USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 933 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 57 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 66 LYS NZ :NH3+ 151:sc= 0.771 (180deg=0.312) USER MOD Single : A 5 MET CE :methyl -110:sc= -0.191 (180deg=-0.559) USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 16 LYS NZ :NH3+ -107:sc= 0.124 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 169:sc= 0.208 (180deg=0.163) USER MOD Single : A 27 TYR OH : rot 180:sc= -0.0484 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.0462 X(o=-0.046,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 146:sc= -0.157 (180deg=-1.15) USER MOD Single : A 41 SER OG : rot 132:sc= 0.118 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 136:sc= -0.0534 (180deg=-2.69!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl 164:sc= -3.49 (180deg=-5.06!) USER MOD Single : A 71 ASN : amide:sc= -0.779! K(o=-0.78!,f=-2.4) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 7:sc= 1.05 USER MOD Single : A 84 GLN : amide:sc= -0.689 X(o=-0.69,f=-0.7) USER MOD Single : A 86 TYR OH : rot 130:sc= -0.445 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 17 N GLU A 2 -16.243 0.728 8.103 1.00 0.00 N ATOM 18 CA GLU A 2 -15.895 -0.248 7.084 1.00 0.00 C ATOM 19 C GLU A 2 -15.506 0.458 5.784 1.00 0.00 C ATOM 20 O GLU A 2 -16.354 1.046 5.115 1.00 0.00 O ATOM 21 CB GLU A 2 -17.043 -1.231 6.852 1.00 0.00 C ATOM 22 CG GLU A 2 -16.511 -2.621 6.495 1.00 0.00 C ATOM 23 CD GLU A 2 -17.632 -3.518 5.965 1.00 0.00 C ATOM 24 OE1 GLU A 2 -18.078 -3.257 4.827 1.00 0.00 O ATOM 25 OE2 GLU A 2 -18.019 -4.443 6.711 1.00 0.00 O ATOM 0 HA GLU A 2 -15.036 -0.820 7.435 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -17.660 -1.293 7.748 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -17.683 -0.865 6.049 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -15.726 -2.532 5.744 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -16.060 -3.079 7.375 1.00 0.00 H new ATOM 32 N TRP A 3 -14.223 0.376 5.464 1.00 0.00 N ATOM 33 CA TRP A 3 -13.711 0.999 4.255 1.00 0.00 C ATOM 34 C TRP A 3 -13.868 0.001 3.106 1.00 0.00 C ATOM 35 O TRP A 3 -13.513 -1.168 3.242 1.00 0.00 O ATOM 36 CB TRP A 3 -12.268 1.467 4.448 1.00 0.00 C ATOM 37 CG TRP A 3 -12.124 2.679 5.371 1.00 0.00 C ATOM 38 CD1 TRP A 3 -11.737 2.698 6.654 1.00 0.00 C ATOM 39 CD2 TRP A 3 -12.383 4.056 5.028 1.00 0.00 C ATOM 40 NE1 TRP A 3 -11.728 3.981 7.161 1.00 0.00 N ATOM 41 CE2 TRP A 3 -12.133 4.834 6.140 1.00 0.00 C ATOM 42 CE3 TRP A 3 -12.814 4.627 3.817 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -12.285 6.225 6.153 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -12.961 6.019 3.846 1.00 0.00 C ATOM 45 CH2 TRP A 3 -12.714 6.815 4.958 1.00 0.00 C ATOM 0 H TRP A 3 -13.522 -0.113 6.021 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.278 1.898 4.015 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.681 0.643 4.853 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -11.843 1.712 3.475 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -11.466 1.819 7.220 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -11.472 4.254 8.110 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -13.016 4.038 2.934 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -12.082 6.812 7.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -13.289 6.508 2.941 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.852 7.885 4.901 1.00 0.00 H new ATOM 56 N GLU A 4 -14.400 0.500 2.000 1.00 0.00 N ATOM 57 CA GLU A 4 -14.608 -0.333 0.828 1.00 0.00 C ATOM 58 C GLU A 4 -14.021 0.342 -0.414 1.00 0.00 C ATOM 59 O GLU A 4 -14.268 1.522 -0.659 1.00 0.00 O ATOM 60 CB GLU A 4 -16.093 -0.644 0.633 1.00 0.00 C ATOM 61 CG GLU A 4 -16.878 0.623 0.287 1.00 0.00 C ATOM 62 CD GLU A 4 -18.252 0.617 0.959 1.00 0.00 C ATOM 63 OE1 GLU A 4 -19.009 -0.343 0.695 1.00 0.00 O ATOM 64 OE2 GLU A 4 -18.515 1.572 1.721 1.00 0.00 O ATOM 0 H GLU A 4 -14.693 1.471 1.891 1.00 0.00 H new ATOM 0 HA GLU A 4 -14.090 -1.279 0.982 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -16.213 -1.379 -0.163 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -16.497 -1.090 1.542 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -16.317 1.501 0.606 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -16.998 0.697 -0.794 1.00 0.00 H new ATOM 71 N MET A 5 -13.256 -0.436 -1.165 1.00 0.00 N ATOM 72 CA MET A 5 -12.632 0.072 -2.375 1.00 0.00 C ATOM 73 C MET A 5 -13.012 -0.781 -3.587 1.00 0.00 C ATOM 74 O MET A 5 -14.016 -1.492 -3.561 1.00 0.00 O ATOM 75 CB MET A 5 -11.112 0.070 -2.206 1.00 0.00 C ATOM 76 CG MET A 5 -10.711 0.630 -0.840 1.00 0.00 C ATOM 77 SD MET A 5 -11.315 2.301 -0.665 1.00 0.00 S ATOM 78 CE MET A 5 -10.498 2.769 0.852 1.00 0.00 C ATOM 0 H MET A 5 -13.054 -1.414 -0.959 1.00 0.00 H new ATOM 0 HA MET A 5 -12.986 1.089 -2.544 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.732 -0.946 -2.312 1.00 0.00 H new ATOM 0 HB3 MET A 5 -10.654 0.666 -2.996 1.00 0.00 H new ATOM 0 HG2 MET A 5 -11.117 0.003 -0.047 1.00 0.00 H new ATOM 0 HG3 MET A 5 -9.626 0.614 -0.735 1.00 0.00 H new ATOM 0 HE1 MET A 5 -11.235 2.856 1.650 1.00 0.00 H new ATOM 0 HE2 MET A 5 -9.763 2.010 1.118 1.00 0.00 H new ATOM 0 HE3 MET A 5 -9.997 3.727 0.715 1.00 0.00 H new ATOM 88 N GLY A 6 -12.190 -0.682 -4.622 1.00 0.00 N ATOM 89 CA GLY A 6 -12.427 -1.436 -5.841 1.00 0.00 C ATOM 90 C GLY A 6 -11.169 -1.484 -6.709 1.00 0.00 C ATOM 91 O GLY A 6 -11.188 -1.054 -7.861 1.00 0.00 O ATOM 0 H GLY A 6 -11.359 -0.091 -4.641 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -12.739 -2.450 -5.591 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -13.243 -0.980 -6.402 1.00 0.00 H new ATOM 95 N LEU A 7 -10.104 -2.012 -6.123 1.00 0.00 N ATOM 96 CA LEU A 7 -8.839 -2.123 -6.829 1.00 0.00 C ATOM 97 C LEU A 7 -8.916 -3.280 -7.827 1.00 0.00 C ATOM 98 O LEU A 7 -9.919 -3.990 -7.884 1.00 0.00 O ATOM 99 CB LEU A 7 -7.681 -2.243 -5.837 1.00 0.00 C ATOM 100 CG LEU A 7 -7.859 -3.273 -4.719 1.00 0.00 C ATOM 101 CD1 LEU A 7 -6.540 -3.984 -4.414 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.465 -2.628 -3.471 1.00 0.00 C ATOM 0 H LEU A 7 -10.091 -2.368 -5.167 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.643 -1.218 -7.404 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.777 -2.492 -6.393 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.516 -1.267 -5.381 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.562 -4.032 -5.062 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.694 -4.710 -3.616 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -6.188 -4.497 -5.309 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.796 -3.252 -4.099 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.581 -3.381 -2.692 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.807 -1.836 -3.115 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.440 -2.207 -3.716 1.00 0.00 H new ATOM 114 N GLN A 8 -7.844 -3.434 -8.590 1.00 0.00 N ATOM 115 CA GLN A 8 -7.777 -4.492 -9.583 1.00 0.00 C ATOM 116 C GLN A 8 -7.543 -5.843 -8.904 1.00 0.00 C ATOM 117 O GLN A 8 -7.034 -5.900 -7.785 1.00 0.00 O ATOM 118 CB GLN A 8 -6.690 -4.204 -10.620 1.00 0.00 C ATOM 119 CG GLN A 8 -7.271 -4.189 -12.035 1.00 0.00 C ATOM 120 CD GLN A 8 -6.183 -4.452 -13.078 1.00 0.00 C ATOM 121 OE1 GLN A 8 -5.000 -4.284 -12.833 1.00 0.00 O ATOM 122 NE2 GLN A 8 -6.648 -4.871 -14.251 1.00 0.00 N ATOM 0 H GLN A 8 -7.014 -2.843 -8.540 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.732 -4.531 -10.108 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -6.223 -3.243 -10.405 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -5.908 -4.961 -10.552 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -8.051 -4.946 -12.120 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -7.740 -3.224 -12.229 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -7.652 -4.990 -14.389 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -6.001 -5.073 -15.013 1.00 0.00 H new ATOM 131 N GLU A 9 -7.926 -6.898 -9.609 1.00 0.00 N ATOM 132 CA GLU A 9 -7.764 -8.245 -9.088 1.00 0.00 C ATOM 133 C GLU A 9 -6.284 -8.546 -8.845 1.00 0.00 C ATOM 134 O GLU A 9 -5.909 -9.004 -7.767 1.00 0.00 O ATOM 135 CB GLU A 9 -8.385 -9.276 -10.032 1.00 0.00 C ATOM 136 CG GLU A 9 -9.415 -10.140 -9.300 1.00 0.00 C ATOM 137 CD GLU A 9 -10.641 -10.394 -10.180 1.00 0.00 C ATOM 138 OE1 GLU A 9 -10.436 -10.586 -11.398 1.00 0.00 O ATOM 139 OE2 GLU A 9 -11.755 -10.391 -9.614 1.00 0.00 O ATOM 0 H GLU A 9 -8.348 -6.847 -10.536 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.289 -8.310 -8.135 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -8.862 -8.767 -10.870 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -7.603 -9.911 -10.448 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -8.963 -11.090 -9.017 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.721 -9.645 -8.378 1.00 0.00 H new ATOM 146 N GLU A 10 -5.482 -8.276 -9.865 1.00 0.00 N ATOM 147 CA GLU A 10 -4.052 -8.512 -9.776 1.00 0.00 C ATOM 148 C GLU A 10 -3.468 -7.784 -8.562 1.00 0.00 C ATOM 149 O GLU A 10 -2.518 -8.262 -7.945 1.00 0.00 O ATOM 150 CB GLU A 10 -3.344 -8.085 -11.063 1.00 0.00 C ATOM 151 CG GLU A 10 -2.540 -9.243 -11.657 1.00 0.00 C ATOM 152 CD GLU A 10 -1.587 -8.748 -12.747 1.00 0.00 C ATOM 153 OE1 GLU A 10 -2.088 -8.486 -13.862 1.00 0.00 O ATOM 154 OE2 GLU A 10 -0.380 -8.642 -12.441 1.00 0.00 O ATOM 0 H GLU A 10 -5.796 -7.896 -10.758 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.888 -9.582 -9.648 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.079 -7.738 -11.789 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.680 -7.246 -10.856 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -1.971 -9.737 -10.869 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.220 -9.986 -12.074 1.00 0.00 H new ATOM 161 N PHE A 11 -4.062 -6.639 -8.257 1.00 0.00 N ATOM 162 CA PHE A 11 -3.613 -5.841 -7.129 1.00 0.00 C ATOM 163 C PHE A 11 -4.070 -6.457 -5.805 1.00 0.00 C ATOM 164 O PHE A 11 -3.418 -6.282 -4.777 1.00 0.00 O ATOM 165 CB PHE A 11 -4.248 -4.457 -7.280 1.00 0.00 C ATOM 166 CG PHE A 11 -3.237 -3.309 -7.309 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.234 -3.309 -8.227 1.00 0.00 C ATOM 168 CD2 PHE A 11 -3.341 -2.289 -6.415 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.296 -2.243 -8.254 1.00 0.00 C ATOM 170 CE2 PHE A 11 -2.403 -1.223 -6.442 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.400 -1.223 -7.361 1.00 0.00 C ATOM 0 H PHE A 11 -4.850 -6.245 -8.771 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.524 -5.791 -7.119 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.833 -4.435 -8.199 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -4.943 -4.295 -6.456 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.151 -4.120 -8.936 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -4.137 -2.290 -5.685 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -0.500 -2.243 -8.984 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -2.486 -0.412 -5.733 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.686 -0.413 -7.381 1.00 0.00 H new ATOM 181 N LEU A 12 -5.188 -7.166 -5.874 1.00 0.00 N ATOM 182 CA LEU A 12 -5.739 -7.809 -4.693 1.00 0.00 C ATOM 183 C LEU A 12 -4.762 -8.876 -4.195 1.00 0.00 C ATOM 184 O LEU A 12 -4.472 -8.949 -3.002 1.00 0.00 O ATOM 185 CB LEU A 12 -7.142 -8.346 -4.982 1.00 0.00 C ATOM 186 CG LEU A 12 -8.270 -7.312 -4.982 1.00 0.00 C ATOM 187 CD1 LEU A 12 -9.550 -7.896 -5.584 1.00 0.00 C ATOM 188 CD2 LEU A 12 -8.501 -6.754 -3.577 1.00 0.00 C ATOM 0 H LEU A 12 -5.726 -7.309 -6.728 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.859 -7.086 -3.886 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.128 -8.839 -5.954 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.377 -9.110 -4.241 1.00 0.00 H new ATOM 0 HG LEU A 12 -7.968 -6.478 -5.615 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.335 -7.140 -5.572 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.360 -8.206 -6.612 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.867 -8.759 -4.998 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.308 -6.021 -3.605 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -8.772 -7.567 -2.903 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.589 -6.276 -3.221 1.00 0.00 H new ATOM 200 N GLU A 13 -4.282 -9.677 -5.135 1.00 0.00 N ATOM 201 CA GLU A 13 -3.344 -10.737 -4.807 1.00 0.00 C ATOM 202 C GLU A 13 -2.069 -10.148 -4.198 1.00 0.00 C ATOM 203 O GLU A 13 -1.429 -10.779 -3.359 1.00 0.00 O ATOM 204 CB GLU A 13 -3.022 -11.585 -6.038 1.00 0.00 C ATOM 205 CG GLU A 13 -2.643 -13.013 -5.637 1.00 0.00 C ATOM 206 CD GLU A 13 -3.867 -13.931 -5.659 1.00 0.00 C ATOM 207 OE1 GLU A 13 -4.861 -13.568 -4.994 1.00 0.00 O ATOM 208 OE2 GLU A 13 -3.780 -14.976 -6.340 1.00 0.00 O ATOM 0 H GLU A 13 -4.525 -9.613 -6.124 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.808 -11.390 -4.068 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.884 -11.607 -6.704 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.202 -11.130 -6.593 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.884 -13.397 -6.318 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.204 -13.010 -4.639 1.00 0.00 H new ATOM 215 N LEU A 14 -1.739 -8.945 -4.646 1.00 0.00 N ATOM 216 CA LEU A 14 -0.553 -8.264 -4.156 1.00 0.00 C ATOM 217 C LEU A 14 -0.679 -8.050 -2.646 1.00 0.00 C ATOM 218 O LEU A 14 0.267 -8.296 -1.899 1.00 0.00 O ATOM 219 CB LEU A 14 -0.313 -6.974 -4.942 1.00 0.00 C ATOM 220 CG LEU A 14 0.137 -7.147 -6.394 1.00 0.00 C ATOM 221 CD1 LEU A 14 0.850 -5.892 -6.900 1.00 0.00 C ATOM 222 CD2 LEU A 14 0.999 -8.401 -6.556 1.00 0.00 C ATOM 0 H LEU A 14 -2.272 -8.425 -5.343 1.00 0.00 H new ATOM 0 HA LEU A 14 0.333 -8.878 -4.318 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.234 -6.391 -4.935 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.440 -6.387 -4.417 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.750 -7.285 -7.012 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.160 -6.041 -7.934 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.172 -5.041 -6.844 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.728 -5.698 -6.283 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.305 -8.500 -7.597 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.883 -8.319 -5.924 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.423 -9.279 -6.262 1.00 0.00 H new ATOM 234 N ILE A 15 -1.856 -7.595 -2.242 1.00 0.00 N ATOM 235 CA ILE A 15 -2.119 -7.345 -0.835 1.00 0.00 C ATOM 236 C ILE A 15 -1.896 -8.635 -0.042 1.00 0.00 C ATOM 237 O ILE A 15 -1.423 -8.596 1.093 1.00 0.00 O ATOM 238 CB ILE A 15 -3.513 -6.742 -0.649 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.518 -5.254 -1.004 1.00 0.00 C ATOM 240 CG2 ILE A 15 -4.035 -6.996 0.767 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.724 -5.050 -2.507 1.00 0.00 C ATOM 0 H ILE A 15 -2.638 -7.393 -2.865 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.422 -6.604 -0.443 1.00 0.00 H new ATOM 0 HB ILE A 15 -4.196 -7.239 -1.338 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.310 -4.747 -0.453 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.576 -4.800 -0.697 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -5.027 -6.557 0.873 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.092 -8.070 0.947 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.358 -6.542 1.491 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.724 -3.984 -2.733 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.917 -5.537 -3.054 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.678 -5.484 -2.806 1.00 0.00 H new ATOM 253 N LYS A 16 -2.247 -9.747 -0.671 1.00 0.00 N ATOM 254 CA LYS A 16 -2.090 -11.045 -0.039 1.00 0.00 C ATOM 255 C LYS A 16 -0.601 -11.337 0.156 1.00 0.00 C ATOM 256 O LYS A 16 -0.210 -11.954 1.146 1.00 0.00 O ATOM 257 CB LYS A 16 -2.829 -12.122 -0.837 1.00 0.00 C ATOM 258 CG LYS A 16 -3.855 -12.846 0.037 1.00 0.00 C ATOM 259 CD LYS A 16 -4.406 -14.083 -0.674 1.00 0.00 C ATOM 260 CE LYS A 16 -5.604 -13.722 -1.555 1.00 0.00 C ATOM 261 NZ LYS A 16 -6.027 -14.890 -2.359 1.00 0.00 N ATOM 0 H LYS A 16 -2.640 -9.775 -1.612 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.547 -11.044 0.951 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.330 -11.667 -1.691 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.113 -12.841 -1.234 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.392 -13.140 0.979 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.673 -12.168 0.281 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.624 -14.534 -1.285 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.704 -14.828 0.064 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.432 -13.383 -0.932 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.342 -12.895 -2.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -5.752 -14.746 -3.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -5.567 -15.748 -1.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -7.060 -14.998 -2.298 1.00 0.00 H new ATOM 275 N LEU A 17 0.189 -10.880 -0.804 1.00 0.00 N ATOM 276 CA LEU A 17 1.627 -11.084 -0.750 1.00 0.00 C ATOM 277 C LEU A 17 2.263 -9.979 0.095 1.00 0.00 C ATOM 278 O LEU A 17 3.381 -10.133 0.585 1.00 0.00 O ATOM 279 CB LEU A 17 2.207 -11.190 -2.162 1.00 0.00 C ATOM 280 CG LEU A 17 2.068 -12.553 -2.844 1.00 0.00 C ATOM 281 CD1 LEU A 17 1.530 -12.401 -4.268 1.00 0.00 C ATOM 282 CD2 LEU A 17 3.391 -13.320 -2.809 1.00 0.00 C ATOM 0 H LEU A 17 -0.139 -10.369 -1.624 1.00 0.00 H new ATOM 0 HA LEU A 17 1.859 -12.031 -0.264 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.723 -10.441 -2.789 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.266 -10.934 -2.119 1.00 0.00 H new ATOM 0 HG LEU A 17 1.340 -13.142 -2.287 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.441 -13.384 -4.730 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.550 -11.924 -4.238 1.00 0.00 H new ATOM 0 HD13 LEU A 17 2.215 -11.786 -4.852 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.265 -14.285 -3.300 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.158 -12.746 -3.328 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.694 -13.476 -1.774 1.00 0.00 H new ATOM 294 N ARG A 18 1.524 -8.889 0.240 1.00 0.00 N ATOM 295 CA ARG A 18 2.003 -7.758 1.017 1.00 0.00 C ATOM 296 C ARG A 18 1.876 -8.051 2.514 1.00 0.00 C ATOM 297 O ARG A 18 2.239 -7.221 3.345 1.00 0.00 O ATOM 298 CB ARG A 18 1.215 -6.489 0.685 1.00 0.00 C ATOM 299 CG ARG A 18 1.572 -5.972 -0.710 1.00 0.00 C ATOM 300 CD ARG A 18 0.416 -5.168 -1.309 1.00 0.00 C ATOM 301 NE ARG A 18 0.943 -4.099 -2.186 1.00 0.00 N ATOM 302 CZ ARG A 18 0.281 -2.972 -2.478 1.00 0.00 C ATOM 303 NH1 ARG A 18 -0.939 -2.760 -1.965 1.00 0.00 N ATOM 304 NH2 ARG A 18 0.837 -2.056 -3.283 1.00 0.00 N ATOM 0 H ARG A 18 0.597 -8.765 -0.167 1.00 0.00 H new ATOM 0 HA ARG A 18 3.051 -7.600 0.761 1.00 0.00 H new ATOM 0 HB2 ARG A 18 0.146 -6.696 0.738 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.428 -5.720 1.427 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.463 -5.347 -0.653 1.00 0.00 H new ATOM 0 HG3 ARG A 18 1.812 -6.811 -1.362 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.239 -5.827 -1.879 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.186 -4.732 -0.512 1.00 0.00 H new ATOM 0 HE ARG A 18 1.869 -4.229 -2.594 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.363 -3.457 -1.352 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -1.444 -1.902 -2.187 1.00 0.00 H new ATOM 0 HH21 ARG A 18 1.765 -2.217 -3.674 1.00 0.00 H new ATOM 0 HH22 ARG A 18 0.332 -1.198 -3.505 1.00 0.00 H new ATOM 318 N LYS A 19 1.360 -9.235 2.811 1.00 0.00 N ATOM 319 CA LYS A 19 1.182 -9.648 4.192 1.00 0.00 C ATOM 320 C LYS A 19 2.542 -10.011 4.791 1.00 0.00 C ATOM 321 O LYS A 19 2.656 -10.226 5.997 1.00 0.00 O ATOM 322 CB LYS A 19 0.149 -10.772 4.286 1.00 0.00 C ATOM 323 CG LYS A 19 -0.281 -11.003 5.737 1.00 0.00 C ATOM 324 CD LYS A 19 -0.043 -12.455 6.155 1.00 0.00 C ATOM 325 CE LYS A 19 -1.245 -13.332 5.798 1.00 0.00 C ATOM 326 NZ LYS A 19 -1.561 -14.256 6.910 1.00 0.00 N ATOM 0 H LYS A 19 1.060 -9.921 2.118 1.00 0.00 H new ATOM 0 HA LYS A 19 0.781 -8.827 4.786 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.722 -10.522 3.680 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.568 -11.691 3.877 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.275 -10.336 6.395 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.337 -10.756 5.851 1.00 0.00 H new ATOM 0 HD2 LYS A 19 0.850 -12.838 5.661 1.00 0.00 H new ATOM 0 HD3 LYS A 19 0.141 -12.503 7.228 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -2.109 -12.704 5.582 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -1.031 -13.902 4.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -2.379 -14.844 6.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -0.741 -14.867 7.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.786 -13.707 7.764 1.00 0.00 H new ATOM 340 N LYS A 20 3.540 -10.068 3.921 1.00 0.00 N ATOM 341 CA LYS A 20 4.888 -10.402 4.350 1.00 0.00 C ATOM 342 C LYS A 20 5.822 -9.230 4.038 1.00 0.00 C ATOM 343 O LYS A 20 6.983 -9.233 4.442 1.00 0.00 O ATOM 344 CB LYS A 20 5.335 -11.726 3.728 1.00 0.00 C ATOM 345 CG LYS A 20 6.503 -12.331 4.510 1.00 0.00 C ATOM 346 CD LYS A 20 7.788 -12.309 3.679 1.00 0.00 C ATOM 347 CE LYS A 20 9.015 -12.120 4.573 1.00 0.00 C ATOM 348 NZ LYS A 20 10.250 -12.087 3.757 1.00 0.00 N ATOM 0 H LYS A 20 3.442 -9.889 2.922 1.00 0.00 H new ATOM 0 HA LYS A 20 4.918 -10.557 5.429 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.500 -12.426 3.715 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.631 -11.564 2.692 1.00 0.00 H new ATOM 0 HG2 LYS A 20 6.654 -11.774 5.435 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.265 -13.357 4.791 1.00 0.00 H new ATOM 0 HD2 LYS A 20 7.880 -13.241 3.121 1.00 0.00 H new ATOM 0 HD3 LYS A 20 7.739 -11.502 2.948 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.921 -11.193 5.139 1.00 0.00 H new ATOM 0 HE3 LYS A 20 9.073 -12.932 5.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.074 -11.958 4.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.346 -12.982 3.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 10.199 -11.298 3.082 1.00 0.00 H new ATOM 362 N LYS A 21 5.279 -8.257 3.322 1.00 0.00 N ATOM 363 CA LYS A 21 6.049 -7.081 2.952 1.00 0.00 C ATOM 364 C LYS A 21 5.439 -5.847 3.618 1.00 0.00 C ATOM 365 O LYS A 21 5.424 -5.742 4.844 1.00 0.00 O ATOM 366 CB LYS A 21 6.156 -6.969 1.429 1.00 0.00 C ATOM 367 CG LYS A 21 6.753 -8.242 0.826 1.00 0.00 C ATOM 368 CD LYS A 21 6.451 -8.332 -0.671 1.00 0.00 C ATOM 369 CE LYS A 21 7.147 -9.542 -1.299 1.00 0.00 C ATOM 370 NZ LYS A 21 7.187 -9.410 -2.772 1.00 0.00 N ATOM 0 H LYS A 21 4.315 -8.258 2.988 1.00 0.00 H new ATOM 0 HA LYS A 21 7.073 -7.166 3.315 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.169 -6.789 1.004 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.777 -6.112 1.167 1.00 0.00 H new ATOM 0 HG2 LYS A 21 7.831 -8.253 0.985 1.00 0.00 H new ATOM 0 HG3 LYS A 21 6.347 -9.116 1.336 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.374 -8.407 -0.825 1.00 0.00 H new ATOM 0 HD3 LYS A 21 6.781 -7.420 -1.168 1.00 0.00 H new ATOM 0 HE2 LYS A 21 8.161 -9.629 -0.908 1.00 0.00 H new ATOM 0 HE3 LYS A 21 6.620 -10.455 -1.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 7.818 -10.135 -3.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 6.230 -9.536 -3.