.933 1.00 0.00 C ATOM 1043 CD GLU B 8 -4.457 -14.367 1.364 1.00 0.00 C ATOM 1044 OE1 GLU B 8 -3.628 -14.627 0.506 1.00 0.00 O ATOM 1045 OE2 GLU B 8 -4.320 -14.637 2.548 1.00 0.00 O ATOM 0 H GLU B 8 -6.043 -11.714 2.588 1.00 0.00 H new ATOM 0 HA GLU B 8 -3.541 -11.976 1.291 1.00 0.00 H new ATOM 0 HB2 GLU B 8 -6.381 -11.749 0.142 1.00 0.00 H new ATOM 0 HB3 GLU B 8 -4.998 -12.436 -0.687 1.00 0.00 H new ATOM 0 HG2 GLU B 8 -6.401 -13.534 1.797 1.00 0.00 H new ATOM 0 HG3 GLU B 8 -6.286 -14.293 0.221 1.00 0.00 H new ATOM 1052 N ARG B 9 -5.179 -9.171 0.831 1.00 0.00 N ATOM 1053 CA ARG B 9 -5.105 -7.824 0.300 1.00 0.00 C ATOM 1054 C ARG B 9 -3.893 -7.103 0.873 1.00 0.00 C ATOM 1055 O ARG B 9 -3.178 -6.411 0.158 1.00 0.00 O ATOM 1056 CB ARG B 9 -6.392 -7.069 0.658 1.00 0.00 C ATOM 1057 CG ARG B 9 -6.316 -5.624 0.154 1.00 0.00 C ATOM 1058 CD ARG B 9 -7.696 -4.967 0.262 1.00 0.00 C ATOM 1059 NE ARG B 9 -8.111 -4.895 1.662 1.00 0.00 N ATOM 1060 CZ ARG B 9 -9.376 -5.091 2.020 1.00 0.00 C ATOM 1061 NH1 ARG B 9 -9.950 -6.235 1.783 1.00 0.00 N ATOM 1062 NH2 ARG B 9 -10.041 -4.140 2.610 1.00 0.00 N ATOM 0 H ARG B 9 -5.989 -9.337 1.428 1.00 0.00 H new ATOM 0 HA ARG B 9 -5.001 -7.865 -0.784 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -7.252 -7.571 0.215 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -6.539 -7.078 1.738 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -5.588 -5.062 0.739 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -5.974 -5.607 -0.881 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -7.665 -3.966 -0.168 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -8.425 -5.538 -0.312 1.00 0.00 H new ATOM 0 HE ARG B 9 -7.415 -4.690 2.379 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -9.429 -6.981 1.322 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -10.921 -6.385 2.058 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -9.591 -3.244 2.798 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -11.012 -4.291 2.884 1.00 0.00 H new ATOM 1076 N VAL B 10 -3.670 -7.290 2.175 1.00 0.00 N ATOM 1077 CA VAL B 10 -2.543 -6.660 2.862 1.00 0.00 C ATOM 1078 C VAL B 10 -1.235 -7.083 2.206 1.00 0.00 C ATOM 1079 O VAL B 10 -0.320 -6.278 2.047 1.00 0.00 O ATOM 1080 CB VAL B 10 -2.513 -7.094 4.335 1.00 0.00 C ATOM 1081 CG1 VAL B 10 -1.423 -6.324 5.093 1.00 0.00 C ATOM 1082 CG2 VAL B 10 -3.889 -6.895 4.999 1.00 0.00 C ATOM 0 H VAL B 10 -4.255 -7.872 2.774 1.00 0.00 H new ATOM 0 HA VAL B 10 -2.661 -5.578 2.798 1.00 0.00 H new ATOM 0 HB VAL B 10 -2.277 -8.157 4.375 1.00 0.00 H new ATOM 0 HG11 VAL B 10 -1.412 -6.641 6.136 1.00 0.00 H new ATOM 0 HG12 VAL B 10 -0.452 -6.529 4.641 1.00 0.00 H new ATOM 0 HG13 VAL B 10 -1.629 -5.255 5.041 1.00 0.00 H new ATOM 0 HG21 VAL B 10 -3.839 -7.210 6.041 1.00 0.00 H new ATOM 0 HG22 VAL B 10 -4.167 -5.842 4.951 1.00 0.00 H new ATOM 0 HG23 VAL B 10 -4.636 -7.492 4.475 1.00 0.00 H new ATOM 1092 N ILE B 11 -1.164 -8.355 1.830 1.00 0.00 N ATOM 1093 CA ILE B 11 0.027 -8.899 1.192 1.00 0.00 C ATOM 1094 C ILE B 11 0.203 -8.283 -0.195 1.00 0.00 C ATOM 1095 O ILE B 11 1.322 -7.964 -0.597 1.00 0.00 O ATOM 1096 CB ILE B 11 -0.075 -10.429 1.094 1.00 0.00 C ATOM 1097 CG1 ILE B 11 -0.493 -11.020 2.474 1.00 0.00 C ATOM 1098 CG2 ILE B 11 1.280 -10.995 0.639 1.00 0.00 C ATOM 1099 CD1 ILE B 11 0.685 -11.696 3.203 1.00 0.00 C ATOM 0 H ILE B 11 -1.919 -9.029 1.957 1.00 0.00 H new ATOM 0 HA ILE B 11 0.899 -8.651 1.797 1.00 0.00 H new ATOM 0 HB ILE B 11 -0.835 -10.707 0.363 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -0.896 -10.224 3.100 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -1.292 -11.747 2.328 1.00 0.00 H new ATOM 0 HG21 ILE B 11 1.215 -12.081 0.567 1.00 0.00 H new ATOM 0 HG22 ILE B 11 1.538 -10.582 -0.336 1.00 0.00 H new ATOM 0 HG23 ILE B 11 2.049 -10.725 1.363 1.00 0.00 H new ATOM 0 HD11 ILE B 11 0.342 -12.092 4.159 1.00 0.00 H new ATOM 0 HD12 ILE B 11 1.072 -12.511 2.591 1.00 0.00 H new ATOM 0 HD13 ILE B 11 1.474 -10.964 3.375 1.00 0.00 H new ATOM 1111 N ALA B 12 -0.916 -8.095 -0.912 1.00 0.00 N ATOM 1112 CA ALA B 12 -0.879 -7.491 -2.236 1.00 0.00 C ATOM 1113 C ALA B 12 -0.402 -6.078 -2.127 1.00 0.00 C ATOM 1114 O ALA B 12 0.482 -5.682 -2.869 1.00 0.00 O ATOM 1115 CB ALA B 12 -2.269 -7.512 -2.864 1.00 0.00 C ATOM 0 H ALA B 12 -1.849 -8.354 -0.592 1.00 0.00 H new ATOM 0 HA ALA B 12 -0.197 -8.061 -2.866 1.00 0.00 H new ATOM 0 HB1 ALA B 12 -2.228 -7.057 -3.854 1.00 0.00 H new ATOM 0 HB2 ALA B 12 -2.613 -8.543 -2.952 1.00 0.00 H new ATOM 0 HB3 ALA B 12 -2.961 -6.951 -2.236 1.00 0.00 H new ATOM 1121 N ILE B 13 -0.956 -5.342 -1.164 1.00 0.00 N ATOM 1122 CA ILE B 13 -0.541 -3.967 -0.944 1.00 0.00 C ATOM 1123 C ILE B 13 0.947 -3.990 -0.688 1.00 0.00 C ATOM 1124 O ILE B 13 1.695 -3.238 -1.284 1.00 0.00 O ATOM 1125 CB ILE B 13 -1.305 -3.383 0.262 1.00 0.00 C ATOM 1126 CG1 ILE B 13 -2.792 -3.409 -0.041 1.00 0.00 C ATOM 1127 CG2 ILE B 13 -0.917 -1.927 0.509 1.00 0.00 C ATOM 1128 CD1 ILE B 13 -3.604 -3.214 1.227 1.00 0.00 C ATOM 0 H ILE B 13 -1.685 -5.675 -0.533 1.00 0.00 H new ATOM 0 HA ILE B 13 -0.762 -3.338 -1.807 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.058 -3.980 1.140 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -3.035 -2.625 -0.758 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -3.057 -4.359 -0.505 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -1.472 -1.543 1.365 1.00 0.00 H new ATOM 0 HG22 ILE B 13 0.152 -1.865 0.712 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.154 -1.333 -0.373 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -4.667 -3.236 0.986 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -3.375 -4.013 1.932 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -3.354 -2.252 1.675 1.00 0.00 H new ATOM 1140 N GLY B 14 1.368 -4.921 0.152 1.00 0.00 N ATOM 1141 CA GLY B 14 2.781 -5.091 0.445 1.00 0.00 C ATOM 1142 C GLY B 14 3.571 -5.356 -0.829 1.00 0.00 C ATOM 1143 O GLY B 14 4.659 -4.820 -1.011 1.00 0.00 O ATOM 0 H GLY B 14 0.752 -5.570 0.642 1.00 0.00 H new ATOM 0 HA2 GLY B 14 3.165 -4.197 0.937 1.00 0.00 H new ATOM 0 HA3 GLY B 14 2.915 -5.920 1.140 1.00 0.00 H new ATOM 1147 N GLU B 15 3.007 -6.179 -1.713 1.00 0.00 N ATOM 1148 CA GLU B 15 3.669 -6.512 -2.960 1.00 0.00 C ATOM 1149 C GLU B 15 3.770 -5.288 -3.842 1.00 0.00 C ATOM 1150 O GLU B 15 4.821 -5.046 -4.425 1.00 0.00 O ATOM 1151 CB GLU B 15 2.904 -7.619 -3.678 1.00 0.00 C ATOM 1152 CG GLU B 15 3.836 -8.385 -4.639 1.00 0.00 C ATOM 1153 CD GLU B 15 3.659 -9.891 -4.443 1.00 0.00 C ATOM 1154 OE1 GLU B 15 2.586 -10.389 -4.744 1.00 0.00 O ATOM 1155 OE2 GLU B 15 4.601 -10.525 -3.994 1.00 0.00 O ATOM 0 H GLU B 15 2.097 -6.622 -1.584 1.00 0.00 H new ATOM 0 HA GLU B 15 4.676 -6.866 -2.740 1.00 0.00 H new ATOM 0 HB2 GLU B 15 2.479 -8.308 -2.948 1.00 0.00 H new ATOM 0 HB3 GLU B 15 2.070 -7.191 -4.235 1.00 0.00 H new ATOM 0 HG2 GLU B 15 3.611 -8.115 -5.671 1.00 0.00 H new ATOM 0 HG3 GLU B 15 4.873 -8.105 -4.455 1.00 0.00 H new ATOM 1162 N ILE B 16 2.684 -4.505 -3.935 1.00 0.00 N ATOM 1163 CA ILE B 16 2.748 -3.297 -4.787 1.00 0.00 C ATOM 1164 C ILE B 16 3.899 -2.419 -4.301 1.00 0.00 C ATOM 1165 O ILE B 16 4.746 -1.972 -5.075 1.00 0.00 O ATOM 1166 CB ILE B 16 1.489 -2.384 -4.701 1.00 0.00 C ATOM 1167 CG1 ILE B 16 0.172 -3.159 -4.597 1.00 0.00 C ATOM 1168 CG2 ILE B 16 1.432 -1.486 -5.942 1.00 0.00 C ATOM 1169 CD1 ILE B 16 -0.129 -3.871 -5.902 1.00 0.00 C ATOM 0 H ILE B 16 1.795 -4.668 -3.462 1.00 0.00 H new ATOM 0 HA ILE B 16 2.853 -3.667 -5.807 1.00 0.00 H new ATOM 0 HB ILE B 16 1.591 -1.802 -3.785 1.00 0.00 H new ATOM 0 HG12 ILE B 16 0.233 -3.884 -3.786 1.00 0.00 H new ATOM 0 HG13 ILE B 16 -0.641 -2.475 -4.353 1.00 0.00 H new ATOM 0 HG21 ILE B 16 0.552 -0.845 -5.887 1.00 0.00 H new ATOM 0 HG22 ILE B 16 2.329 -0.868 -5.986 1.00 0.00 H new ATOM 0 HG23 ILE B 16 1.374 -2.105 -6.837 1.00 0.00 H new ATOM 0 HD11 ILE B 16 -1.068 -4.417 -5.811 1.00 0.00 H new ATOM 0 HD12 ILE B 16 -0.211 -3.139 -6.705 1.00 0.00 H new ATOM 0 HD13 ILE B 16 0.676 -4.570 -6.129 1.00 0.00 H new ATOM 1181 N MET B 17 3.885 -2.187 -3.000 1.00 0.00 N ATOM 1182 CA MET B 17 4.880 -1.368 -2.324 1.00 0.00 C ATOM 1183 C MET B 17 6.284 -1.964 -2.485 1.00 0.00 C ATOM 1184 O MET B 17 7.258 -1.221 -2.616 1.00 0.00 O ATOM 1185 CB MET B 17 4.476 -1.261 -0.862 1.00 0.00 C ATOM 1186 CG MET B 17 3.028 -0.745 -0.782 1.00 0.00 C ATOM 1187 SD MET B 17 2.965 0.967 -1.307 1.00 0.00 S ATOM 1188 CE MET B 17 3.894 1.598 0.089 1.00 0.00 C ATOM 0 H MET B 17 3.174 -2.566 -2.374 1.00 0.00 H new ATOM 0 HA MET B 17 4.918 -0.373 -2.767 1.00 0.00 H new ATOM 0 HB2 MET B 17 4.557 -2.233 -0.376 1.00 0.00 H new ATOM 0 HB3 MET B 17 5.147 -0.584 -0.334 1.00 0.00 H new ATOM 0 HG2 MET B 17 2.380 -1.353 -1.414 1.00 0.00 H new ATOM 0 HG3 MET B 17 2.655 -0.836 0.238 1.00 0.00 H new ATOM 0 HE1 MET B 17 3.277 2.300 0.649 1.00 0.00 H new ATOM 0 HE2 MET B 17 4.182 0.771 0.738 1.00 0.00 H new ATOM 0 HE3 MET B 17 4.789 2.107 -0.270 1.00 0.00 H new ATOM 1198 N ARG B 18 6.378 -3.301 -2.511 1.00 0.00 N ATOM 1199 CA ARG B 18 7.668 -3.966 -2.698 1.00 0.00 C ATOM 1200 C ARG B 18 8.216 -3.682 -4.092 1.00 0.00 C ATOM 1201 O ARG B 18 9.426 -3.523 -4.267 1.00 0.00 O ATOM 1202 CB ARG B 18 7.542 -5.475 -2.510 1.00 0.00 C ATOM 1203 CG ARG B 18 7.366 -5.820 -1.024 1.00 0.00 C ATOM 1204 CD ARG B 18 8.452 -6.800 -0.566 1.00 0.00 C ATOM 1205 NE ARG B 18 8.359 -8.055 -1.313 1.00 0.00 N ATOM 1206 CZ ARG B 18 7.333 -8.884 -1.152 1.00 0.00 C ATOM 1207 NH1 ARG B 18 7.368 -9.787 -0.214 1.00 0.00 N ATOM 1208 NH2 ARG B 18 6.292 -8.790 -1.931 1.00 0.00 N ATOM 0 H ARG B 18 5.585 -3.934 -2.406 1.00 0.00 H new ATOM 0 HA ARG B 18 8.353 -3.572 -1.947 1.00 0.00 H new ATOM 0 HB2 ARG B 18 6.691 -5.848 -3.079 1.00 0.00 H new ATOM 0 HB3 ARG B 18 8.430 -5.971 -2.902 1.00 0.00 H new ATOM 0 HG2 ARG B 18 7.414 -4.910 -0.426 1.00 0.00 H new ATOM 0 HG3 ARG B 18 6.381 -6.258 -0.861 1.00 0.00 H new ATOM 0 HD2 ARG B 18 9.436 -6.355 -0.712 1.00 0.00 H new ATOM 0 HD3 ARG B 18 8.346 -6.996 0.501 1.00 0.00 H new ATOM 0 HE ARG B 18 9.098 -8.299 -1.972 1.00 0.00 H new ATOM 0 HH11 ARG B 18 8.182 -9.857 0.396 1.00 0.00 H new ATOM 0 HH12 ARG B 18 6.581 -10.424 -0.090 1.00 0.00 H new ATOM 0 HH21 ARG B 18 6.265 -8.081 -2.663 1.00 0.00 H new ATOM 0 HH22 ARG B 18 5.504 -9.426 -1.808 1.00 0.00 H new ATOM 1222 N LEU B 19 7.314 -3.621 -5.082 1.00 0.00 N ATOM 1223 CA LEU B 19 7.714 -3.354 -6.463 1.00 0.00 C ATOM 1224 C LEU B 19 8.412 -2.003 -6.550 1.00 0.00 C ATOM 1225 O LEU B 19 7.780 -0.971 -6.342 1.00 0.00 O ATOM 1226 CB LEU B 19 6.491 -3.334 -7.391 1.00 0.00 C ATOM 1227 CG LEU B 19 5.782 -4.690 -7.433 1.00 0.00 C ATOM 1228 CD1 LEU B 19 4.471 -4.550 -8.199 1.00 0.00 C ATOM 1229 CD2 LEU B 19 6.647 -5.718 -8.138 1.00 0.00 C ATOM 0 H LEU B 19 6.311 -3.752 -4.950 1.00 0.00 H new ATOM 0 HA LEU B 19 8.391 -4.148 -6.776 1.00 0.00 H new ATOM 0 HB2 LEU B 19 5.792 -2.569 -7.053 1.00 0.00 H new ATOM 0 HB3 LEU B 19 6.804 -3.057 -8.398 1.00 0.00 H new ATOM 0 HG LEU B 19 5.593 -5.017 -6.410 1.00 0.00 H new ATOM 0 