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 7.541 -8.466 -3.026 1.00 0.00 H new ATOM 384 N ILE A 22 4.951 -4.942 2.782 1.00 0.00 N ATOM 385 CA ILE A 22 4.342 -3.719 3.275 1.00 0.00 C ATOM 386 C ILE A 22 3.577 -3.040 2.137 1.00 0.00 C ATOM 387 O ILE A 22 3.679 -3.454 0.983 1.00 0.00 O ATOM 388 CB ILE A 22 5.395 -2.821 3.929 1.00 0.00 C ATOM 389 CG1 ILE A 22 5.312 -2.900 5.454 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.280 -1.382 3.422 1.00 0.00 C ATOM 391 CD1 ILE A 22 3.888 -2.625 5.941 1.00 0.00 C ATOM 0 H ILE A 22 4.965 -5.032 1.766 1.00 0.00 H new ATOM 0 HA ILE A 22 3.617 -3.944 4.058 1.00 0.00 H new ATOM 0 HB ILE A 22 6.381 -3.186 3.641 1.00 0.00 H new ATOM 0 HG12 ILE A 22 5.630 -3.888 5.788 1.00 0.00 H new ATOM 0 HG13 ILE A 22 5.997 -2.177 5.897 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.039 -0.765 3.902 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.428 -1.364 2.342 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.291 -0.990 3.660 1.00 0.00 H new ATOM 0 HD11 ILE A 22 3.857 -2.687 7.029 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.582 -1.627 5.626 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.209 -3.364 5.516 1.00 0.00 H new ATOM 403 N GLU A 23 2.828 -2.010 2.502 1.00 0.00 N ATOM 404 CA GLU A 23 2.046 -1.270 1.526 1.00 0.00 C ATOM 405 C GLU A 23 1.994 0.212 1.901 1.00 0.00 C ATOM 406 O GLU A 23 1.252 0.603 2.801 1.00 0.00 O ATOM 407 CB GLU A 23 0.637 -1.853 1.397 1.00 0.00 C ATOM 408 CG GLU A 23 -0.319 -0.842 0.761 1.00 0.00 C ATOM 409 CD GLU A 23 0.209 -0.367 -0.595 1.00 0.00 C ATOM 410 OE1 GLU A 23 1.194 -0.974 -1.065 1.00 0.00 O ATOM 411 OE2 GLU A 23 -0.386 0.594 -1.129 1.00 0.00 O ATOM 0 H GLU A 23 2.746 -1.670 3.460 1.00 0.00 H new ATOM 0 HA GLU A 23 2.532 -1.362 0.555 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.669 -2.759 0.792 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.267 -2.140 2.381 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -1.302 -1.295 0.634 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.446 0.012 1.426 1.00 0.00 H new ATOM 418 N GLY A 24 2.791 0.997 1.191 1.00 0.00 N ATOM 419 CA GLY A 24 2.845 2.428 1.438 1.00 0.00 C ATOM 420 C GLY A 24 2.329 3.213 0.230 1.00 0.00 C ATOM 421 O GLY A 24 2.017 2.629 -0.807 1.00 0.00 O ATOM 0 H GLY A 24 3.404 0.669 0.445 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.248 2.672 2.317 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.871 2.724 1.658 1.00 0.00 H new ATOM 425 N ARG A 25 2.255 4.524 0.404 1.00 0.00 N ATOM 426 CA ARG A 25 1.782 5.395 -0.658 1.00 0.00 C ATOM 427 C ARG A 25 1.696 6.840 -0.162 1.00 0.00 C ATOM 428 O ARG A 25 2.036 7.127 0.984 1.00 0.00 O ATOM 429 CB ARG A 25 0.406 4.953 -1.161 1.00 0.00 C ATOM 430 CG ARG A 25 -0.611 4.921 -0.018 1.00 0.00 C ATOM 431 CD ARG A 25 -1.365 3.590 0.007 1.00 0.00 C ATOM 432 NE ARG A 25 -2.048 3.420 1.309 1.00 0.00 N ATOM 433 CZ ARG A 25 -2.934 2.449 1.572 1.00 0.00 C ATOM 434 NH1 ARG A 25 -3.249 1.555 0.625 1.00 0.00 N ATOM 435 NH2 ARG A 25 -3.504 2.372 2.782 1.00 0.00 N ATOM 0 H ARG A 25 2.515 5.005 1.265 1.00 0.00 H new ATOM 0 HA ARG A 25 2.495 5.332 -1.480 1.00 0.00 H new ATOM 0 HB2 ARG A 25 0.063 5.635 -1.939 1.00 0.00 H new ATOM 0 HB3 ARG A 25 0.481 3.964 -1.614 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.100 5.071 0.933 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.319 5.742 -0.133 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.095 3.561 -0.802 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -0.671 2.766 -0.159 1.00 0.00 H new ATOM 0 HE ARG A 25 -1.831 4.083 2.053 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -2.815 1.613 -0.296 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -3.923 0.816 0.825 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.264 3.052 3.503 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -4.178 1.633 2.982 1.00 0.00 H new ATOM 449 N LEU A 26 1.240 7.711 -1.051 1.00 0.00 N ATOM 450 CA LEU A 26 1.106 9.118 -0.717 1.00 0.00 C ATOM 451 C LEU A 26 0.040 9.282 0.368 1.00 0.00 C ATOM 452 O LEU A 26 -1.061 8.745 0.248 1.00 0.00 O ATOM 453 CB LEU A 26 0.833 9.943 -1.977 1.00 0.00 C ATOM 454 CG LEU A 26 -0.222 11.044 -1.842 1.00 0.00 C ATOM 455 CD1 LEU A 26 0.237 12.126 -0.862 1.00 0.00 C ATOM 456 CD2 LEU A 26 -0.585 11.626 -3.210 1.00 0.00 C ATOM 0 H LEU A 26 0.959 7.469 -2.001 1.00 0.00 H new ATOM 0 HA LEU A 26 2.040 9.503 -0.307 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.769 10.401 -2.297 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.522 9.265 -2.771 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.128 10.600 -1.430 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.531 12.896 -0.784 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.405 11.681 0.119 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.164 12.573 -1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.336 12.406 -3.086 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.306 12.051 -3.673 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.984 10.837 -3.847 1.00 0.00 H new ATOM 468 N TYR A 27 0.403 10.025 1.403 1.00 0.00 N ATOM 469 CA TYR A 27 -0.508 10.265 2.508 1.00 0.00 C ATOM 470 C TYR A 27 -1.645 11.200 2.089 1.00 0.00 C ATOM 471 O TYR A 27 -1.647 12.378 2.441 1.00 0.00 O ATOM 472 CB TYR A 27 0.321 10.948 3.598 1.00 0.00 C ATOM 473 CG TYR A 27 -0.319 10.902 4.987 1.00 0.00 C ATOM 474 CD1 TYR A 27 -0.864 9.725 5.457 1.00 0.00 C ATOM 475 CD2 TYR A 27 -0.350 12.039 5.770 1.00 0.00 C ATOM 476 CE1 TYR A 27 -1.465 9.682 6.765 1.00 0.00 C ATOM 477 CE2 TYR A 27 -0.952 11.996 7.077 1.00 0.00 C ATOM 478 CZ TYR A 27 -1.480 10.820 7.510 1.00 0.00 C ATOM 479 OH TYR A 27 -2.048 10.779 8.745 1.00 0.00 O ATOM 0 H TYR A 27 1.316 10.469 1.499 1.00 0.00 H new ATOM 0 HA TYR A 27 -0.955 9.330 2.846 1.00 0.00 H new ATOM 0 HB2 TYR A 27 1.301 10.474 3.645 1.00 0.00 H new ATOM 0 HB3 TYR A 27 0.483 11.989 3.318 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -0.840 8.836 4.844 1.00 0.00 H new ATOM 0 HD2 TYR A 27 0.077 12.960 5.402 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -1.894 8.767 7.146 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -0.984 12.878 7.700 1.00 0.00 H new ATOM 0 HH TYR A 27 -1.986 11.663 9.163 1.00 0.00 H new ATOM 489 N ASP A 28 -2.585 10.638 1.342 1.00 0.00 N ATOM 490 CA ASP A 28 -3.724 11.407 0.870 1.00 0.00 C ATOM 491 C ASP A 28 -4.620 11.763 2.058 1.00 0.00 C ATOM 492 O ASP A 28 -4.292 11.455 3.203 1.00 0.00 O ATOM 493 CB ASP A 28 -4.559 10.599 -0.126 1.00 0.00 C ATOM 494 CG ASP A 28 -3.749 9.795 -1.145 1.00 0.00 C ATOM 495 OD1 ASP A 28 -3.218 10.434 -2.079 1.00 0.00 O ATOM 496 OD2 ASP A 28 -3.680 8.560 -0.968 1.00 0.00 O ATOM 0 H ASP A 28 -2.581 9.660 1.052 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.346 12.304 0.380 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.198 9.913 0.430 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.217 11.282 -0.664 1.00 0.00 H new ATOM 501 N GLU A 29 -5.735 12.407 1.745 1.00 0.00 N ATOM 502 CA GLU A 29 -6.681 12.808 2.773 1.00 0.00 C ATOM 503 C GLU A 29 -7.362 11.578 3.377 1.00 0.00 C ATOM 504 O GLU A 29 -7.469 11.460 4.597 1.00 0.00 O ATOM 505 CB GLU A 29 -7.715 13.787 2.214 1.00 0.00 C ATOM 506 CG GLU A 29 -7.096 15.168 1.987 1.00 0.00 C ATOM 507 CD GLU A 29 -7.147 16.008 3.265 1.00 0.00 C ATOM 508 OE1 GLU A 29 -8.221 16.005 3.904 1.00 0.00 O ATOM 509 OE2 GLU A 29 -6.110 16.634 3.575 1.00 0.00 O ATOM 0 H GLU A 29 -6.005 12.661 0.795 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.133 13.321 3.563 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.113 13.404 1.274 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.554 13.870 2.905 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.062 15.058 1.661 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.629 15.683 1.188 1.00 0.00 H new ATOM 516 N LYS A 30 -7.805 10.693 2.496 1.00 0.00 N ATOM 517 CA LYS A 30 -8.472 9.477 2.927 1.00 0.00 C ATOM 518 C LYS A 30 -7.470 8.584 3.663 1.00 0.00 C ATOM 519 O LYS A 30 -7.815 7.946 4.656 1.00 0.00 O ATOM 520 CB LYS A 30 -9.153 8.790 1.741 1.00 0.00 C ATOM 521 CG LYS A 30 -10.668 8.999 1.782 1.00 0.00 C ATOM 522 CD LYS A 30 -11.239 9.151 0.371 1.00 0.00 C ATOM 523 CE LYS A 30 -11.911 10.514 0.195 1.00 0.00 C ATOM 524 NZ LYS A 30 -13.370 10.405 0.416 1.00 0.00 N ATOM 0 H LYS A 30 -7.715 10.794 1.485 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.270 9.710 3.632 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.753 9.186 0.808 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -8.929 7.723 1.756 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.142 8.154 2.281 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.900 9.887 2.370 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -10.441 9.038 -0.362 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.962 8.358 0.180 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -11.483 11.230 0.897 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.717 10.895 -0.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -13.811 11.339 0.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -13.776 9.737 -0.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -13.550 10.062 1.381 1.00 0.00 H new ATOM 538 N ARG A 31 -6.250 8.568 3.146 1.00 0.00 N ATOM 539 CA ARG A 31 -5.197 7.764 3.742 1.00 0.00 C ATOM 540 C ARG A 31 -4.984 8.165 5.203 1.00 0.00 C ATOM 541 O ARG A 31 -4.956 7.311 6.087 1.00 0.00 O ATOM 542 CB ARG A 31 -3.881 7.928 2.978 1.00 0.00 C ATOM 543 CG ARG A 31 -4.007 7.398 1.549 1.00 0.00 C ATOM 544 CD ARG A 31 -4.272 5.891 1.543 1.00 0.00 C ATOM 545 NE ARG A 31 -4.223 5.374 0.158 1.00 0.00 N ATOM 546 CZ ARG A 31 -5.267 5.377 -0.683 1.00 0.00 C ATOM 547 NH1 ARG A 31 -6.447 5.872 -0.283 1.00 0.00 N ATOM 548 NH2 ARG A 31 -5.131 4.887 -1.922 1.00 0.00 N ATOM 0 H ARG A 31 -5.968 9.098 2.322 1.00 0.00 H new ATOM 0 HA ARG A 31 -5.507 6.720 3.691 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -3.598 8.980 2.956 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.085 7.395 3.499 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -4.818 7.915 1.036 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.092 7.612 0.996 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.530 5.381 2.157 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -5.247 5.683 1.983 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.339 4.991 -0.178 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.550 6.246 0.660 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -7.242 5.875 -0.922 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.233 4.511 -2.226 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.926 4.889 -2.561 1.00 0.00 H new ATOM 562 N ARG A 32 -4.840 9.466 5.411 1.00 0.00 N ATOM 563 CA ARG A 32 -4.631 9.991 6.750 1.00 0.00 C ATOM 564 C ARG A 32 -5.868 9.745 7.615 1.00 0.00 C ATOM 565 O ARG A 32 -5.785 9.761 8.842 1.00 0.00 O ATOM 566 CB ARG A 32 -4.333 11.491 6.713 1.00 0.00 C ATOM 567 CG ARG A 32 -5.547 12.279 6.217 1.00 0.00 C ATOM 568 CD ARG A 32 -5.544 13.702 6.778 1.00 0.00 C ATOM 569 NE ARG A 32 -5.662 13.664 8.253 1.00 0.00 N ATOM 570 CZ ARG A 32 -6.794 13.372 8.908 1.00 0.00 C ATOM 571 NH1 ARG A 32 -7.911 13.091 8.224 1.00 0.00 N ATOM 572 NH2 ARG A 32 -6.809 13.362 10.248 1.00 0.00 N ATOM 0 H ARG A 32 -4.864 10.172 4.675 1.00 0.00 H new ATOM 0 HA ARG A 32 -3.774 9.472 7.180 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -4.054 11.835 7.709 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.481 11.680 6.060 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -5.542 12.314 5.128 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -6.463 11.769 6.515 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -4.625 14.213 6.491 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -6.371 14.271 6.353 1.00 0.00 H new ATOM 0 HE ARG A 32 -4.830 13.873 8.805 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -7.900 13.099 7.204 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -8.772 12.869 8.723 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -5.959 13.577 10.769 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -7.671 13.140 10.747 1.00 0.00 H new ATOM 586 N GLN A 33 -6.987 9.522 6.942 1.00 0.00 N ATOM 587 CA GLN A 33 -8.240 9.273 7.635 1.00 0.00 C ATOM 588 C GLN A 33 -8.255 7.856 8.212 1.00 0.00 C ATOM 589 O GLN A 33 -8.853 7.615 9.259 1.00 0.00 O ATOM 590 CB GLN A 33 -9.435 9.499 6.706 1.00 0.00 C ATOM 591 CG GLN A 33 -10.403 10.525 7.298 1.00 0.00 C ATOM 592 CD GLN A 33 -11.849 10.035 7.198 1.00 0.00 C ATOM 593 OE1 GLN A 33 -12.473 9.657 8.176 1.00 0.00 O ATOM 594 NE2 GLN A 33 -12.345 10.061 5.964 1.00 0.00 N ATOM 0 H GLN A 33 -7.052 9.508 5.924 1.00 0.00 H new ATOM 0 HA GLN A 33 -8.323 9.981 8.459 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -9.084 9.844 5.733 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -9.955 8.556 6.541 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.149 10.710 8.342 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.299 11.474 6.772 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -11.768 10.389 5.189 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -13.302 9.753 5.792 1.00 0.00 H new ATOM 603 N ILE A 34 -7.590 6.956 7.503 1.00 0.00 N ATOM 604 CA ILE A 34 -7.519 5.569 7.932 1.00 0.00 C ATOM 605 C ILE A 34 -6.672 5.475 9.203 1.00 0.00 C ATOM 606 O ILE A 34 -5.688 6.198 9.352 1.00 0.00 O ATOM 607 CB ILE A 34 -7.017 4.681 6.792 1.00 0.00 C ATOM 608 CG1 ILE A 34 -7.952 4.759 5.583 1.00 0.00 C ATOM 609 CG2 ILE A 34 -6.814 3.241 7.267 1.00 0.00 C ATOM 610 CD1 ILE A 34 -7.233 4.324 4.304 1.00 0.00 C ATOM 0 H ILE A 34 -7.096 7.160 6.634 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.512 5.197 8.182 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.044 5.055 6.472 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.821 4.123 5.750 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.320 5.779 5.469 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.457 2.631 6.437 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.080 3.224 8.072 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.761 2.841 7.630 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.920 4.389 3.460 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.378 4.977 4.127 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.888 3.296 4.412 1.00 0.00 H new ATOM 622 N LYS A 35 -7.086 4.579 10.086 1.00 0.00 N ATOM 623 CA LYS A 35 -6.378 4.381 11.339 1.00 0.00 C ATOM 624 C LYS A 35 -6.256 2.882 11.621 1.00 0.00 C ATOM 625 O LYS A 35 -7.012 2.081 11.073 1.00 0.00 O ATOM 626 CB LYS A 35 -7.054 5.165 12.466 1.00 0.00 C ATOM 627 CG LYS A 35 -8.344 4.476 12.916 1.00 0.00 C ATOM 628 CD LYS A 35 -9.574 5.220 12.392 1.00 0.00 C ATOM 629 CE LYS A 35 -9.837 6.487 13.208 1.00 0.00 C ATOM 630 NZ LYS A 35 -9.358 7.682 12.478 1.00 0.00 N ATOM 0 H LYS A 35 -7.903 3.982 9.959 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.364 4.776 11.269 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -6.372 5.255 13.311 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.277 6.177 12.127 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -8.356 3.447 12.556 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -8.377 4.433 14.005 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -9.426 5.482 11.344 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -10.445 4.567 12.437 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -10.904 6.581 13.411 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -9.334 6.417 14.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -9.984 8.487 12.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -8.390 7.910 12.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -9.362 7.489 11.456 1.00 0.00 H new ATOM 644 N PRO A 36 -5.273 2.540 12.496 1.00 0.00 N ATOM 645 CA PRO A 36 -5.042 1.151 12.856 1.00 0.00 C ATOM 646 C PRO A 36 -6.121 0.647 13.817 1.00 0.00 C ATOM 647 O PRO A 36 -6.009 0.823 15.029 1.00 0.00 O ATOM 648 CB PRO A 36 -3.649 1.128 13.463 1.00 0.00 C ATOM 649 CG PRO A 36 -3.337 2.566 13.845 1.00 0.00 C ATOM 650 CD PRO A 36 -4.359 3.462 13.163 1.00 0.00 C ATOM 0 HA PRO A 36 -5.100 0.479 11.999 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.614 0.476 14.336 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.918 0.746 12.750 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -3.381 2.692 14.927 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.327 2.833 13.534 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.884 4.086 13.886 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.883 4.134 12.449 1.00 0.00 H new ATOM 658 N GLY A 37 -7.142 0.031 13.239 1.00 0.00 N ATOM 659 CA GLY A 37 -8.240 -0.499 14.029 1.00 0.00 C ATOM 660 C GLY A 37 -9.527 -0.566 13.204 1.00 0.00 C ATOM 661 O GLY A 37 -10.585 -0.137 13.662 1.00 0.00 O ATOM 0 H GLY A 37 -7.232 -0.113 12.233 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.984 -1.494 14.392 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.398 0.129 14.906 1.00 0.00 H new ATOM 665 N ASP A 38 -9.394 -1.108 12.002 1.00 0.00 N ATOM 666 CA ASP A 38 -10.533 -1.236 11.109 1.00 0.00 C ATOM 667 C ASP A 38 -10.187 -2.217 9.987 1.00 0.00 C ATOM 668 O ASP A 38 -9.143 -2.865 10.024 1.00 0.00 O ATOM 669 CB ASP A 38 -10.887 0.108 10.471 1.00 0.00 C ATOM 670 CG ASP A 38 -12.156 0.768 11.013 1.00 0.00 C ATOM 671 OD1 ASP A 38 -13.220 0.120 10.911 1.00 0.00 O ATOM 672 OD2 ASP A 38 -12.034 1.905 11.518 1.00 0.00 O ATOM 0 H ASP A 38 -8.515 -1.463 11.626 1.00 0.00 H new ATOM 0 HA ASP A 38 -11.382 -1.591 11.693 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.051 0.792 10.614 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.001 -0.036 9.397 1.00 0.00 H new ATOM 677 N VAL A 39 -11.084 -2.293 9.014 1.00 0.00 N ATOM 678 CA VAL A 39 -10.886 -3.183 7.883 1.00 0.00 C ATOM 679 C VAL A 39 -11.263 -2.452 6.593 1.00 0.00 C ATOM 680 O VAL A 39 -12.173 -1.625 6.587 1.00 0.00 O ATOM 681 CB VAL A 39 -11.678 -4.476 8.090 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.499 -5.425 6.903 1.00 0.00 C ATOM 683 CG2 VAL A 39 -11.281 -5.158 9.401 1.00 0.00 C ATOM 0 H VAL A 39 -11.949 -1.753 8.986 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.837 -3.469 7.801 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.734 -4.215 8.154 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.072 -6.336 7.076 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.853 -4.940 5.993 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.444 -5.676 6.793 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.858 -6.074 9.524 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.218 -5.399 9.378 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.483 -4.487 10.236 1.00 0.00 H new ATOM 693 N ILE A 40 -10.543 -2.784 5.531 1.00 0.00 N ATOM 694 CA ILE A 40 -10.790 -2.170 4.238 1.00 0.00 C ATOM 695 C ILE A 40 -11.112 -3.259 3.213 1.00 0.00 C ATOM 696 O ILE A 40 -10.211 -3.929 2.710 1.00 0.00 O ATOM 697 CB ILE A 40 -9.615 -1.276 3.836 1.00 0.00 C ATOM 698 CG1 ILE A 40 -9.025 -0.565 5.056 1.00 0.00 C ATOM 699 CG2 ILE A 40 -10.025 -0.290 2.740 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.712 0.136 4.700 1.00 0.00 C ATOM 0 H ILE A 40 -9.789 -3.470 5.540 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.658 -1.513 4.289 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.830 -1.909 3.421 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.739 0.165 5.437 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -8.851 -1.287 5.854 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -9.171 0.333 2.473 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -10.361 -0.841 1.862 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.836 0.342 3.103 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.314 0.633 5.584 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -6.992 -0.600 4.342 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.894 0.875 3.919 1.00 0.00 H new ATOM 712 N SER A 41 -12.399 -3.403 2.934 1.00 0.00 N ATOM 713 CA SER A 41 -12.851 -4.400 1.978 1.00 0.00 C ATOM 714 C SER A 41 -12.576 -3.920 0.552 1.00 0.00 C ATOM 715 O SER A 41 -12.619 -2.722 0.277 1.00 0.00 O ATOM 716 CB SER A 41 -14.340 -4.701 2.159 1.00 0.00 C ATOM 717 OG SER A 41 -15.162 -3.767 1.463 1.00 0.00 O ATOM 0 H SER A 41 -13.143 -2.846 3.353 1.00 0.00 H new ATOM 0 HA SER A 41 -12.297 -5.322 2.157 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.552 -5.708 1.801 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.587 -4.681 3.220 1.00 0.00 H new ATOM 0 HG SER A 41 -15.840 -4.250 0.945 1.00 0.00 H new ATOM 723 N PHE A 42 -12.298 -4.880 -0.318 1.00 0.00 N ATOM 724 CA PHE A 42 -12.016 -4.571 -1.709 1.00 0.00 C ATOM 725 C PHE A 42 -12.987 -5.299 -2.641 1.00 0.00 C ATOM 726 O PHE A 42 -13.358 -6.443 -2.386 1.00 0.00 O ATOM 727 CB PHE A 42 -10.593 -5.056 -1.995 1.00 0.00 C ATOM 728 CG PHE A 42 -9.503 -4.213 -1.332 1.00 0.00 C ATOM 729 CD1 PHE A 42 -9.771 -2.937 -0.944 1.00 0.00 C ATOM 730 CD2 PHE A 42 -8.265 -4.739 -1.130 1.00 0.00 C ATOM 731 CE1 PHE A 42 -8.759 -2.155 -0.328 1.00 0.00 C ATOM 732 CE2 PHE A 42 -7.252 -3.956 -0.515 1.00 0.00 C ATOM 733 CZ PHE A 42 -7.521 -2.680 -0.126 1.00 0.00 C ATOM 0 H PHE A 42 -12.262 -5.873 -0.086 1.00 0.00 H new ATOM 0 HA PHE A 42 -12.124 -3.500 -1.881 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -10.497 -6.087 -1.656 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -10.431 -5.058 -3.073 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.754 -2.519 -1.105 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.052 -5.752 -1.437 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.972 -1.142 -0.020 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.269 -4.373 -0.356 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.752 -2.085 0.343 1.00 0.00 H new ATOM 743 N GLU A 43 -13.371 -4.604 -3.702 1.00 0.00 N ATOM 744 CA GLU A 43 -14.292 -5.170 -4.673 1.00 0.00 C ATOM 745 C GLU A 43 -15.492 -5.799 -3.963 1.00 0.00 C ATOM 746 O GLU A 43 -15.955 -6.871 -4.349 1.00 0.00 O ATOM 747 CB GLU A 43 -13.587 -6.191 -5.567 1.00 0.00 C ATOM 748 CG GLU A 43 -12.529 -5.517 -6.442 1.00 0.00 C ATOM 749 CD GLU A 43 -13.087 -5.196 -7.830 1.00 0.00 C ATOM 750 OE1 GLU A 43 -14.074 -5.862 -8.212 1.00 0.00 O ATOM 751 OE2 GLU A 43 -12.515 -4.293 -8.477 1.00 0.00 O ATOM 0 H GLU A 43 -13.061 -3.655 -3.910 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.654 -4.365 -5.313 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.119 -6.958 -4.950 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.320 -6.694 -6.198 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -12.187 -4.600 -5.963 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.661 -6.170 -6.537 1.00 0.00 H new ATOM 758 N GLY A 44 -15.963 -5.105 -2.937 1.00 0.00 N ATOM 759 CA GLY A 44 -17.100 -5.582 -2.169 1.00 0.00 C ATOM 760 C GLY A 44 -16.641 -6.400 -0.960 1.00 0.00 C ATOM 761 O GLY A 44 -16.909 -6.030 0.182 1.00 0.00 O ATOM 0 H GLY A 44 -15.577 -4.216 -2.620 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.698 -4.735 -1.833 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.741 -6.193 -2.804 1.00 0.00 H new ATOM 765 N GLY A 45 -15.957 -7.496 -1.252 1.00 0.00 N ATOM 766 CA GLY A 45 -15.458 -8.369 -0.204 1.00 0.00 C ATOM 767 C GLY A 45 -14.569 -9.471 -0.784 1.00 0.00 C ATOM 768 O GLY A 45 -14.526 -10.581 -0.257 1.00 0.00 O ATOM 0 H GLY A 45 -15.736 -7.800 -2.200 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.892 -7.785 0.522 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.296 -8.817 0.331 1.00 0.00 H new ATOM 772 N LYS A 46 -13.881 -9.124 -1.862 1.00 0.00 N ATOM 773 CA LYS A 46 -12.994 -10.070 -2.520 1.00 0.00 C ATOM 774 C LYS A 46 -11.715 -10.222 -1.694 1.00 0.00 C ATOM 775 O LYS A 46 -11.195 -11.327 -1.547 1.00 0.00 O ATOM 776 CB LYS A 46 -12.745 -9.650 -3.970 1.00 0.00 C ATOM 777 CG LYS A 46 -12.401 -10.861 -4.839 1.00 0.00 C ATOM 778 CD LYS A 46 -10.890 -11.098 -4.877 1.00 0.00 C ATOM 779 CE LYS A 46 -10.477 -11.803 -6.170 1.00 0.00 C ATOM 780 NZ LYS A 46 -9.277 -12.640 -5.945 1.00 0.00 N ATOM 0 H LYS A 46 -13.919 -8.202 -2.296 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.458 -11.055 -2.573 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.631 -9.153 -4.366 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.930 -8.927 -4.008 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.902 -11.747 -4.449 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.774 -10.704 -5.851 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.367 -10.145 -4.795 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.591 -11.700 -4.019 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.298 -12.423 -6.531 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -10.272 -11.064 -6.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -9.011 -13.111 -6.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -8.491 -12.040 -5.