HD11 LEU B 19 3.963 -5.514 -8.231 1.00 0.00 H new ATOM 0 HD12 LEU B 19 3.834 -3.821 -7.699 1.00 0.00 H new ATOM 0 HD13 LEU B 19 4.678 -4.215 -9.215 1.00 0.00 H new ATOM 0 HD21 LEU B 19 6.129 -6.677 -8.159 1.00 0.00 H new ATOM 0 HD22 LEU B 19 6.844 -5.389 -9.158 1.00 0.00 H new ATOM 0 HD23 LEU B 19 7.591 -5.828 -7.603 1.00 0.00 H new ATOM 1241 N PRO B 20 9.694 -1.985 -6.836 1.00 0.00 N ATOM 1242 CA PRO B 20 10.474 -0.726 -6.934 1.00 0.00 C ATOM 1243 C PRO B 20 10.283 0.014 -8.263 1.00 0.00 C ATOM 1244 O PRO B 20 10.734 1.152 -8.403 1.00 0.00 O ATOM 1245 CB PRO B 20 11.934 -1.188 -6.781 1.00 0.00 C ATOM 1246 CG PRO B 20 11.913 -2.671 -6.602 1.00 0.00 C ATOM 1247 CD PRO B 20 10.561 -3.145 -7.097 1.00 0.00 C ATOM 0 HA PRO B 20 10.152 -0.009 -6.179 1.00 0.00 H new ATOM 0 HB2 PRO B 20 12.518 -0.915 -7.660 1.00 0.00 H new ATOM 0 HB3 PRO B 20 12.403 -0.704 -5.924 1.00 0.00 H new ATOM 0 HG2 PRO B 20 12.719 -3.141 -7.165 1.00 0.00 H new ATOM 0 HG3 PRO B 20 12.058 -2.938 -5.555 1.00 0.00 H new ATOM 0 HD2 PRO B 20 10.585 -3.402 -8.156 1.00 0.00 H new ATOM 0 HD3 PRO B 20 10.222 -4.032 -6.562 1.00 0.00 H new ATOM 1255 N ASN B 21 9.643 -0.636 -9.245 1.00 0.00 N ATOM 1256 CA ASN B 21 9.450 -0.012 -10.555 1.00 0.00 C ATOM 1257 C ASN B 21 8.107 0.716 -10.656 1.00 0.00 C ATOM 1258 O ASN B 21 7.933 1.555 -11.544 1.00 0.00 O ATOM 1259 CB ASN B 21 9.556 -1.067 -11.662 1.00 0.00 C ATOM 1260 CG ASN B 21 10.878 -1.825 -11.562 1.00 0.00 C ATOM 1261 OD1 ASN B 21 11.910 -1.246 -11.222 1.00 0.00 O ATOM 1262 ND2 ASN B 21 10.909 -3.095 -11.849 1.00 0.00 N ATOM 0 H ASN B 21 9.258 -1.576 -9.158 1.00 0.00 H new ATOM 0 HA ASN B 21 10.237 0.732 -10.679 1.00 0.00 H new ATOM 0 HB2 ASN B 21 8.724 -1.766 -11.585 1.00 0.00 H new ATOM 0 HB3 ASN B 21 9.480 -0.587 -12.637 1.00 0.00 H new ATOM 0 HD21 ASN B 21 11.788 -3.609 -11.792 1.00 0.00 H new ATOM 0 HD22 ASN B 21 10.054 -3.575 -12.131 1.00 0.00 H new ATOM 1269 N LEU B 22 7.153 0.406 -9.764 1.00 0.00 N ATOM 1270 CA LEU B 22 5.847 1.072 -9.820 1.00 0.00 C ATOM 1271 C LEU B 22 5.932 2.529 -9.381 1.00 0.00 C ATOM 1272 O LEU B 22 6.821 2.931 -8.630 1.00 0.00 O ATOM 1273 CB LEU B 22 4.794 0.367 -8.945 1.00 0.00 C ATOM 1274 CG LEU B 22 4.585 -1.084 -9.367 1.00 0.00 C ATOM 1275 CD1 LEU B 22 3.319 -1.636 -8.699 1.00 0.00 C ATOM 1276 CD2 LEU B 22 4.415 -1.143 -10.867 1.00 0.00 C ATOM 0 H LEU B 22 7.257 -0.281 -9.017 1.00 0.00 H new ATOM 0 HA LEU B 22 5.541 1.020 -10.865 1.00 0.00 H new ATOM 0 HB2 LEU B 22 5.107 0.400 -7.902 1.00 0.00 H new ATOM 0 HB3 LEU B 22 3.848 0.904 -9.011 1.00 0.00 H new ATOM 0 HG LEU B 22 5.447 -1.679 -9.065 1.00 0.00 H new ATOM 0 HD11 LEU B 22 3.171 -2.673 -9.001 1.00 0.00 H new ATOM 0 HD12 LEU B 22 3.428 -1.586 -7.616 1.00 0.00 H new ATOM 0 HD13 LEU B 22 2.458 -1.042 -9.005 1.00 0.00 H new ATOM 0 HD21 LEU B 22 4.265 -2.178 -11.176 1.00 0.00 H new ATOM 0 HD22 LEU B 22 3.549 -0.548 -11.159 1.00 0.00 H new ATOM 0 HD23 LEU B 22 5.308 -0.746 -11.350 1.00 0.00 H new ATOM 1288 N ASN B 23 4.969 3.299 -9.865 1.00 0.00 N ATOM 1289 CA ASN B 23 4.849 4.712 -9.556 1.00 0.00 C ATOM 1290 C ASN B 23 4.058 4.874 -8.255 1.00 0.00 C ATOM 1291 O ASN B 23 3.276 3.992 -7.902 1.00 0.00 O ATOM 1292 CB ASN B 23 4.100 5.357 -10.733 1.00 0.00 C ATOM 1293 CG ASN B 23 3.834 6.826 -10.526 1.00 0.00 C ATOM 1294 OD1 ASN B 23 3.163 7.207 -9.586 1.00 0.00 O ATOM 1295 ND2 ASN B 23 4.279 7.661 -11.396 1.00 0.00 N ATOM 0 H ASN B 23 4.241 2.954 -10.491 1.00 0.00 H new ATOM 0 HA ASN B 23 5.822 5.185 -9.420 1.00 0.00 H new ATOM 0 HB2 ASN B 23 4.683 5.224 -11.644 1.00 0.00 H new ATOM 0 HB3 ASN B 23 3.153 4.839 -10.882 1.00 0.00 H new ATOM 0 HD21 ASN B 23 4.070 8.655 -11.302 1.00 0.00 H new ATOM 0 HD22 ASN B 23 4.841 7.330 -12.180 1.00 0.00 H new ATOM 1302 N SER B 24 4.237 6.001 -7.556 1.00 0.00 N ATOM 1303 CA SER B 24 3.495 6.237 -6.311 1.00 0.00 C ATOM 1304 C SER B 24 2.002 6.183 -6.616 1.00 0.00 C ATOM 1305 O SER B 24 1.224 5.546 -5.910 1.00 0.00 O ATOM 1306 CB SER B 24 3.840 7.619 -5.740 1.00 0.00 C ATOM 1307 OG SER B 24 5.212 7.902 -5.978 1.00 0.00 O ATOM 0 H SER B 24 4.875 6.750 -7.823 1.00 0.00 H new ATOM 0 HA SER B 24 3.764 5.475 -5.580 1.00 0.00 H new ATOM 0 HB2 SER B 24 3.215 8.382 -6.204 1.00 0.00 H new ATOM 0 HB3 SER B 24 3.633 7.644 -4.670 1.00 0.00 H new ATOM 0 HG SER B 24 5.761 7.449 -5.304 1.00 0.00 H new ATOM 1313 N LEU B 25 1.648 6.837 -7.716 1.00 0.00 N ATOM 1314 CA LEU B 25 0.285 6.885 -8.212 1.00 0.00 C ATOM 1315 C LEU B 25 -0.151 5.528 -8.733 1.00 0.00 C ATOM 1316 O LEU B 25 -1.289 5.119 -8.513 1.00 0.00 O ATOM 1317 CB LEU B 25 0.176 7.919 -9.340 1.00 0.00 C ATOM 1318 CG LEU B 25 -0.523 9.160 -8.840 1.00 0.00 C ATOM 1319 CD1 LEU B 25 -0.419 10.273 -9.890 1.00 0.00 C ATOM 1320 CD2 LEU B 25 -1.978 8.797 -8.572 1.00 0.00 C ATOM 0 H LEU B 25 2.311 7.354 -8.293 1.00 0.00 H new ATOM 0 HA LEU B 25 -0.366 7.169 -7.386 1.00 0.00 H new ATOM 0 HB2 LEU B 25 1.170 8.175 -9.707 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -0.374 7.496 -10.180 1.00 0.00 H new ATOM 0 HG LEU B 25 -0.060 9.525 -7.923 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.925 11.167 -9.524 1.00 0.00 H new ATOM 0 HD12 LEU B 25 0.631 10.501 -10.076 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.889 9.944 -10.817 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -2.511 9.675 -8.208 1.00 0.00 H new ATOM 0 HD22 LEU B 25 -2.442 8.447 -9.494 1.00 0.00 H new ATOM 0 HD23 LEU B 25 -2.024 8.008 -7.821 1.00 0.00 H new ATOM 1332 N GLN B 26 0.760 4.828 -9.410 1.00 0.00 N ATOM 1333 CA GLN B 26 0.442 3.501 -9.936 1.00 0.00 C ATOM 1334 C GLN B 26 0.155 2.565 -8.782 1.00 0.00 C ATOM 1335 O GLN B 26 -0.757 1.744 -8.837 1.00 0.00 O ATOM 1336 CB GLN B 26 1.616 2.927 -10.727 1.00 0.00 C ATOM 1337 CG GLN B 26 1.587 3.382 -12.192 1.00 0.00 C ATOM 1338 CD GLN B 26 2.834 2.872 -12.906 1.00 0.00 C ATOM 1339 OE1 GLN B 26 3.020 3.132 -14.093 1.00 0.00 O ATOM 1340 NE2 GLN B 26 3.700 2.148 -12.250 1.00 0.00 N ATOM 0 H GLN B 26 1.708 5.151 -9.605 1.00 0.00 H new ATOM 0 HA GLN B 26 -0.423 3.595 -10.593 1.00 0.00 H new ATOM 0 HB2 GLN B 26 2.553 3.240 -10.267 1.00 0.00 H new ATOM 0 HB3 GLN B 26 1.587 1.838 -10.683 1.00 0.00 H new ATOM 0 HG2 GLN B 26 0.692 3.002 -12.684 1.00 0.00 H new ATOM 0 HG3 GLN B 26 1.543 4.470 -12.246 1.00 0.00 H new ATOM 0 HE21 GLN B 26 3.544 1.934 -11.265 1.00 0.00 H new ATOM 0 HE22 GLN B 26 4.533 1.797 -12.722 1.00 0.00 H new ATOM 1349 N VAL B 27 0.946 2.720 -7.730 1.00 0.00 N ATOM 1350 CA VAL B 27 0.794 1.909 -6.541 1.00 0.00 C ATOM 1351 C VAL B 27 -0.537 2.209 -5.911 1.00 0.00 C ATOM 1352 O VAL B 27 -1.297 1.301 -5.602 1.00 0.00 O ATOM 1353 CB VAL B 27 1.961 2.172 -5.588 1.00 0.00 C ATOM 1354 CG1 VAL B 27 1.715 1.503 -4.226 1.00 0.00 C ATOM 1355 CG2 VAL B 27 3.222 1.591 -6.235 1.00 0.00 C ATOM 0 H VAL B 27 1.701 3.404 -7.680 1.00 0.00 H new ATOM 0 HA VAL B 27 0.814 0.849 -6.792 1.00 0.00 H new ATOM 0 HB VAL B 27 2.069 3.243 -5.415 1.00 0.00 H new ATOM 0 HG11 VAL B 27 2.558 1.704 -3.565 1.00 0.00 H new ATOM 0 HG12 VAL B 27 0.803 1.904 -3.783 1.00 0.00 H new ATOM 0 HG13 VAL B 27 1.609 0.427 -4.363 1.00 0.00 H new ATOM 0 HG21 VAL B 27 4.078 1.761 -5.581 1.00 0.00 H new ATOM 0 HG22 VAL B 27 3.091 0.520 -6.390 1.00 0.00 H new ATOM 0 HG23 VAL B 27 3.396 2.078 -7.194 1.00 0.00 H new ATOM 1365 N VAL B 28 -0.839 3.491 -5.794 1.00 0.00 N ATOM 1366 CA VAL B 28 -2.112 3.912 -5.275 1.00 0.00 C ATOM 1367 C VAL B 28 -3.210 3.368 -6.196 1.00 0.00 C ATOM 1368 O VAL B 28 -4.289 3.012 -5.742 1.00 0.00 O ATOM 1369 CB VAL B 28 -2.175 5.443 -5.192 1.00 0.00 C ATOM 1370 CG1 VAL B 28 -3.550 5.850 -4.659 1.00 0.00 C ATOM 1371 CG2 VAL B 28 -1.068 5.967 -4.250 1.00 0.00 C ATOM 0 H VAL B 28 -0.213 4.253 -6.054 1.00 0.00 H new ATOM 0 HA VAL B 28 -2.254 3.523 -4.267 1.00 0.00 H new ATOM 0 HB VAL B 28 -2.020 5.873 -6.182 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -3.608 6.937 -4.595 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -4.324 5.484 -5.333 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -3.698 5.420 -3.669 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -1.120 7.054 -4.197 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -1.210 5.548 -3.254 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -0.092 5.669 -4.634 1.00 0.00 H new ATOM 1381 N ALA B 29 -2.904 3.292 -7.499 1.00 0.00 N ATOM 1382 CA ALA B 29 -3.849 2.775 -8.482 1.00 0.00 C ATOM 1383 C ALA B 29 -4.208 1.345 -8.127 1.00 0.00 C ATOM 1384 O ALA B 29 -5.378 0.960 -8.151 1.00 0.00 O ATOM 1385 CB ALA B 29 -3.220 2.808 -9.884 1.00 0.00 C ATOM 0 H ALA B 29 -2.008 3.583 -7.890 1.00 0.00 H new ATOM 0 HA ALA B 29 -4.746 3.395 -8.478 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -3.933 2.420 -10.612 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -2.960 3.835 -10.142 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -2.320 2.193 -9.894 1.00 0.00 H new ATOM 1391 N PHE B 30 -3.182 0.566 -7.783 1.00 0.00 N ATOM 1392 CA PHE B 30 -3.367 -0.800 -7.416 1.00 0.00 C ATOM 1393 C PHE B 30 -4.009 -0.894 -6.036 1.00 0.00 C ATOM 1394 O PHE B 30 -4.976 -1.623 -5.868 1.00 0.00 O ATOM 1395 CB PHE B 30 -2.002 -1.506 -7.470 1.00 0.00 C ATOM 1396 CG PHE B 30 -1.488 -1.483 -8.908 1.00 0.00 C ATOM 1397 CD1 PHE B 30 -2.300 -1.939 -9.968 1.00 0.00 C ATOM 1398 CD2 PHE B 30 -0.215 -0.956 -9.198 1.00 0.00 C ATOM 1399 CE1 PHE B 30 -1.837 -1.869 -11.279 1.00 0.00 C ATOM 1400 CE2 PHE B 30 0.231 -0.887 -10.513 1.00 0.00 C ATOM 1401 CZ PHE B 30 -0.579 -1.341 -11.555 1.00 0.00 C ATOM 0 H PHE B 30 -2.212 0.881 -7.757 1.00 0.00 H new ATOM 0 HA PHE B 30 -4.044 -1.296 -8.111 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -1.294 -1.007 -6.809 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -2.095 -2.534 -7.120 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -3.281 -2.342 -9.762 1.00 0.00 H new ATOM 0 HD2 PHE B 30 0.417 -0.604 -8.396 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -2.458 -2.227 -12.087 1.00 0.00 H new ATOM 0 HE2 PHE B 30 1.208 -0.481 -10.729 1.00 0.00 H new ATOM 0 HZ PHE B 30 -0.230 -1.283 -12.575 1.00 0.00 H new ATOM 1411 N ILE B 31 -3.508 -0.117 -5.067 1.00 0.00 N ATOM 1412 CA ILE B 31 -4.075 -0.130 -3.714 1.00 0.00 C ATOM 1413 C ILE B 31 -5.556 0.232 -3.774 1.00 0.00 C ATOM 1414 O ILE B 31 -6.403 -0.462 -3.213 1.00 0.00 O ATOM 1415 CB ILE B 31 -3.325 0.876 -2.819 1.00 0.00 C ATOM 1416 CG1 ILE B 31 -1.849 0.467 -2.675 1.00 0.00 C ATOM 1417 CG2 ILE B 31 -3.959 0.910 -1.423 1.00 0.00 C ATOM 1418 CD1 ILE B 31 -1.061 1.628 -2.056 1.00 0.00 C ATOM 0 H ILE B 31 -2.722 0.520 -5.192 1.00 0.00 H new ATOM 0 HA ILE B 31 -3.967 -1.129 -3.291 1.00 0.00 H new ATOM 0 HB ILE B 31 -3.390 1.860 -3.284 1.00 0.00 H new ATOM 0 HG12 ILE B 31 -1.765 -0.420 -2.048 1.00 0.00 H new ATOM 0 HG13 ILE B 31 -1.434 0.209 -3.649 1.00 0.00 H new ATOM 0 HG21 ILE B 31 -3.423 1.623 -0.797 1.00 0.00 H new ATOM 0 HG22 ILE B 31 -5.003 1.212 -1.505 1.00 0.00 H new ATOM 0 HG23 ILE B 31 -3.902 -0.081 -0.973 1.00 0.00 H new ATOM 0 HD11 ILE B 31 -0.014 1.343 -1.952 1.00 0.00 H new ATOM 0 HD12 