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -9.485 -13.358 -5.221 1.00 0.00 H new ATOM 794 N LEU A 47 -11.245 -9.096 -1.178 1.00 0.00 N ATOM 795 CA LEU A 47 -10.036 -9.091 -0.371 1.00 0.00 C ATOM 796 C LEU A 47 -10.246 -8.191 0.848 1.00 0.00 C ATOM 797 O LEU A 47 -10.427 -6.982 0.709 1.00 0.00 O ATOM 798 CB LEU A 47 -8.826 -8.701 -1.222 1.00 0.00 C ATOM 799 CG LEU A 47 -7.511 -9.404 -0.880 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.865 -8.785 0.361 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.720 -10.912 -0.726 1.00 0.00 C ATOM 0 H LEU A 47 -11.679 -8.181 -1.303 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.824 -10.092 0.004 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -9.062 -8.903 -2.267 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.674 -7.625 -1.131 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.819 -9.258 -1.710 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.932 -9.303 0.582 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.660 -7.731 0.177 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.543 -8.880 1.210 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.770 -11.388 -0.483 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.435 -11.100 0.074 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -8.104 -11.323 -1.660 1.00 0.00 H new ATOM 813 N LYS A 48 -10.216 -8.815 2.017 1.00 0.00 N ATOM 814 CA LYS A 48 -10.401 -8.086 3.260 1.00 0.00 C ATOM 815 C LYS A 48 -9.035 -7.815 3.895 1.00 0.00 C ATOM 816 O LYS A 48 -8.203 -8.715 3.994 1.00 0.00 O ATOM 817 CB LYS A 48 -11.369 -8.832 4.180 1.00 0.00 C ATOM 818 CG LYS A 48 -12.702 -9.094 3.475 1.00 0.00 C ATOM 819 CD LYS A 48 -13.484 -7.793 3.279 1.00 0.00 C ATOM 820 CE LYS A 48 -14.903 -7.918 3.836 1.00 0.00 C ATOM 821 NZ LYS A 48 -15.734 -8.767 2.953 1.00 0.00 N ATOM 0 H LYS A 48 -10.066 -9.818 2.129 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.862 -7.117 3.068 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -10.925 -9.778 4.491 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.540 -8.248 5.084 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.520 -9.562 2.508 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.296 -9.795 4.062 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.965 -6.974 3.777 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.526 -7.546 2.218 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -14.870 -8.347 4.837 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.352 -6.929 3.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.292 -9.427 3.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -16.376 -8.166 2.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.119 -9.305 2.309 1.00 0.00 H new ATOM 835 N VAL A 49 -8.847 -6.570 4.308 1.00 0.00 N ATOM 836 CA VAL A 49 -7.597 -6.169 4.931 1.00 0.00 C ATOM 837 C VAL A 49 -7.898 -5.348 6.186 1.00 0.00 C ATOM 838 O VAL A 49 -8.961 -4.739 6.294 1.00 0.00 O ATOM 839 CB VAL A 49 -6.727 -5.418 3.921 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.414 -6.296 2.707 1.00 0.00 C ATOM 841 CG2 VAL A 49 -7.389 -4.107 3.493 1.00 0.00 C ATOM 0 H VAL A 49 -9.539 -5.826 4.223 1.00 0.00 H new ATOM 0 HA VAL A 49 -7.028 -7.045 5.244 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.784 -5.172 4.410 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.794 -5.738 2.005 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.880 -7.189 3.032 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.344 -6.587 2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.749 -3.594 2.775 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -8.354 -4.320 3.032 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -7.537 -3.472 4.366 1.00 0.00 H new ATOM 851 N ARG A 50 -6.943 -5.359 7.105 1.00 0.00 N ATOM 852 CA ARG A 50 -7.092 -4.624 8.349 1.00 0.00 C ATOM 853 C ARG A 50 -5.811 -3.851 8.666 1.00 0.00 C ATOM 854 O ARG A 50 -4.742 -4.444 8.802 1.00 0.00 O ATOM 855 CB ARG A 50 -7.412 -5.567 9.511 1.00 0.00 C ATOM 856 CG ARG A 50 -7.091 -4.909 10.855 1.00 0.00 C ATOM 857 CD ARG A 50 -8.093 -5.338 11.928 1.00 0.00 C ATOM 858 NE ARG A 50 -7.749 -6.687 12.431 1.00 0.00 N ATOM 859 CZ ARG A 50 -8.216 -7.203 13.576 1.00 0.00 C ATOM 860 NH1 ARG A 50 -9.048 -6.487 14.344 1.00 0.00 N ATOM 861 NH2 ARG A 50 -7.849 -8.436 13.954 1.00 0.00 N ATOM 0 H ARG A 50 -6.063 -5.866 7.012 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.920 -3.926 8.224 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.466 -5.844 9.480 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.837 -6.487 9.406 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.082 -5.181 11.165 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -7.110 -3.825 10.747 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -8.087 -4.622 12.750 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -9.102 -5.341 11.515 1.00 0.00 H new ATOM 0 HE ARG A 50 -7.117 -7.259 11.871 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -9.326 -5.549 14.057 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.403 -6.880 15.216 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -7.215 -8.981 13.370 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -8.204 -8.829 14.826 1.00 0.00 H new ATOM 875 N VAL A 51 -5.960 -2.539 8.774 1.00 0.00 N ATOM 876 CA VAL A 51 -4.828 -1.679 9.072 1.00 0.00 C ATOM 877 C VAL A 51 -4.146 -2.167 10.352 1.00 0.00 C ATOM 878 O VAL A 51 -4.815 -2.570 11.301 1.00 0.00 O ATOM 879 CB VAL A 51 -5.286 -0.221 9.157 1.00 0.00 C ATOM 880 CG1 VAL A 51 -4.106 0.708 9.449 1.00 0.00 C ATOM 881 CG2 VAL A 51 -6.012 0.200 7.878 1.00 0.00 C ATOM 0 H VAL A 51 -6.848 -2.051 8.660 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.090 -1.727 8.271 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.990 -0.138 9.985 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.459 1.738 9.504 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.650 0.429 10.399 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.368 0.620 8.652 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.327 1.240 7.964 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -5.340 0.094 7.026 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.887 -0.433 7.731 1.00 0.00 H new ATOM 891 N LYS A 52 -2.822 -2.113 10.336 1.00 0.00 N ATOM 892 CA LYS A 52 -2.042 -2.545 11.483 1.00 0.00 C ATOM 893 C LYS A 52 -1.423 -1.321 12.163 1.00 0.00 C ATOM 894 O LYS A 52 -1.407 -1.231 13.390 1.00 0.00 O ATOM 895 CB LYS A 52 -1.016 -3.601 11.068 1.00 0.00 C ATOM 896 CG LYS A 52 -1.203 -4.892 11.867 1.00 0.00 C ATOM 897 CD LYS A 52 0.114 -5.340 12.503 1.00 0.00 C ATOM 898 CE LYS A 52 0.059 -5.211 14.026 1.00 0.00 C ATOM 899 NZ LYS A 52 -0.168 -6.533 14.651 1.00 0.00 N ATOM 0 H LYS A 52 -2.270 -1.777 9.547 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.684 -3.030 12.218 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.115 -3.811 10.003 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.009 -3.215 11.224 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.952 -4.738 12.644 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.580 -5.677 11.212 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.321 -6.375 12.229 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.934 -4.737 12.113 1.00 0.00 H new ATOM 0 HE2 LYS A 52 0.992 -4.783 14.394 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.740 -4.526 14.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.203 -6.427 15.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -1.069 -6.927 14.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.608 -7.176 14.395 1.00 0.00 H new ATOM 913 N ALA A 53 -0.930 -0.411 11.337 1.00 0.00 N ATOM 914 CA ALA A 53 -0.312 0.803 11.843 1.00 0.00 C ATOM 915 C ALA A 53 -0.057 1.763 10.680 1.00 0.00 C ATOM 916 O ALA A 53 -0.127 1.368 9.517 1.00 0.00 O ATOM 917 CB ALA A 53 0.970 0.447 12.598 1.00 0.00 C ATOM 0 H ALA A 53 -0.946 -0.490 10.320 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.975 1.307 12.547 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.434 1.358 12.978 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.730 -0.213 13.432 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.661 -0.058 11.923 1.00 0.00 H new ATOM 923 N ILE A 54 0.235 3.006 11.033 1.00 0.00 N ATOM 924 CA ILE A 54 0.502 4.026 10.033 1.00 0.00 C ATOM 925 C ILE A 54 1.914 4.577 10.237 1.00 0.00 C ATOM 926 O ILE A 54 2.415 4.611 11.359 1.00 0.00 O ATOM 927 CB ILE A 54 -0.587 5.100 10.060 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.884 5.616 8.650 1.00 0.00 C ATOM 929 CG2 ILE A 54 -0.216 6.234 11.018 1.00 0.00 C ATOM 930 CD1 ILE A 54 -2.243 5.113 8.158 1.00 0.00 C ATOM 0 H ILE A 54 0.293 3.330 11.998 1.00 0.00 H new ATOM 0 HA ILE A 54 0.469 3.596 9.032 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.504 4.646 10.437 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.873 6.706 8.648 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -0.101 5.288 7.966 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.007 6.984 11.018 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.095 5.835 12.025 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.718 6.693 10.694 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -2.430 5.494 7.154 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.242 4.023 8.139 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -3.026 5.463 8.831 1.00 0.00 H new ATOM 942 N ARG A 55 2.517 4.995 9.133 1.00 0.00 N ATOM 943 CA ARG A 55 3.862 5.543 9.176 1.00 0.00 C ATOM 944 C ARG A 55 4.058 6.559 8.049 1.00 0.00 C ATOM 945 O ARG A 55 3.451 6.437 6.987 1.00 0.00 O ATOM 946 CB ARG A 55 4.911 4.437 9.045 1.00 0.00 C ATOM 947 CG ARG A 55 5.089 3.689 10.368 1.00 0.00 C ATOM 948 CD ARG A 55 5.778 4.574 11.409 1.00 0.00 C ATOM 949 NE ARG A 55 4.900 4.745 12.588 1.00 0.00 N ATOM 950 CZ ARG A 55 4.525 3.745 13.397 1.00 0.00 C ATOM 951 NH1 ARG A 55 4.948 2.496 13.159 1.00 0.00 N ATOM 952 NH2 ARG A 55 3.726 3.994 14.444 1.00 0.00 N ATOM 0 H ARG A 55 2.098 4.965 8.203 1.00 0.00 H new ATOM 0 HA ARG A 55 3.989 6.036 10.140 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.611 3.737 8.265 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.863 4.869 8.737 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.117 3.370 10.743 1.00 0.00 H new ATOM 0 HG3 ARG A 55 5.679 2.787 10.204 1.00 0.00 H new ATOM 0 HD2 ARG A 55 6.724 4.125 11.712 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.011 5.546 10.975 1.00 0.00 H new ATOM 0 HE ARG A 55 4.559 5.683 12.798 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.556 2.307 12.362 1.00 0.00 H new ATOM 0 HH12 ARG A 55 4.662 1.735 13.775 1.00 0.00 H new ATOM 0 HH21 ARG A 55 3.404 4.945 14.625 1.00 0.00 H new ATOM 0 HH22 ARG A 55 3.440 3.233 15.060 1.00 0.00 H new ATOM 966 N VAL A 56 4.908 7.538 8.320 1.00 0.00 N ATOM 967 CA VAL A 56 5.191 8.575 7.342 1.00 0.00 C ATOM 968 C VAL A 56 6.701 8.645 7.103 1.00 0.00 C ATOM 969 O VAL A 56 7.489 8.422 8.020 1.00 0.00 O ATOM 970 CB VAL A 56 4.597 9.907 7.804 1.00 0.00 C ATOM 971 CG1 VAL A 56 4.306 10.820 6.612 1.00 0.00 C ATOM 972 CG2 VAL A 56 3.338 9.683 8.644 1.00 0.00 C ATOM 0 H VAL A 56 5.410 7.635 9.203 1.00 0.00 H new ATOM 0 HA VAL A 56 4.720 8.339 6.388 1.00 0.00 H new ATOM 0 HB VAL A 56 5.336 10.404 8.433 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.884 11.760 6.968 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.231 11.019 6.072 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.594 10.333 5.946 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.935 10.645 8.960 1.00 0.00 H new ATOM 0 HG22 VAL A 56 2.593 9.156 8.049 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.588 9.088 9.523 1.00 0.00 H new ATOM 982 N TYR A 57 7.058 8.956 5.865 1.00 0.00 N ATOM 983 CA TYR A 57 8.459 9.058 5.494 1.00 0.00 C ATOM 984 C TYR A 57 8.724 10.341 4.703 1.00 0.00 C ATOM 985 O TYR A 57 7.806 11.120 4.451 1.00 0.00 O ATOM 986 CB TYR A 57 8.746 7.852 4.597 1.00 0.00 C ATOM 987 CG TYR A 57 8.928 6.539 5.360 1.00 0.00 C ATOM 988 CD1 TYR A 57 7.827 5.870 5.855 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.194 6.023 5.552 1.00 0.00 C ATOM 990 CE1 TYR A 57 7.999 4.634 6.574 1.00 0.00 C ATOM 991 CE2 TYR A 57 10.365 4.786 6.271 1.00 0.00 C ATOM 992 CZ TYR A 57 9.259 4.153 6.746 1.00 0.00 C ATOM 993 OH TYR A 57 9.421 2.985 7.424 1.00 0.00 O ATOM 0 H TYR A 57 6.401 9.141 5.107 1.00 0.00 H new ATOM 0 HA TYR A 57 9.091 9.079 6.382 1.00 0.00 H new ATOM 0 HB2 TYR A 57 7.927 7.737 3.887 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.646 8.050 4.016 1.00 0.00 H new ATOM 0 HD1 TYR A 57 6.837 6.273 5.703 1.00 0.00 H new ATOM 0 HD2 TYR A 57 11.055 6.546 5.164 1.00 0.00 H new ATOM 0 HE1 TYR A 57 7.146 4.101 6.968 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.349 4.371 6.429 1.00 0.00 H new ATOM 0 HH TYR A 57 10.374 2.762 7.469 1.00 0.00 H new ATOM 