ILE B 31 -1.136 2.503 -2.701 1.00 0.00 H new ATOM 0 HD13 ILE B 31 -1.472 1.864 -1.074 1.00 0.00 H new ATOM 1430 N ASN B 32 -5.853 1.307 -4.486 1.00 0.00 N ATOM 1431 CA ASN B 32 -7.221 1.761 -4.658 1.00 0.00 C ATOM 1432 C ASN B 32 -8.066 0.697 -5.358 1.00 0.00 C ATOM 1433 O ASN B 32 -9.270 0.613 -5.124 1.00 0.00 O ATOM 1434 CB ASN B 32 -7.231 3.046 -5.487 1.00 0.00 C ATOM 1435 CG ASN B 32 -8.618 3.675 -5.501 1.00 0.00 C ATOM 1436 OD1 ASN B 32 -9.408 3.498 -4.572 1.00 0.00 O ATOM 1437 ND2 ASN B 32 -8.954 4.411 -6.515 1.00 0.00 N ATOM 0 H ASN B 32 -5.157 1.885 -4.957 1.00 0.00 H new ATOM 0 HA ASN B 32 -7.649 1.949 -3.673 1.00 0.00 H new ATOM 0 HB2 ASN B 32 -6.511 3.754 -5.076 1.00 0.00 H new ATOM 0 HB3 ASN B 32 -6.917 2.827 -6.507 1.00 0.00 H new ATOM 0 HD21 ASN B 32 -9.876 4.846 -6.546 1.00 0.00 H new ATOM 0 HD22 ASN B 32 -8.296 4.554 -7.281 1.00 0.00 H new ATOM 1444 N SER B 33 -7.430 -0.121 -6.209 1.00 0.00 N ATOM 1445 CA SER B 33 -8.138 -1.158 -6.914 1.00 0.00 C ATOM 1446 C SER B 33 -8.417 -2.316 -5.965 1.00 0.00 C ATOM 1447 O SER B 33 -9.432 -2.989 -6.100 1.00 0.00 O ATOM 1448 CB SER B 33 -7.376 -1.568 -8.166 1.00 0.00 C ATOM 1449 OG SER B 33 -7.677 -0.658 -9.217 1.00 0.00 O ATOM 0 H SER B 33 -6.432 -0.072 -6.414 1.00 0.00 H new ATOM 0 HA SER B 33 -9.103 -0.789 -7.260 1.00 0.00 H new ATOM 0 HB2 SER B 33 -6.304 -1.572 -7.969 1.00 0.00 H new ATOM 0 HB3 SER B 33 -7.650 -2.582 -8.457 1.00 0.00 H new ATOM 0 HG SER B 33 -7.075 0.113 -9.164 1.00 0.00 H new ATOM 1455 N LEU B 34 -7.547 -2.500 -4.953 1.00 0.00 N ATOM 1456 CA LEU B 34 -7.800 -3.535 -3.945 1.00 0.00 C ATOM 1457 C LEU B 34 -9.085 -3.117 -3.251 1.00 0.00 C ATOM 1458 O LEU B 34 -10.002 -3.907 -3.042 1.00 0.00 O ATOM 1459 CB LEU B 34 -6.686 -3.602 -2.888 1.00 0.00 C ATOM 1460 CG LEU B 34 -5.298 -3.619 -3.537 1.00 0.00 C ATOM 1461 CD1 LEU B 34 -4.229 -3.690 -2.477 1.00 0.00 C ATOM 1462 CD2 LEU B 34 -5.151 -4.822 -4.426 1.00 0.00 C ATOM 0 H LEU B 34 -6.691 -1.962 -4.817 1.00 0.00 H new ATOM 0 HA LEU B 34 -7.854 -4.513 -4.422 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -6.766 -2.745 -2.219 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -6.815 -4.496 -2.278 1.00 0.00 H new ATOM 0 HG LEU B 34 -5.190 -2.705 -4.122 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -3.247 -3.702 -2.951 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -4.306 -2.821 -1.823 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -4.359 -4.599 -1.889 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -4.160 -4.820 -4.880 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -5.278 -5.729 -3.835 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -5.909 -4.791 -5.209 1.00 0.00 H new ATOM 1474 N ARG B 35 -9.127 -1.818 -2.951 1.00 0.00 N ATOM 1475 CA ARG B 35 -10.293 -1.180 -2.334 1.00 0.00 C ATOM 1476 C ARG B 35 -11.518 -1.411 -3.215 1.00 0.00 C ATOM 1477 O ARG B 35 -12.585 -1.801 -2.741 1.00 0.00 O ATOM 1478 CB ARG B 35 -10.032 0.338 -2.240 1.00 0.00 C ATOM 1479 CG ARG B 35 -10.082 0.836 -0.787 1.00 0.00 C ATOM 1480 CD ARG B 35 -8.819 1.647 -0.473 1.00 0.00 C ATOM 1481 NE ARG B 35 -8.563 1.653 0.961 1.00 0.00 N ATOM 1482 CZ ARG B 35 -9.371 2.289 1.800 1.00 0.00 C ATOM 1483 NH1 ARG B 35 -10.385 1.663 2.325 1.00 0.00 N ATOM 1484 NH2 ARG B 35 -9.146 3.536 2.102 1.00 0.00 N ATOM 0 H ARG B 35 -8.353 -1.177 -3.129 1.00 0.00 H new ATOM 0 HA ARG B 35 -10.465 -1.600 -1.343 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -9.057 0.566 -2.669 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -10.774 0.872 -2.833 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -10.968 1.452 -0.634 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -10.161 -0.011 -0.105 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -7.965 1.221 -1.000 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -8.937 2.669 -0.832 1.00 0.00 H new ATOM 0 HE ARG B 35 -7.749 1.160 1.327 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -10.557 0.685 2.091 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -11.007 2.150 2.970 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -8.349 4.024 1.694 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -9.767 4.025 2.747 1.00 0.00 H new ATOM 1498 N ASP B 36 -11.326 -1.160 -4.509 1.00 0.00 N ATOM 1499 CA ASP B 36 -12.375 -1.323 -5.509 1.00 0.00 C ATOM 1500 C ASP B 36 -12.798 -2.787 -5.627 1.00 0.00 C ATOM 1501 O ASP B 36 -13.982 -3.089 -5.791 1.00 0.00 O ATOM 1502 CB ASP B 36 -11.845 -0.829 -6.864 1.00 0.00 C ATOM 1503 CG ASP B 36 -11.534 0.678 -6.831 1.00 0.00 C ATOM 1504 OD1 ASP B 36 -12.103 1.381 -6.008 1.00 0.00 O ATOM 1505 OD2 ASP B 36 -10.720 1.106 -7.634 1.00 0.00 O ATOM 0 H ASP B 36 -10.437 -0.838 -4.892 1.00 0.00 H new ATOM 0 HA ASP B 36 -13.247 -0.742 -5.206 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -10.943 -1.382 -7.127 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -12.582 -1.033 -7.641 1.00 0.00 H new ATOM 1510 N ASP B 37 -11.814 -3.681 -5.556 1.00 0.00 N ATOM 1511 CA ASP B 37 -12.061 -5.120 -5.669 1.00 0.00 C ATOM 1512 C ASP B 37 -11.074 -5.891 -4.801 1.00 0.00 C ATOM 1513 O ASP B 37 -9.972 -6.239 -5.238 1.00 0.00 O ATOM 1514 CB ASP B 37 -11.954 -5.583 -7.140 1.00 0.00 C ATOM 1515 CG ASP B 37 -12.074 -4.401 -8.105 1.00 0.00 C ATOM 1516 OD1 ASP B 37 -11.052 -3.808 -8.414 1.00 0.00 O ATOM 1517 OD2 ASP B 37 -13.182 -4.106 -8.518 1.00 0.00 O ATOM 0 H ASP B 37 -10.834 -3.434 -5.420 1.00 0.00 H new ATOM 0 HA ASP B 37 -13.074 -5.323 -5.320 1.00 0.00 H new ATOM 0 HB2 ASP B 37 -11.000 -6.087 -7.296 1.00 0.00 H new ATOM 0 HB3 ASP B 37 -12.738 -6.310 -7.353 1.00 0.00 H new ATOM 1522 N PRO B 38 -11.450 -6.157 -3.574 1.00 0.00 N ATOM 1523 CA PRO B 38 -10.588 -6.899 -2.621 1.00 0.00 C ATOM 1524 C PRO B 38 -10.387 -8.352 -3.037 1.00 0.00 C ATOM 1525 O PRO B 38 -9.321 -8.928 -2.813 1.00 0.00 O ATOM 1526 CB PRO B 38 -11.312 -6.812 -1.284 1.00 0.00 C ATOM 1527 CG PRO B 38 -12.558 -6.007 -1.482 1.00 0.00 C ATOM 1528 CD PRO B 38 -12.741 -5.780 -2.975 1.00 0.00 C ATOM 0 HA PRO B 38 -9.587 -6.470 -2.581 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -11.557 -7.809 -0.918 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -10.673 -6.346 -0.534 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -13.420 -6.531 -1.068 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -12.483 -5.054 -0.958 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -13.554 -6.389 -3.371 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -12.988 -4.740 -3.190 1.00 0.00 H new ATOM 1536 N SER B 39 -11.416 -8.928 -3.659 1.00 0.00 N ATOM 1537 CA SER B 39 -11.343 -10.304 -4.126 1.00 0.00 C ATOM 1538 C SER B 39 -10.284 -10.400 -5.210 1.00 0.00 C ATOM 1539 O SER B 39 -9.558 -11.392 -5.301 1.00 0.00 O ATOM 1540 CB SER B 39 -12.702 -10.747 -4.677 1.00 0.00 C ATOM 1541 OG SER B 39 -12.667 -12.142 -4.953 1.00 0.00 O ATOM 0 H SER B 39 -12.304 -8.462 -3.848 1.00 0.00 H new ATOM 0 HA SER B 39 -11.078 -10.959 -3.296 1.00 0.00 H new ATOM 0 HB2 SER B 39 -13.489 -10.527 -3.955 1.00 0.00 H new ATOM 0 HB3 SER B 39 -12.938 -10.191 -5.585 1.00 0.00 H new ATOM 0 HG SER B 39 -13.536 -12.428 -5.304 1.00 0.00 H new ATOM 1547 N GLN B 40 -10.203 -9.341 -6.022 1.00 0.00 N ATOM 1548 CA GLN B 40 -9.235 -9.279 -7.099 1.00 0.00 C ATOM 1549 C GLN B 40 -8.021 -8.464 -6.686 1.00 0.00 C ATOM 1550 O GLN B 40 -7.298 -7.966 -7.546 1.00 0.00 O ATOM 1551 CB GLN B 40 -9.850 -8.697 -8.384 1.00 0.00 C ATOM 1552 CG GLN B 40 -11.387 -8.726 -8.334 1.00 0.00 C ATOM 1553 CD GLN B 40 -11.960 -8.041 -9.571 1.00 0.00 C ATOM 1554 OE1 GLN B 40 -12.871 -8.567 -10.210 1.00 0.00 O ATOM 1555 NE2 GLN B 40 -11.471 -6.894 -9.949 1.00 0.00 N ATOM 0 H GLN B 40 -10.801 -8.518 -5.946 1.00 0.00 H new ATOM 0 HA GLN B 40 -8.920 -10.301 -7.310 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -9.508 -7.671 -8.520 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -9.502 -9.266 -9.246 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -11.738 -9.757 -8.283 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -11.740 -8.224 -7.433 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -10.716 -6.461 -9.417 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -11.843 -6.429 -10.777 1.00 0.00 H new ATOM 1564 N SER B 41 -7.772 -8.345 -5.374 1.00 0.00 N ATOM 1565 CA SER B 41 -6.608 -7.606 -4.910 1.00 0.00 C ATOM 1566 C SER B 41 -5.359 -8.165 -5.576 1.00 0.00 C ATOM 1567 O SER B 41 -4.406 -7.445 -5.853 1.00 0.00 O ATOM 1568 CB SER B 41 -6.480 -7.744 -3.390 1.00 0.00 C ATOM 1569 OG SER B 41 -7.411 -6.885 -2.751 1.00 0.00 O ATOM 0 H SER B 41 -8.352 -8.744 -4.636 1.00 0.00 H new ATOM 0 HA SER B 41 -6.722 -6.553 -5.167 1.00 0.00 H new ATOM 0 HB2 SER B 41 -6.660 -8.777 -3.093 1.00 0.00 H new ATOM 0 HB3 SER B 41 -5.466 -7.495 -3.077 1.00 0.00 H new ATOM 0 HG SER B 41 -7.682 -7.276 -1.894 1.00 0.00 H new ATOM 1575 N ALA B 42 -5.412 -9.461 -5.837 1.00 0.00 N ATOM 1576 CA ALA B 42 -4.336 -10.181 -6.494 1.00 0.00 C ATOM 1577 C ALA B 42 -4.273 -9.841 -7.987 1.00 0.00 C ATOM 1578 O ALA B 42 -3.224 -9.972 -8.610 1.00 0.00 O ATOM 1579 CB ALA B 42 -4.595 -11.677 -6.338 1.00 0.00 C ATOM 0 H ALA B 42 -6.211 -10.047 -5.596 1.00 0.00 H new ATOM 0 HA ALA B 42 -3.389 -9.895 -6.037 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -3.797 -12.237 -6.825 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -4.623 -11.933 -5.279 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -5.550 -11.931 -6.798 1.00 0.00 H new ATOM 1585 N ASN B 43 -5.425 -9.447 -8.543 1.00 0.00 N ATOM 1586 CA ASN B 43 -5.557 -9.129 -9.963 1.00 0.00 C ATOM 1587 C ASN B 43 -4.855 -7.842 -10.345 1.00 0.00 C ATOM 1588 O ASN B 43 -4.036 -7.823 -11.257 1.00 0.00 O ATOM 1589 CB ASN B 43 -7.026 -8.982 -10.277 1.00 0.00 C ATOM 1590 CG ASN B 43 -7.307 -9.145 -11.775 1.00 0.00 C ATOM 1591 OD1 ASN B 43 -8.418 -9.514 -12.155 1.00 0.00 O ATOM 1592 ND2 ASN B 43 -6.373 -8.889 -12.654 1.00 0.00 N ATOM 0 H ASN B 43 -6.292 -9.341 -8.016 1.00 0.00 H new ATOM 0 HA ASN B 43 -5.093 -9.936 -10.529 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -7.593 -9.726 -9.718 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -7.372 -8.003 -9.947 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -6.567 -8.995 -13.650 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -5.451 -8.583 -12.344 1.00 0.00 H new ATOM 1599 N LEU B 44 -5.175 -6.766 -9.639 1.00 0.00 N ATOM 1600 CA LEU B 44 -4.555 -5.502 -9.917 1.00 0.00 C ATOM 1601 C LEU B 44 -3.131 -5.565 -9.385 1.00 0.00 C ATOM 1602 O LEU B 44 -2.224 -4.937 -9.910 1.00 0.00 O ATOM 1603 CB LEU B 44 -5.408 -4.302 -9.427 1.00 0.00 C ATOM 1604 CG LEU B 44 -5.541 -4.195 -7.917 1.00 0.00 C ATOM 1605 CD1 LEU B 44 -6.445 -5.290 -7.398 1.00 0.00 C ATOM 1606 CD2 LEU B 44 -4.188 -4.198 -7.239 1.00 0.00 C ATOM 0 H LEU B 44 -5.855 -6.754 -8.879 1.00 0.00 H new ATOM 0 HA LEU B 44 -4.498 -5.316 -10.990 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -4.966 -3.380 -9.806 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.405 -4.380 -9.862 1.00 0.00 H new ATOM 