1003 N ASN A 58 9.984 10.521 4.335 1.00 0.00 N ATOM 1004 CA ASN A 58 10.381 11.696 3.578 1.00 0.00 C ATOM 1005 C ASN A 58 9.931 11.538 2.124 1.00 0.00 C ATOM 1006 O ASN A 58 9.381 12.468 1.537 1.00 0.00 O ATOM 1007 CB ASN A 58 11.902 11.868 3.586 1.00 0.00 C ATOM 1008 CG ASN A 58 12.331 12.905 4.627 1.00 0.00 C ATOM 1009 OD1 ASN A 58 12.468 14.084 4.346 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.534 12.401 5.840 1.00 0.00 N ATOM 0 H ASN A 58 10.743 9.873 4.547 1.00 0.00 H new ATOM 0 HA ASN A 58 9.916 12.567 4.040 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.379 10.912 3.802 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.242 12.177 2.598 1.00 0.00 H new ATOM 0 HD21 ASN A 58 12.823 13.012 6.604 1.00 0.00 H new ATOM 0 HD22 ASN A 58 12.401 11.404 6.007 1.00 0.00 H new ATOM 1017 N SER A 59 10.182 10.354 1.586 1.00 0.00 N ATOM 1018 CA SER A 59 9.810 10.062 0.212 1.00 0.00 C ATOM 1019 C SER A 59 9.632 8.554 0.028 1.00 0.00 C ATOM 1020 O SER A 59 9.821 7.783 0.967 1.00 0.00 O ATOM 1021 CB SER A 59 10.856 10.597 -0.768 1.00 0.00 C ATOM 1022 OG SER A 59 10.259 11.297 -1.856 1.00 0.00 O ATOM 0 H SER A 59 10.639 9.585 2.077 1.00 0.00 H new ATOM 0 HA SER A 59 8.865 10.562 -0.000 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.540 11.262 -0.241 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.450 9.768 -1.153 1.00 0.00 H new ATOM 0 HG SER A 59 10.959 11.624 -2.458 1.00 0.00 H new ATOM 1028 N PHE A 60 9.270 8.178 -1.190 1.00 0.00 N ATOM 1029 CA PHE A 60 9.064 6.776 -1.510 1.00 0.00 C ATOM 1030 C PHE A 60 10.390 6.012 -1.507 1.00 0.00 C ATOM 1031 O PHE A 60 10.471 4.904 -0.979 1.00 0.00 O ATOM 1032 CB PHE A 60 8.462 6.721 -2.916 1.00 0.00 C ATOM 1033 CG PHE A 60 6.934 6.646 -2.935 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.304 5.508 -2.536 1.00 0.00 C ATOM 1035 CD2 PHE A 60 6.205 7.716 -3.352 1.00 0.00 C ATOM 1036 CE1 PHE A 60 4.886 5.438 -2.554 1.00 0.00 C ATOM 1037 CE2 PHE A 60 4.787 7.646 -3.370 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.157 6.508 -2.971 1.00 0.00 C ATOM 0 H PHE A 60 9.114 8.820 -1.967 1.00 0.00 H new ATOM 0 HA PHE A 60 8.409 6.318 -0.768 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.779 7.604 -3.471 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.865 5.854 -3.439 1.00 0.00 H new ATOM 0 HD1 PHE A 60 6.882 4.658 -2.206 1.00 0.00 H new ATOM 0 HD2 PHE A 60 6.705 8.619 -3.670 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.386 4.535 -2.236 1.00 0.00 H new ATOM 0 HE2 PHE A 60 4.209 8.496 -3.700 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.078 6.454 -2.985 1.00 0.00 H new ATOM 1048 N ARG A 61 11.397 6.635 -2.102 1.00 0.00 N ATOM 1049 CA ARG A 61 12.715 6.029 -2.174 1.00 0.00 C ATOM 1050 C ARG A 61 13.209 5.663 -0.773 1.00 0.00 C ATOM 1051 O ARG A 61 13.922 4.676 -0.600 1.00 0.00 O ATOM 1052 CB ARG A 61 13.722 6.975 -2.832 1.00 0.00 C ATOM 1053 CG ARG A 61 14.735 6.198 -3.674 1.00 0.00 C ATOM 1054 CD ARG A 61 16.162 6.669 -3.388 1.00 0.00 C ATOM 1055 NE ARG A 61 16.913 6.809 -4.656 1.00 0.00 N ATOM 1056 CZ ARG A 61 18.122 7.379 -4.754 1.00 0.00 C ATOM 1057 NH1 ARG A 61 18.724 7.866 -3.660 1.00 0.00 N ATOM 1058 NH2 ARG A 61 18.728 7.463 -5.946 1.00 0.00 N ATOM 0 H ARG A 61 11.326 7.554 -2.539 1.00 0.00 H new ATOM 0 HA ARG A 61 12.632 5.127 -2.780 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.195 7.692 -3.461 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.244 7.547 -2.065 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.650 5.133 -3.460 1.00 0.00 H new ATOM 0 HG3 ARG A 61 14.510 6.329 -4.732 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.140 7.623 -2.862 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.665 5.956 -2.735 1.00 0.00 H new ATOM 0 HE ARG A 61 16.484 6.449 -5.508 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.262 7.803 -2.753 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.644 8.300 -3.735 1.00 0.00 H new ATOM 0 HH21 ARG A 61 18.269 7.093 -6.779 1.00 0.00 H new ATOM 0 HH22 ARG A 61 19.648 7.897 -6.021 1.00 0.00 H new ATOM 1072 N GLU A 62 12.810 6.479 0.192 1.00 0.00 N ATOM 1073 CA GLU A 62 13.203 6.255 1.572 1.00 0.00 C ATOM 1074 C GLU A 62 12.435 5.067 2.156 1.00 0.00 C ATOM 1075 O GLU A 62 12.952 4.348 3.010 1.00 0.00 O ATOM 1076 CB GLU A 62 12.989 7.514 2.415 1.00 0.00 C ATOM 1077 CG GLU A 62 14.270 8.347 2.491 1.00 0.00 C ATOM 1078 CD GLU A 62 14.401 9.263 1.272 1.00 0.00 C ATOM 1079 OE1 GLU A 62 14.352 8.720 0.147 1.00 0.00 O ATOM 1080 OE2 GLU A 62 14.547 10.484 1.493 1.00 0.00 O ATOM 0 H GLU A 62 12.218 7.297 0.045 1.00 0.00 H new ATOM 0 HA GLU A 62 14.267 6.021 1.593 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.187 8.113 1.984 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.673 7.234 3.420 1.00 0.00 H new ATOM 0 HG2 GLU A 62 14.265 8.946 3.402 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.135 7.686 2.549 1.00 0.00 H new ATOM 1087 N MET A 63 11.213 4.898 1.673 1.00 0.00 N ATOM 1088 CA MET A 63 10.368 3.810 2.136 1.00 0.00 C ATOM 1089 C MET A 63 10.816 2.475 1.537 1.00 0.00 C ATOM 1090 O MET A 63 11.012 1.500 2.261 1.00 0.00 O ATOM 1091 CB MET A 63 8.916 4.086 1.740 1.00 0.00 C ATOM 1092 CG MET A 63 8.032 4.247 2.978 1.00 0.00 C ATOM 1093 SD MET A 63 6.490 5.026 2.530 1.00 0.00 S ATOM 1094 CE MET A 63 6.014 3.999 1.149 1.00 0.00 C ATOM 0 H MET A 63 10.787 5.497 0.965 1.00 0.00 H new ATOM 0 HA MET A 63 10.452 3.747 3.221 1.00 0.00 H new ATOM 0 HB2 MET A 63 8.866 4.990 1.133 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.541 3.268 1.125 1.00 0.00 H new ATOM 0 HG2 MET A 63 7.840 3.273 3.427 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.548 4.847 3.728 1.00 0.00 H new ATOM 0 HE1 MET A 63 4.958 4.155 0.927 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.611 4.263 0.276 1.00 0.00 H new ATOM 0 HE3 MET A 63 6.181 2.952 1.400 1.00 0.00 H new ATOM 1104 N LEU A 64 10.965 2.475 0.221 1.00 0.00 N ATOM 1105 CA LEU A 64 11.386 1.276 -0.484 1.00 0.00 C ATOM 1106 C LEU A 64 12.817 0.923 -0.072 1.00 0.00 C ATOM 1107 O LEU A 64 13.213 -0.240 -0.124 1.00 0.00 O ATOM 1108 CB LEU A 64 11.206 1.450 -1.993 1.00 0.00 C ATOM 1109 CG LEU A 64 9.761 1.478 -2.497 1.00 0.00 C ATOM 1110 CD1 LEU A 64 8.834 0.720 -1.546 1.00 0.00 C ATOM 1111 CD2 LEU A 64 9.291 2.914 -2.734 1.00 0.00 C ATOM 0 H LEU A 64 10.802 3.286 -0.376 1.00 0.00 H new ATOM 0 HA LEU A 64 10.756 0.431 -0.207 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.692 2.378 -2.292 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.730 0.638 -2.498 1.00 0.00 H new ATOM 0 HG LEU A 64 9.724 0.965 -3.458 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.814 0.755 -1.927 1.00 0.00 H new ATOM 0 HD12 LEU A 64 9.158 -0.318 -1.472 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.869 1.182 -0.559 1.00 0.00 H new ATOM 0 HD21 LEU A 64 8.261 2.905 -3.092 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.346 3.474 -1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.930 3.388 -3.479 1.00 0.00 H new ATOM 1123 N GLU A 65 13.554 1.950 0.327 1.00 0.00 N ATOM 1124 CA GLU A 65 14.932 1.763 0.747 1.00 0.00 C ATOM 1125 C GLU A 65 14.981 1.141 2.144 1.00 0.00 C ATOM 1126 O GLU A 65 15.815 0.278 2.414 1.00 0.00 O ATOM 1127 CB GLU A 65 15.701 3.085 0.708 1.00 0.00 C ATOM 1128 CG GLU A 65 16.164 3.408 -0.715 1.00 0.00 C ATOM 1129 CD GLU A 65 17.508 2.743 -1.018 1.00 0.00 C ATOM 1130 OE1 GLU A 65 17.482 1.547 -1.379 1.00 0.00 O ATOM 1131 OE2 GLU A 65 18.533 3.447 -0.881 1.00 0.00 O ATOM 0 H GLU A 65 13.222 2.914 0.368 1.00 0.00 H new ATOM 0 HA GLU A 65 15.415 1.079 0.049 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.067 3.890 1.080 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.564 3.027 1.371 1.00 0.00 H new ATOM 0 HG2 GLU A 65 15.416 3.067 -1.431 1.00 0.00 H new ATOM 0 HG3 GLU A 65 16.253 4.488 -0.836 1.00 0.00 H new ATOM 1138 N LYS A 66 14.078 1.605 2.996 1.00 0.00 N ATOM 1139 CA LYS A 66 14.008 1.105 4.358 1.00 0.00 C ATOM 1140 C LYS A 66 13.187 -0.186 4.382 1.00 0.00 C ATOM 1141 O LYS A 66 13.712 -1.254 4.694 1.00 0.00 O ATOM 1142 CB LYS A 66 13.478 2.188 5.300 1.00 0.00 C ATOM 1143 CG LYS A 66 14.381 2.339 6.526 1.00 0.00 C ATOM 1144 CD LYS A 66 13.573 2.768 7.752 1.00 0.00 C ATOM 1145 CE LYS A 66 13.527 4.293 7.872 1.00 0.00 C ATOM 1146 NZ LYS A 66 12.431 4.708 8.775 1.00 0.00 N ATOM 0 H LYS A 66 13.389 2.322 2.769 1.00 0.00 H new ATOM 0 HA LYS A 66 15.004 0.856 4.724 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.417 3.138 4.770 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.467 1.935 5.618 1.00 0.00 H new ATOM 0 HG2 LYS A 66 14.884 1.394 6.730 1.00 0.00 H new ATOM 0 HG3 LYS A 66 15.158 3.076 6.322 1.00 0.00 H new ATOM 0 HD2 LYS A 66 12.559 2.375 7.680 1.00 0.00 H new ATOM 0 HD3 LYS A 66 14.017 2.342 8.652 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.479 4.663 8.252 1.00 0.00 H new ATOM 0 HE3 LYS A 66 13.383 4.737 6.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 12.681 5.607 9.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 11.556 4.830 8.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 12.284 3.978 9.501 1.00 0.00 H new ATOM 1160 N GLU A 67 11.913 -0.045 4.048 1.00 0.00 N ATOM 1161 CA GLU A 67 11.014 -1.186 4.027 1.00 0.00 C ATOM 1162 C GLU A 67 11.478 -2.208 2.987 1.00 0.00 C ATOM 1163 O GLU A 67 11.652 -3.385 3.302 1.00 0.00 O ATOM 1164 CB GLU A 67 9.574 -0.746 3.757 1.00 0.00 C ATOM 1165 CG GLU A 67 8.763 -0.699 5.054 1.00 0.00 C ATOM 1166 CD GLU A 67 8.589 -2.100 5.642 1.00 0.00 C ATOM 1167 OE1 GLU A 67 8.655 -3.062 4.847 1.00 0.00 O ATOM 1168 OE2 GLU A 67 8.393 -2.178 6.874 1.00 0.00 O ATOM 0 H GLU A 67 11.482 0.842 3.790 1.00 0.00 H new ATOM 0 HA GLU A 67 11.036 -1.659 5.009 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.572 0.237 3.287 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.105 -1.435 3.055 1.00 0.00 H new ATOM 0 HG2 GLU A 67 9.265 -0.057 5.778 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.785 -0.258 4.860 1.00 0.00 H new ATOM 1175 N GLY A 68 11.666 -1.722 1.769 1.00 0.00 N ATOM 1176 CA GLY A 68 12.107 -2.579 0.681 1.00 0.00 C ATOM 1177 C GLY A 68 11.229 -2.387 -0.558 1.00 0.00 C ATOM 1178 O GLY A 68 10.015 -2.578 -0.499 1.00 0.00 O ATOM 0 H GLY A 68 11.521 -0.746 1.511 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.145 -2.355 0.434 1.00 0.00 H new ATOM 0 HA3 GLY A 68 12.073 -3.621 0.998 1.00 0.00 H new ATOM 1182 N LEU A 69 11.877 -2.012 -1.651 1.00 0.00 N ATOM 1183 CA LEU A 69 11.171 -1.792 -2.901 1.00 0.00 C ATOM 1184 C LEU A 69 10.256 -2.986 -3.182 1.00 0.00 C ATOM 1185 O LEU A 69 9.043 -2.826 -3.309 1.00 0.00 O ATOM 1186 CB LEU A 69 12.160 -1.496 -4.031 1.00 0.00 C ATOM 1187 CG LEU A 69 11.580 -1.494 -5.447 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.688 -0.272 -5.672 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.691 -1.593 -6.494 1.00 0.00 C ATOM 0 H LEU A 69 12.884 -1.855 -1.697 1.00 0.00 H new ATOM 0 HA LEU A 69 10.533 -0.911 -2.828 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.614 -0.523 -3.844 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.961 -2.234 -3.989 1.00 0.00 H new ATOM 0 HG LEU A 69 10.951 -2.377 -5.560 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.289 -0.295 -6.686 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.865 -0.286 -4.957 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.274 0.637 -5.533 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.252 -1.590 -7.492 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.365 -0.742 -6.391 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.249 -2.518 -6.346 1.00 0.00 H new ATOM 1201 N GLU A 70 10.873 -4.155 -3.270 1.00 0.00 N ATOM 1202 CA GLU A 70 10.129 -5.375 -3.533 1.00 0.00 C ATOM 1203 C GLU A 70 9.207 -5.699 -2.356 1.00 0.00 C ATOM 1204 O GLU A 70 8.306 -6.528 -2.479 1.00 0.00 O ATOM 1205 CB GLU A 70 11.075 -6.542 -3.825 1.00 0.00 C ATOM 1206 CG GLU A 70 11.193 -6.788 -5.331 1.00 0.00 C ATOM 1207 CD GLU A 70 12.134 -7.959 -5.623 1.00 0.00 C ATOM 1208 OE1 GLU A 70 13.085 -8.134 -4.831 1.00 0.00 O ATOM 1209 OE2 GLU A 70 11.881 -8.652 -6.631 1.00 0.00 O ATOM 0 H GLU A 70 11.879 -4.283 -3.164 1.00 0.00 H new ATOM 0 HA GLU A 70 9.514 -5.218 -4.419 1.00 0.00 H new ATOM 0 HB2 GLU A 70 12.060 -6.329 -3.409 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.709 -7.443 -3.333 1.00 0.00 H new ATOM 0 HG2 GLU A 70 10.207 -6.996 -5.747 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.563 -5.888 -5.822 1.00 0.00 H new ATOM 1216 N ASN A 71 9.463 -5.029 -1.243 1.00 0.00 N ATOM 1217 CA ASN A 71 8.667 -5.235 -0.045 1.00 0.00 C ATOM 1218 C ASN A 71 7.505 -4.239 -0.032 1.00 0.00 C ATOM 1219 O ASN A 71 6.954 -3.937 1.025 1.00 0.00 O ATOM 1220 CB ASN A 71 9.501 -5.004 1.217 1.00 0.00 C ATOM 1221 CG ASN A 71 10.680 -5.977 1.281 1.00 0.00 C ATOM 1222 OD1 ASN A 71 10.705 -7.007 0.628 1.00 0.00 O ATOM 1223 ND2 ASN A 71 11.654 -5.594 2.102 1.00 0.00 N ATOM 0 H ASN A 71 10.211 -4.342 -1.145 1.00 0.00 H new ATOM 0 HA ASN A 71 8.304 -6.263 -0.054 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.870 -3.978 1.231 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.874 -5.129 2.100 1.00 0.00 H new ATOM 0 HD21 ASN A 71 12.485 -6.175 2.214 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.570 -4.719 2.620 1.00 0.00 H new ATOM 1230 N VAL A 72 7.168 -3.758 -1.220 1.00 0.00 N ATOM 1231 CA VAL A 72 6.081 -2.803 -1.359 1.00 0.00 C ATOM 1232 C VAL A 72 5.466 -2.936 -2.753 1.00 0.00 C ATOM 1233 O VAL A 72 4.266 -3.168 -2.886 1.00 0.00 O ATOM 1234 CB VAL A 72 6.586 -1.390 -1.060 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.462 -0.363 -1.215 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.209 -1.313 0.335 1.00 0.00 C ATOM 0 H VAL A 72 7.628 -4.011 -2.094 1.00 0.00 H new ATOM 0 HA VAL A 72 5.293 -3.012 -0.636 1.00 0.00 H new ATOM 0 HB VAL A 72 7.362 -1.151 -1.787 1.00 0.00 H new ATOM 0 HG11 VAL A 72 5.847 0.633 -0.997 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.083 -0.390 -2.237 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.655 -0.600 -0.522 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.560 -0.298 0.521 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.462 -1.582 1.082 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.050 -2.004 0.397 1.00 0.00 H new ATOM 1246 N LEU A 73 6.317 -2.784 -3.757 1.00 0.00 N ATOM 1247 CA LEU A 73 5.873 -2.885 -5.137 1.00 0.00 C ATOM 1248 C LEU A 73 6.512 -4.114 -5.786 1.00 0.00 C ATOM 1249 O LEU A 73 7.620 -4.036 -6.315 1.00 0.00 O ATOM 1250 CB LEU A 73 6.150 -1.580 -5.886 1.00 0.00 C ATOM 1251 CG LEU A 73 5.223 -1.272 -7.064 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.179 -0.222 -6.680 1.00 0.00 C ATOM 1253 CD2 LEU A 73 6.026 -0.858 -8.299 1.00 0.00 C ATOM 0 H LEU A 73 7.312 -2.592 -3.642 1.00 0.00 H new ATOM 0 HA LEU A 73 4.793 -3.027 -5.180 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.087 -0.756 -5.175 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.176 -1.606 -6.254 1.00 0.00 H new ATOM 0 HG LEU A 73 4.683 -2.183 -7.322 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.533 -0.021 -7.535 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.578 -0.593 -5.850 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.681 0.698 -6.381 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.344 -0.645 -9.122 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.610 0.034 -8.071 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.697 -1.668 -8.585 1.00 0.00 H new ATOM 1265 N PRO A 74 5.767 -5.250 -5.723 1.00 0.00 N ATOM 1266 CA PRO A 74 6.249 -6.494 -6.298 1.00 0.00 C ATOM 1267 C PRO A 74 6.145 -6.469 -7.824 1.00 0.00 C ATOM 1268 O PRO A 74 5.046 -6.411 -8.374 1.00 0.00 O ATOM 1269 CB PRO A 74 5.395 -7.579 -5.662 1.00 0.00 C ATOM 1270 CG PRO A 74 4.166 -6.873 -5.112 1.00 0.00 C ATOM 1271 CD PRO A 74 4.451 -5.380 -5.105 1.00 0.00 C ATOM 0 HA PRO A 74 7.306 -6.669 -6.096 1.00 0.00 H new ATOM 0 HB2 PRO A 74 5.115 -8.336 -6.395 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.940 -8.090 -4.868 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.293 -7.092 -5.726 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.943 -7.224 -4.104 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.695 -4.830 -5.665 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.449 -4.981 -4.090 1.00 0.00 H new ATOM 1279 N GLY A 75 7.303 -6.515 -8.466 1.00 0.00 N ATOM 1280 CA GLY A 75 7.356 -6.499 -9.918 1.00 0.00 C ATOM 1281 C GLY A 75 8.175 -5.309 -10.423 1.00 0.00 C ATOM 1282 O GLY A 75 8.736 -5.356 -11.517 1.00 0.00 O ATOM 0 H GLY A 75 8.213 -6.563 -8.007 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.796 -7.428 -10.280 1.00 0.00 H new ATOM 0 HA3 GLY A 75 6.345 -6.447 -10.322 1.00 0.00 H new ATOM 1286 N VAL A 76 8.218 -4.270 -9.602 1.00 0.00 N ATOM 1287 CA VAL A 76 8.958 -3.070 -9.952 1.00 0.00 C ATOM 1288 C VAL A 76 10.269 -3.466 -10.634 1.00 0.00 C ATOM 1289 O VAL A 76 10.819 -4.531 -10.359 1.00 0.00 O ATOM 1290 CB VAL A 76 9.169 -2.203 -8.709 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.824 -3.009 -7.585 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.992 -0.957 -9.042 1.00 0.00 C ATOM 0 H VAL A 76 7.752 -4.235 -8.695 1.00 0.00 H new ATOM 0 HA VAL A 76 8.392 -2.465 -10.661 1.00 0.00 H new ATOM 0 HB VAL A 76 8.190 -1.873 -8.360 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.963 -2.370 -6.713 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.184 -3.851 -7.320 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.792 -3.381 -7.921 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.127 -0.359 -8.141 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.966 -1.257 -9.428 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.470 -0.367 -9.795 1.00 0.00 H new ATOM 1302 N LYS A 77 10.732 -2.586 -11.511 1.00 0.00 N ATOM 1303 CA LYS A 77 11.968 -2.831 -12.235 1.00 0.00 C ATOM 1304 C LYS A 77 13.152 -2.370 -11.383 1.00 0.00 C ATOM 1305 O LYS A 77 14.213 -2.993 -11.398 1.00 0.00 O ATOM 1306 CB LYS A 77 11.916 -2.181 -13.619 1.00 0.00 C ATOM 1307 CG LYS A 77 10.911 -2.897 -14.524 1.00 0.00 C ATOM 1308 CD LYS A 77 11.439 -3.000 -15.956 1.00 0.00 C ATOM 1309 CE LYS A 77 11.353 -4.439 -16.470 1.00 0.00 C ATOM 1310 NZ LYS A 77 12.169 -4.602 -17.694 1.00 0.00 N ATOM 0 H LYS A 77 10.273 -1.703 -11.736 1.00 0.00 H new ATOM 0 HA LYS A 77 12.100 -3.898 -12.414 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.639 -1.131 -13.521 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.906 -2.209 -14.075 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.711 -3.895 -14.134 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.964 -2.358 -14.520 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.864 -2.342 -16.608 1.00 0.00 H new ATOM 0 HD3 LYS A 77 12.474 -2.659 -15.991 1.00 0.00 H new ATOM 0 HE2 LYS A 77 11.700 -5.128 -15.700 1.00 0.00 H new ATOM 0 HE3 LYS A 77 10.315 -4.694 -16.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.099 -5.584 -18.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.820 -3.958 -18.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 13.162 -4.378 -17.481 1.00 0.00 H new ATOM 1324 N SER A 78 12.932 -1.282 -10.660 1.00 0.00 N ATOM 1325 CA SER A 78 13.968 -0.730 -9.804 1.00 0.00 C ATOM 1326 C SER A 78 13.381 0.367 -8.913 1.00 0.00 C ATOM 1327 O SER A 78 12.275 0.845 -9.158 1.00 0.00 O ATOM 1328 CB SER A 78 15.130 -0.176 -10.631 1.00 0.00 C ATOM 1329 OG SER A 78 15.956 -1.214 -11.152 1.00 0.00 O ATOM 0 H SER A 78 12.051 -0.768 -10.649 1.00 0.00 H new ATOM 0 HA SER A 78 14.355 -1.532 -9.176 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.737 0.422 -11.453 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.731 0.489 -10.012 1.00 0.00 H new ATOM 0 HG SER A 78 15.549 -2.084 -10.958 1.00 0.00 H new ATOM 1335 N ILE A 79 14.149 0.734 -7.897 1.00 0.00 N ATOM 1336 CA ILE A 79 13.719 1.765 -6.968 1.00 0.00 C ATOM 1337 C ILE A 79 13.322 3.018 -7.752 1.00 0.00 C ATOM 1338 O ILE A 79 12.377 3.712 -7.382 1.00 0.00 O ATOM 1339 CB ILE A 79 14.795 2.017 -5.911 1.00 0.00 C ATOM 1340 CG1 ILE A 79 15.087 0.745 -5.112 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.410 3.187 -5.004 1.00 0.00 C ATOM 1342 CD1 ILE A 79 15.959 1.051 -3.892 1.00 0.00 C ATOM 0 H ILE A 79 15.066 0.336 -7.697 1.00 0.00 H new ATOM 0 HA ILE A 79 12.836 1.438 -6.419 1.00 0.00 H new ATOM 0 HB ILE A 79 15.717 2.296 -6.422 1.00 0.00 H new ATOM 0 HG12 ILE A 79 14.150 0.291 -4.789 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.590 0.018 -5.750 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.192 3.345 -4.262 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.292 4.089 -5.604 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.471 2.962 -4.499 1.00 0.00 H new ATOM 0 HD11 ILE A 79 16.151 0.130 -3.342 1.00 0.00 H new ATOM 0 HD12 ILE A 79 16.905 1.482 -4.220 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.443 1.759 -3.244 1.00 0.00 H new ATOM 1354 N GLU A 80 14.065 3.268 -8.820 1.00 0.00 N ATOM 1355 CA GLU A 80 13.802 4.425 -9.659 1.00 0.00 C ATOM 1356 C GLU A 80 12.439 4.289 -10.340 1.00 0.00 C ATOM 1357 O GLU A 80 11.630 5.215 -10.307 1.00 0.00 O ATOM 1358 CB GLU A 80 14.914 4.616 -10.693 1.00 0.00 C ATOM 1359 CG GLU A 80 15.764 5.846 -10.364 1.00 0.00 C ATOM 1360 CD GLU A 80 15.685 6.883 -11.486 1.00 0.00 C ATOM 1361 OE1 GLU A 80 14.586 7.006 -12.069 1.00 0.00 O ATOM 1362 OE2 GLU A 80 16.726 7.529 -11.735 1.00 0.00 O ATOM 0 H GLU A 80 14.848 2.690 -9.124 1.00 0.00 H new ATOM 0 HA GLU A 80 13.783 5.312 -9.025 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.547 3.729 -10.720 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.477 4.726 -11.686 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.422 6.290 -9.429 1.00 0.00 H new ATOM 0 HG3 GLU A 80 16.801 5.546 -10.213 1.00 0.00 H new ATOM 1369 N GLU A 81 12.226 3.128 -10.940 1.00 0.00 N ATOM 1370 CA GLU A 81 10.974 2.858 -11.627 1.00 0.00 C ATOM 1371 C GLU A 81 9.802 2.941 -10.647 1.00 0.00 C ATOM 1372 O GLU A 81 8.742 3.465 -10.985 1.00 0.00 O ATOM 1373 CB GLU A 81 11.012 1.496 -12.322 1.00 0.00 C ATOM 1374 CG GLU A 81 11.862 1.553 -13.594 1.00 0.00 C ATOM 1375 CD GLU A 81 11.084 1.016 -14.797 1.00 0.00 C ATOM 1376 OE1 GLU A 81 9.956 1.512 -15.011 1.00 0.00 O ATOM 1377 OE2 GLU A 81 11.634 0.123 -15.477 1.00 0.00 O ATOM 0 H GLU A 81 12.900 2.362 -10.965 1.00 0.00 H new ATOM 0 HA GLU A 81 10.834 3.617 -12.396 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.419 0.748 -11.642 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.998 1.183 -12.571 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.169 2.581 -13.785 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.772 0.969 -13.454 1.00 0.00 H new ATOM 1384 N GLY A 82 10.033 2.416 -9.453 1.00 0.00 N ATOM 1385 CA GLY A 82 9.010 2.425 -8.421 1.00 0.00 C ATOM 1386 C GLY A 82 8.464 3.837 -8.201 1.00 0.00 C ATOM 1387 O GLY A 82 7.264 4.020 -8.006 1.00 0.00 O ATOM 0 H GLY A 82 10.914 1.982 -9.177 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.197 1.757 -8.705 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.426 2.043 -7.489 1.00 0.00 H new ATOM 1391 N ILE A 83 9.373 4.800 -8.239 1.00 0.00 N ATOM 1392 CA ILE A 83 8.999 6.191 -8.046 1.00 0.00 C ATOM 1393 C ILE A 83 8.136 6.650 -9.223 1.00 0.00 C ATOM 1394 O ILE A 83 7.233 7.468 -9.053 1.00 0.00 O ATOM 1395 CB ILE A 83 10.242 7.054 -7.821 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.741 6.931 -6.380 1.00 0.00 C ATOM 1397 CG2 ILE A 83 9.977 8.509 -8.214 1.00 0.00 C ATOM 1398 CD1 ILE A 83 12.270 6.886 -6.331 1.00 0.00 C ATOM 0 H ILE A 83 10.368 4.645 -8.401 1.00 0.00 H new ATOM 0 HA ILE A 83 8.396 6.302 -7.145 1.00 0.00 H new ATOM 0 HB ILE A 83 11.037 6.685 -8.469 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.379 7.775 -5.793 1.00 0.00 H new ATOM 0 HG13 ILE A 83 10.332 6.028 -5.926 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.876 9.101 -8.044 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.704 8.557 -9.268 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.162 8.906 -7.610 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.598 6.798 -5.295 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.627 6.027 -6.899 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.675 7.801 -6.764 1.00 0.00 H new ATOM 1410 N GLN A 84 8.445 6.105 -10.390 1.00 0.00 N ATOM 1411 CA GLN A 84 7.709 6.448 -11.595 1.00 0.00 C ATOM 1412 C GLN A 84 6.266 5.946 -11.497 1.00 0.00 C ATOM 1413 O GLN A 84 5.343 6.605 -11.973 1.00 0.00 O ATOM 1414 CB GLN A 84 8.401 5.888 -12.839 1.00 0.00 C ATOM 1415 