0 HG LEU B 44 -6.002 -3.238 -7.674 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -6.534 -5.205 -6.315 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.431 -5.193 -7.852 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.022 -6.262 -7.652 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -4.322 -4.120 -6.160 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -3.665 -5.125 -7.474 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -3.601 -3.351 -7.594 1.00 0.00 H new ATOM 1618 N LEU B 45 -2.936 -6.410 -8.372 1.00 0.00 N ATOM 1619 CA LEU B 45 -1.612 -6.649 -7.842 1.00 0.00 C ATOM 1620 C LEU B 45 -0.852 -7.314 -8.967 1.00 0.00 C ATOM 1621 O LEU B 45 0.324 -7.058 -9.207 1.00 0.00 O ATOM 1622 CB LEU B 45 -1.690 -7.588 -6.630 1.00 0.00 C ATOM 1623 CG LEU B 45 -0.370 -8.350 -6.447 1.00 0.00 C ATOM 1624 CD1 LEU B 45 0.768 -7.357 -6.235 1.00 0.00 C ATOM 1625 CD2 LEU B 45 -0.475 -9.296 -5.241 1.00 0.00 C ATOM 0 H LEU B 45 -3.680 -6.933 -7.910 1.00 0.00 H new ATOM 0 HA LEU B 45 -1.131 -5.729 -7.509 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -1.911 -7.012 -5.731 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -2.508 -8.295 -6.764 1.00 0.00 H new ATOM 0 HG LEU B 45 -0.168 -8.940 -7.341 1.00 0.00 H new ATOM 0 HD11 LEU B 45 1.705 -7.899 -6.105 1.00 0.00 H new ATOM 0 HD12 LEU B 45 0.845 -6.702 -7.103 1.00 0.00 H new ATOM 0 HD13 LEU B 45 0.568 -6.759 -5.346 1.00 0.00 H new ATOM 0 HD21 LEU B 45 0.465 -9.833 -5.117 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -0.683 -8.717 -4.341 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -1.282 -10.010 -5.408 1.00 0.00 H new ATOM 1637 N ALA B 46 -1.594 -8.144 -9.684 1.00 0.00 N ATOM 1638 CA ALA B 46 -1.057 -8.837 -10.833 1.00 0.00 C ATOM 1639 C ALA B 46 -0.661 -7.777 -11.845 1.00 0.00 C ATOM 1640 O ALA B 46 0.430 -7.806 -12.404 1.00 0.00 O ATOM 1641 CB ALA B 46 -2.115 -9.779 -11.430 1.00 0.00 C ATOM 0 H ALA B 46 -2.573 -8.351 -9.485 1.00 0.00 H new ATOM 0 HA ALA B 46 -0.197 -9.445 -10.553 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -1.697 -10.294 -12.295 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -2.414 -10.512 -10.681 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -2.985 -9.200 -11.739 1.00 0.00 H new ATOM 1647 N GLU B 47 -1.560 -6.805 -12.011 1.00 0.00 N ATOM 1648 CA GLU B 47 -1.331 -5.680 -12.895 1.00 0.00 C ATOM 1649 C GLU B 47 -0.113 -4.898 -12.421 1.00 0.00 C ATOM 1650 O GLU B 47 0.615 -4.320 -13.220 1.00 0.00 O ATOM 1651 CB GLU B 47 -2.543 -4.730 -12.883 1.00 0.00 C ATOM 1652 CG GLU B 47 -3.788 -5.400 -13.451 1.00 0.00 C ATOM 1653 CD GLU B 47 -3.523 -5.968 -14.848 1.00 0.00 C ATOM 1654 OE1 GLU B 47 -3.149 -5.201 -15.722 1.00 0.00 O ATOM 1655 OE2 GLU B 47 -3.702 -7.163 -15.023 1.00 0.00 O ATOM 0 H GLU B 47 -2.462 -6.783 -11.535 1.00 0.00 H new ATOM 0 HA GLU B 47 -1.173 -6.064 -13.903 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -2.739 -4.403 -11.862 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -2.312 -3.838 -13.465 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -4.109 -6.201 -12.785 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -4.603 -4.678 -13.498 1.00 0.00 H new ATOM 1662 N ALA B 48 0.069 -4.868 -11.099 1.00 0.00 N ATOM 1663 CA ALA B 48 1.157 -4.140 -10.483 1.00 0.00 C ATOM 1664 C ALA B 48 2.484 -4.813 -10.707 1.00 0.00 C ATOM 1665 O ALA B 48 3.441 -4.182 -11.123 1.00 0.00 O ATOM 1666 CB ALA B 48 0.907 -4.117 -8.989 1.00 0.00 C ATOM 0 H ALA B 48 -0.537 -5.350 -10.435 1.00 0.00 H new ATOM 0 HA ALA B 48 1.194 -3.143 -10.922 1.00 0.00 H new ATOM 0 HB1 ALA B 48 1.712 -3.574 -8.494 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -0.043 -3.622 -8.787 1.00 0.00 H new ATOM 0 HB3 ALA B 48 0.872 -5.138 -8.610 1.00 0.00 H new ATOM 1672 N LYS B 49 2.522 -6.102 -10.447 1.00 0.00 N ATOM 1673 CA LYS B 49 3.732 -6.863 -10.639 1.00 0.00 C ATOM 1674 C LYS B 49 4.092 -6.803 -12.115 1.00 0.00 C ATOM 1675 O LYS B 49 5.254 -6.666 -12.478 1.00 0.00 O ATOM 1676 CB LYS B 49 3.504 -8.286 -10.131 1.00 0.00 C ATOM 1677 CG LYS B 49 3.493 -8.302 -8.599 1.00 0.00 C ATOM 1678 CD LYS B 49 3.418 -9.753 -8.103 1.00 0.00 C ATOM 1679 CE LYS B 49 2.045 -10.357 -8.434 1.00 0.00 C ATOM 1680 NZ LYS B 49 1.505 -11.057 -7.235 1.00 0.00 N ATOM 0 H LYS B 49 1.728 -6.642 -10.103 1.00 0.00 H new ATOM 0 HA LYS B 49 4.571 -6.456 -10.075 1.00 0.00 H new ATOM 0 HB2 LYS B 49 2.558 -8.670 -10.513 1.00 0.00 H new ATOM 0 HB3 LYS B 49 4.289 -8.944 -10.504 1.00 0.00 H new ATOM 0 HG2 LYS B 49 4.392 -7.821 -8.213 1.00 0.00 H new ATOM 0 HG3 LYS B 49 2.641 -7.734 -8.225 1.00 0.00 H new ATOM 0 HD2 LYS B 49 4.206 -10.345 -8.569 1.00 0.00 H new ATOM 0 HD3 LYS B 49 3.588 -9.786 -7.027 1.00 0.00 H new ATOM 0 HE2 LYS B 49 1.358 -9.572 -8.750 1.00 0.00 H new ATOM 0 HE3 LYS B 49 2.135 -11.056 -9.266 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 0.467 -10.988 -7.231 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 1.786 -12.058 -7.262 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 1.885 -10.614 -6.374 1.00 0.00 H new ATOM 1694 N LYS B 50 3.049 -6.817 -12.941 1.00 0.00 N ATOM 1695 CA LYS B 50 3.186 -6.685 -14.386 1.00 0.00 C ATOM 1696 C LYS B 50 3.652 -5.286 -14.750 1.00 0.00 C ATOM 1697 O LYS B 50 4.462 -5.115 -15.651 1.00 0.00 O ATOM 1698 CB LYS B 50 1.846 -6.944 -15.062 1.00 0.00 C ATOM 1699 CG LYS B 50 1.527 -8.446 -15.048 1.00 0.00 C ATOM 1700 CD LYS B 50 0.127 -8.678 -15.634 1.00 0.00 C ATOM 1701 CE LYS B 50 -0.279 -10.143 -15.445 1.00 0.00 C ATOM 1702 NZ LYS B 50 0.613 -11.017 -16.258 1.00 0.00 N ATOM 0 H LYS B 50 2.085 -6.920 -12.625 1.00 0.00 H new ATOM 0 HA LYS B 50 3.922 -7.414 -14.726 1.00 0.00 H new ATOM 0 HB2 LYS B 50 1.059 -6.393 -14.548 1.00 0.00 H new ATOM 0 HB3 LYS B 50 1.872 -6.580 -16.089 1.00 0.00 H new ATOM 0 HG2 LYS B 50 2.271 -8.992 -15.628 1.00 0.00 H new ATOM 0 HG3 LYS B 50 1.574 -8.829 -14.029 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -0.595 -8.025 -15.144 1.00 0.00 H new ATOM 0 HD3 LYS B 50 0.120 -8.423 -16.694 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -0.212 -10.417 -14.392 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -1.317 -10.285 -15.746 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 0.227 -11.983 -16.279 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 0.672 -10.646 -17.228 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 1.563 -11.033 -15.835 1.00 0.00 H new ATOM 1716 N LEU B 51 3.126 -4.282 -14.044 1.00 0.00 N ATOM 1717 CA LEU B 51 3.510 -2.898 -14.311 1.00 0.00 C ATOM 1718 C LEU B 51 4.937 -2.689 -13.896 1.00 0.00 C ATOM 1719 O LEU B 51 5.726 -2.064 -14.603 1.00 0.00 O ATOM 1720 CB LEU B 51 2.603 -1.920 -13.557 1.00 0.00 C ATOM 1721 CG LEU B 51 1.692 -1.200 -14.547 1.00 0.00 C ATOM 1722 CD1 LEU B 51 2.543 -0.272 -15.433 1.00 0.00 C ATOM 1723 CD2 LEU B 51 0.933 -2.230 -15.409 1.00 0.00 C ATOM 0 H LEU B 51 2.444 -4.400 -13.295 1.00 0.00 H new ATOM 0 HA LEU B 51 3.402 -2.707 -15.379 1.00 0.00 H new ATOM 0 HB2 LEU B 51 2.005 -2.457 -12.821 1.00 0.00 H new ATOM 0 HB3 LEU B 51 3.207 -1.196 -13.010 1.00 0.00 H new ATOM 0 HG LEU B 51 0.959 -0.602 -14.006 1.00 0.00 H new ATOM 0 HD11 LEU B 51 1.898 0.246 -16.143 1.00 0.00 H new ATOM 0 HD12 LEU B 51 3.055 0.459 -14.808 1.00 0.00 H new ATOM 0 HD13 LEU B 51 3.280 -0.863 -15.977 1.00 0.00 H new ATOM 0 HD21 LEU B 51 0.285 -1.708 -16.113 1.00 0.00 H new ATOM 0 HD22 LEU B 51 1.648 -2.842 -15.959 1.00 0.00 H new ATOM 0 HD23 LEU B 51 0.329 -2.869 -14.765 1.00 0.00 H new ATOM 1735 N ASN B 52 5.266 -3.267 -12.760 1.00 0.00 N ATOM 1736 CA ASN B 52 6.619 -3.205 -12.258 1.00 0.00 C ATOM 1737 C ASN B 52 7.499 -3.886 -13.276 1.00 0.00 C ATOM 1738 O ASN B 52 8.591 -3.420 -13.593 1.00 0.00 O ATOM 1739 CB ASN B 52 6.715 -3.907 -10.910 1.00 0.00 C ATOM 1740 CG ASN B 52 8.169 -4.018 -10.470 1.00 0.00 C ATOM 1741 OD1 ASN B 52 8.655 -3.208 -9.683 1.00 0.00 O ATOM 1742 ND2 ASN B 52 8.895 -4.979 -10.948 1.00 0.00 N ATOM 0 H ASN B 52 4.615 -3.784 -12.169 1.00 0.00 H new ATOM 0 HA ASN B 52 6.933 -2.172 -12.109 1.00 0.00 H new ATOM 0 HB2 ASN B 52 6.144 -3.354 -10.164 1.00 0.00 H new ATOM 0 HB3 ASN B 52 6.272 -4.901 -10.978 1.00 0.00 H new ATOM 0 HD21 ASN B 52 9.873 -5.065 -10.672 1.00 0.00 H new ATOM 0 HD22 ASN B 52 8.488 -5.649 -11.601 1.00 0.00 H new ATOM 1749 N ASP B 53 6.961 -4.975 -13.817 1.00 0.00 N ATOM 1750 CA ASP B 53 7.653 -5.721 -14.857 1.00 0.00 C ATOM 1751 C ASP B 53 7.734 -4.865 -16.120 1.00 0.00 C ATOM 1752 O ASP B 53 8.720 -4.907 -16.858 1.00 0.00 O ATOM 1753 CB ASP B 53 6.918 -7.037 -15.163 1.00 0.00 C ATOM 1754 CG ASP B 53 7.018 -8.028 -13.992 1.00 0.00 C ATOM 1755 OD1 ASP B 53 7.881 -7.857 -13.141 1.00 0.00 O ATOM 1756 OD2 ASP B 53 6.216 -8.947 -13.963 1.00 0.00 O ATOM 0 H ASP B 53 6.053 -5.357 -13.553 1.00 0.00 H new ATOM 0 HA ASP B 53 8.658 -5.963 -14.510 1.00 0.00 H new ATOM 0 HB2 ASP B 53 5.869 -6.828 -15.374 1.00 0.00 H new ATOM 0 HB3 ASP B 53 7.340 -7.490 -16.060 1.00 0.00 H new ATOM 1761 N ALA B 54 6.672 -4.090 -16.346 1.00 0.00 N ATOM 1762 CA ALA B 54 6.579 -3.209 -17.502 1.00 0.00 C ATOM 1763 C ALA B 54 7.623 -2.099 -17.421 1.00 0.00 C ATOM 1764 O ALA B 54 8.218 -1.718 -18.430 1.00 0.00 O ATOM 1765 CB ALA B 54 5.177 -2.602 -17.557 1.00 0.00 C ATOM 0 H ALA B 54 5.857 -4.058 -15.733 1.00 0.00 H new ATOM 0 HA ALA B 54 6.767 -3.788 -18.406 1.00 0.00 H new ATOM 0 HB1 ALA B 54 5.100 -1.941 -18.420 1.00 0.00 H new ATOM 0 HB2 ALA B 54 4.439 -3.399 -17.643 1.00 0.00 H new ATOM 0 HB3 ALA B 54 4.991 -2.032 -16.646 1.00 0.00 H new ATOM 1771 N GLN B 55 7.837 -1.589 -16.207 1.00 0.00 N ATOM 1772 CA GLN B 55 8.806 -0.523 -15.976 1.00 0.00 C ATOM 1773 C GLN B 55 10.172 -1.086 -15.589 1.00 0.00 C ATOM 1774 O GLN B 55 11.138 -0.335 -15.434 1.00 0.00 O ATOM 1775 CB GLN B 55 8.293 0.368 -14.864 1.00 0.00 C ATOM 1776 CG GLN B 55 7.010 1.070 -15.307 1.00 0.00 C ATOM 1777 CD GLN B 55 6.151 1.360 -14.089 1.00 0.00 C ATOM 1778 OE1 GLN B 55 5.853 2.517 -13.795 1.00 0.00 O ATOM 1779 NE2 GLN B 55 5.745 0.364 -13.353 1.00 0.00 N ATOM 0 H GLN B 55 7.349 -1.900 -15.367 1.00 0.00 H new ATOM 0 HA GLN B 55 8.927 0.045 -16.898 1.00 0.00 H new ATOM 0 HB2 GLN B 55 8.102 -0.226 -13.970 1.00 0.00 H new ATOM 0 HB3 GLN B 55 9.050 1.107 -14.601 1.00 0.00 H new ATOM 0 HG2 GLN B 55 7.250 1.998 -15.826 1.00 0.00 H new ATOM 0 HG3 GLN B 55 6.463 0.443 -16.011 1.00 0.00 H new ATOM 0 HE21 GLN B 55 5.997 -0.592 -13.604 1.00 0.00 H new ATOM 0 HE22 GLN B 55 5.175 0.540 -12.526 1.00 0.00 H new ATOM 1788 N ALA B 56 10.243 -2.407 -15.425 1.00 0.00 N ATOM 1789 CA ALA B 56 11.496 -3.062 -15.042 1.00 0.00 C ATOM 1790 C ALA B 56 12.563 -2.879 -16.110 1.00 0.00 C ATOM 1791 O ALA B 56 12.263 -2.503 -17.247 1.00 0.00 O ATOM 1792 CB ALA B 56 11.279 -4.557 -14.810 1.00 0.00 C ATOM 0 H ALA B 56 9.454 -3.042 -15.550 1.00 0.00 H new ATOM 0 HA ALA B 56 11.833 -2.594 -14.117 1.00 0.00 H new ATOM 0 HB1 ALA B 56 12.223 -5.022 -14.527 1.00 0.00 H new ATOM 0 HB2 ALA B 56 10.550 -4.699 -14.012 1.00 0.00 H new ATOM 0 HB3 ALA B 56 10.908 -5.017 -15.726 1.00 0.00 H new