CG GLN A 84 9.363 6.915 -13.440 1.00 0.00 C ATOM 1416 CD GLN A 84 8.651 8.242 -13.709 1.00 0.00 C ATOM 1417 OE1 GLN A 84 7.565 8.292 -14.262 1.00 0.00 O ATOM 1418 NE2 GLN A 84 9.322 9.311 -13.289 1.00 0.00 N ATOM 0 H GLN A 84 9.195 5.428 -10.527 1.00 0.00 H new ATOM 0 HA GLN A 84 7.690 7.534 -11.688 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.947 4.981 -12.579 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.653 5.608 -13.581 1.00 0.00 H new ATOM 0 HG2 GLN A 84 10.198 7.078 -12.759 1.00 0.00 H new ATOM 0 HG3 GLN A 84 9.780 6.527 -14.369 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.227 9.198 -12.833 1.00 0.00 H new ATOM 0 HE22 GLN A 84 8.931 10.244 -13.423 1.00 0.00 H new ATOM 1427 N VAL A 85 6.119 4.784 -10.878 1.00 0.00 N ATOM 1428 CA VAL A 85 4.805 4.187 -10.712 1.00 0.00 C ATOM 1429 C VAL A 85 3.959 5.071 -9.793 1.00 0.00 C ATOM 1430 O VAL A 85 2.776 5.287 -10.051 1.00 0.00 O ATOM 1431 CB VAL A 85 4.944 2.752 -10.198 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.720 2.343 -9.376 1.00 0.00 C ATOM 1433 CG2 VAL A 85 5.179 1.777 -11.354 1.00 0.00 C ATOM 0 H VAL A 85 6.888 4.240 -10.486 1.00 0.00 H new ATOM 0 HA VAL A 85 4.289 4.127 -11.670 1.00 0.00 H new ATOM 0 HB VAL A 85 5.815 2.713 -9.544 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.844 1.319 -9.023 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.616 3.012 -8.521 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.827 2.406 -9.997 1.00 0.00 H new ATOM 0 HG21 VAL A 85 5.274 0.764 -10.962 1.00 0.00 H new ATOM 0 HG22 VAL A 85 4.337 1.821 -12.044 1.00 0.00 H new ATOM 0 HG23 VAL A 85 6.094 2.050 -11.880 1.00 0.00 H new ATOM 1443 N TYR A 86 4.600 5.559 -8.741 1.00 0.00 N ATOM 1444 CA TYR A 86 3.921 6.415 -7.783 1.00 0.00 C ATOM 1445 C TYR A 86 3.600 7.779 -8.397 1.00 0.00 C ATOM 1446 O TYR A 86 2.621 8.420 -8.018 1.00 0.00 O ATOM 1447 CB TYR A 86 4.900 6.609 -6.623 1.00 0.00 C ATOM 1448 CG TYR A 86 5.632 5.332 -6.206 1.00 0.00 C ATOM 1449 CD1 TYR A 86 5.053 4.099 -6.434 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.871 5.412 -5.603 1.00 0.00 C ATOM 1451 CE1 TYR A 86 5.742 2.897 -6.041 1.00 0.00 C ATOM 1452 CE2 TYR A 86 7.559 4.209 -5.211 1.00 0.00 C ATOM 1453 CZ TYR A 86 6.961 3.012 -5.449 1.00 0.00 C ATOM 1454 OH TYR A 86 7.611 1.876 -5.078 1.00 0.00 O ATOM 0 H TYR A 86 5.582 5.378 -8.531 1.00 0.00 H new ATOM 0 HA TYR A 86 2.980 5.965 -7.466 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.636 7.362 -6.904 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.356 7.001 -5.764 1.00 0.00 H new ATOM 0 HD1 TYR A 86 4.084 4.036 -6.907 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.324 6.376 -5.425 1.00 0.00 H new ATOM 0 HE1 TYR A 86 5.301 1.926 -6.212 1.00 0.00 H new ATOM 0 HE2 TYR A 86 8.529 4.257 -4.738 1.00 0.00 H new ATOM 0 HH TYR A 86 8.530 1.899 -5.418 1.00 0.00 H new ATOM 1464 N ARG A 87 4.443 8.182 -9.337 1.00 0.00 N ATOM 1465 CA ARG A 87 4.262 9.458 -10.007 1.00 0.00 C ATOM 1466 C ARG A 87 3.095 9.378 -10.994 1.00 0.00 C ATOM 1467 O ARG A 87 2.218 10.241 -10.996 1.00 0.00 O ATOM 1468 CB ARG A 87 5.529 9.870 -10.759 1.00 0.00 C ATOM 1469 CG ARG A 87 6.025 11.238 -10.287 1.00 0.00 C ATOM 1470 CD ARG A 87 7.553 11.269 -10.207 1.00 0.00 C ATOM 1471 NE ARG A 87 7.992 12.384 -9.338 1.00 0.00 N ATOM 1472 CZ ARG A 87 7.950 12.355 -7.999 1.00 0.00 C ATOM 1473 NH1 ARG A 87 7.489 11.267 -7.367 1.00 0.00 N ATOM 1474 NH2 ARG A 87 8.369 13.414 -7.293 1.00 0.00 N ATOM 0 H ARG A 87 5.253 7.647 -9.650 1.00 0.00 H new ATOM 0 HA ARG A 87 4.047 10.206 -9.244 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.308 9.123 -10.604 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.327 9.902 -11.830 1.00 0.00 H new ATOM 0 HG2 ARG A 87 5.677 12.011 -10.972 1.00 0.00 H new ATOM 0 HG3 ARG A 87 5.601 11.465 -9.309 1.00 0.00 H new ATOM 0 HD2 ARG A 87 7.924 10.323 -9.814 1.00 0.00 H new ATOM 0 HD3 ARG A 87 7.975 11.387 -11.205 1.00 0.00 H new ATOM 0 HE ARG A 87 8.349 13.228 -9.787 1.00 0.00 H new ATOM 0 HH11 ARG A 87 7.170 10.461 -7.905 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.457 11.245 -6.348 1.00 0.00 H new ATOM 0 HH21 ARG A 87 8.720 14.242 -7.775 1.00 0.00 H new ATOM 0 HH22 ARG A 87 8.337 13.392 -6.274 1.00 0.00 H new ATOM 1488 N ARG A 88 3.121 8.334 -11.809 1.00 0.00 N ATOM 1489 CA ARG A 88 2.077 8.130 -12.798 1.00 0.00 C ATOM 1490 C ARG A 88 0.700 8.161 -12.131 1.00 0.00 C ATOM 1491 O ARG A 88 -0.235 8.761 -12.657 1.00 0.00 O ATOM 1492 CB ARG A 88 2.256 6.793 -13.520 1.00 0.00 C ATOM 1493 CG ARG A 88 3.488 6.819 -14.426 1.00 0.00 C ATOM 1494 CD ARG A 88 3.834 5.414 -14.923 1.00 0.00 C ATOM 1495 NE ARG A 88 2.815 4.956 -15.894 1.00 0.00 N ATOM 1496 CZ ARG A 88 2.967 3.896 -16.699 1.00 0.00 C ATOM 1497 NH1 ARG A 88 4.098 3.178 -16.655 1.00 0.00 N ATOM 1498 NH2 ARG A 88 1.989 3.554 -17.549 1.00 0.00 N ATOM 0 H ARG A 88 3.849 7.620 -11.804 1.00 0.00 H new ATOM 0 HA ARG A 88 2.149 8.937 -13.527 1.00 0.00 H new ATOM 0 HB2 ARG A 88 2.355 5.991 -12.788 1.00 0.00 H new ATOM 0 HB3 ARG A 88 1.368 6.575 -14.114 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.304 7.474 -15.277 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.336 7.235 -13.881 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.819 5.417 -15.391 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.883 4.723 -14.081 1.00 0.00 H new ATOM 0 HE ARG A 88 1.942 5.480 -15.954 1.00 0.00 H new ATOM 0 HH11 ARG A 88 4.843 3.439 -16.009 1.00 0.00 H new ATOM 0 HH12 ARG A 88 4.214 2.371 -17.268 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.129 4.101 -17.583 1.00 0.00 H new ATOM 0 HH22 ARG A 88 2.105 2.747 -18.162 1.00 0.00 H new ATOM 1512 N PHE A 89 0.620 7.506 -10.982 1.00 0.00 N ATOM 1513 CA PHE A 89 -0.626 7.452 -10.237 1.00 0.00 C ATOM 1514 C PHE A 89 -0.785 8.683 -9.342 1.00 0.00 C ATOM 1515 O PHE A 89 -1.787 9.391 -9.427 1.00 0.00 O ATOM 1516 CB PHE A 89 -0.567 6.201 -9.357 1.00 0.00 C ATOM 1517 CG PHE A 89 -0.534 4.889 -10.143 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -1.374 4.706 -11.197 1.00 0.00 C ATOM 1519 CD2 PHE A 89 0.335 3.905 -9.787 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -1.344 3.488 -11.926 1.00 0.00 C ATOM 1521 CE2 PHE A 89 0.365 2.687 -10.516 1.00 0.00 C ATOM 1522 CZ PHE A 89 -0.475 2.504 -11.570 1.00 0.00 C ATOM 0 H PHE A 89 1.398 7.008 -10.549 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.470 7.426 -10.926 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.319 6.256 -8.724 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.432 6.194 -8.694 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.064 5.487 -11.479 1.00 0.00 H new ATOM 0 HD2 PHE A 89 1.002 4.050 -8.950 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.011 3.343 -12.763 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.055 1.906 -10.234 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.452 1.577 -12.124 1.00 0.00 H new ATOM 1532 N TYR A 90 0.219 8.901 -8.506 1.00 0.00 N ATOM 1533 CA TYR A 90 0.204 10.034 -7.597 1.00 0.00 C ATOM 1534 C TYR A 90 1.015 11.202 -8.163 1.00 0.00 C ATOM 1535 O TYR A 90 2.099 11.003 -8.708 1.00 0.00 O ATOM 1536 CB TYR A 90 0.865 9.548 -6.306 1.00 0.00 C ATOM 1537 CG TYR A 90 0.633 8.065 -6.008 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.542 7.458 -6.402 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.598 7.335 -5.345 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -0.761 6.063 -6.121 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.380 5.940 -5.065 1.00 0.00 C ATOM 1542 CZ TYR A 90 0.211 5.372 -5.467 1.00 0.00 C ATOM 1543 OH TYR A 90 0.005 4.054 -5.202 1.00 0.00 O ATOM 0 H TYR A 90 1.049 8.312 -8.439 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.816 10.385 -7.438 1.00 0.00 H new ATOM 0 HB2 TYR A 90 1.938 9.732 -6.367 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.487 10.139 -5.472 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.297 8.029 -6.921 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.517 7.810 -5.036 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.677 5.576 -6.423 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.128 5.357 -4.547 1.00 0.00 H new ATOM 0 HH TYR A 90 0.783 3.689 -4.731 1.00 0.00 H new ATOM 1553 N ASP A 91 0.458 12.395 -8.014 1.00 0.00 N ATOM 1554 CA ASP A 91 1.115 13.594 -8.503 1.00 0.00 C ATOM 1555 C ASP A 91 2.402 13.825 -7.708 1.00 0.00 C ATOM 1556 O ASP A 91 2.437 13.603 -6.498 1.00 0.00 O ATOM 1557 CB ASP A 91 0.222 14.824 -8.324 1.00 0.00 C ATOM 1558 CG ASP A 91 -1.281 14.546 -8.388 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -1.816 14.578 -9.517 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -1.861 14.308 -7.307 1.00 0.00 O ATOM 0 H ASP A 91 -0.442 12.556 -7.561 1.00 0.00 H new ATOM 0 HA ASP A 91 1.327 13.454 -9.563 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.451 15.284 -7.362 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.475 15.553 -9.094 1.00 0.00 H new ATOM 1565 N GLU A 92 3.428 14.269 -8.419 1.00 0.00 N ATOM 1566 CA GLU A 92 4.713 14.532 -7.795 1.00 0.00 C ATOM 1567 C GLU A 92 4.598 15.702 -6.816 1.00 0.00 C ATOM 1568 O GLU A 92 5.148 15.652 -5.716 1.00 0.00 O ATOM 1569 CB GLU A 92 5.789 14.804 -8.849 1.00 0.00 C ATOM 1570 CG GLU A 92 5.535 16.133 -9.562 1.00 0.00 C ATOM 1571 CD GLU A 92 6.460 16.293 -10.771 1.00 0.00 C ATOM 1572 OE1 GLU A 92 6.630 15.286 -11.492 1.00 0.00 O ATOM 1573 OE2 GLU A 92 6.975 17.418 -10.946 1.00 0.00 O ATOM 0 H GLU A 92 3.395 14.453 -9.422 1.00 0.00 H new ATOM 0 HA GLU A 92 5.012 13.645 -7.237 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.770 14.823 -8.375 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.803 13.993 -9.577 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.495 16.183 -9.886 1.00 0.00 H new ATOM 0 HG3 GLU A 92 5.692 16.958 -8.867 1.00 0.00 H new ATOM 1580 N GLU A 93 3.880 16.727 -7.250 1.00 0.00 N ATOM 1581 CA GLU A 93 3.686 17.907 -6.425 1.00 0.00 C ATOM 1582 C GLU A 93 3.016 17.526 -5.103 1.00 0.00 C ATOM 1583 O GLU A 93 3.536 17.829 -4.030 1.00 0.00 O ATOM 1584 CB GLU A 93 2.869 18.967 -7.167 1.00 0.00 C ATOM 1585 CG GLU A 93 3.564 20.329 -7.117 1.00 0.00 C ATOM 1586 CD GLU A 93 2.541 21.464 -7.031 1.00 0.00 C ATOM 1587 OE1 GLU A 93 1.707 21.547 -7.959 1.00 0.00 O ATOM 1588 OE2 GLU A 93 2.616 22.222 -6.040 1.00 0.00 O ATOM 0 H GLU A 93 3.425 16.765 -8.162 1.00 0.00 H new ATOM 0 HA GLU A 93 4.663 18.337 -6.205 1.00 0.00 H new ATOM 0 HB2 GLU A 93 2.730 18.664 -8.205 1.00 0.00 H new ATOM 0 HB3 GLU A 93 1.877 19.044 -6.722 1.00 0.00 H new ATOM 0 HG2 GLU A 93 4.231 20.370 -6.256 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.182 20.459 -8.005 1.00 0.00 H new ATOM 1595 N LYS A 94 1.873 16.867 -5.223 1.00 0.00 N ATOM 1596 CA LYS A 94 1.127 16.442 -4.051 1.00 0.00 C ATOM 1597 C LYS A 94 1.995 15.498 -3.215 1.00 0.00 C ATOM 1598 O LYS A 94 1.963 15.545 -1.986 1.00 0.00 O ATOM 1599 CB LYS A 94 -0.218 15.839 -4.461 1.00 0.00 C ATOM 1600 CG LYS A 94 -1.378 16.728 -4.010 1.00 0.00 C ATOM 1601 CD LYS A 94 -2.076 16.138 -2.783 1.00 0.00 C ATOM 1602 CE LYS A 94 -3.574 16.449 -2.802 1.00 0.00 C ATOM 1603 NZ LYS A 94 -4.350 15.297 -2.291 1.00 0.00 N ATOM 0 H LYS A 94 1.445 16.617 -6.114 1.00 0.00 H new ATOM 0 HA LYS A 94 0.887 17.298 -3.421 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.250 15.715 -5.543 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.324 14.847 -4.023 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.007 17.726 -3.777 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.095 16.837 -4.824 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.925 15.059 -2.758 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.628 16.543 -1.876 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.776 17.330 -2.193 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -3.889 16.685 -3.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.364 15.525 -2.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.171 14.465 -2.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -4.061 15.090 -1.314 1.00 0.00 H new ATOM 1617 N GLU A 95 2.749 14.663 -3.915 1.00 0.00 N ATOM 1618 CA GLU A 95 3.623 13.710 -3.252 1.00 0.00 C ATOM 1619 C GLU A 95 4.707 14.445 -2.462 1.00 0.00 C ATOM 1620 O GLU A 95 4.886 14.199 -1.270 1.00 0.00 O ATOM 1621 CB GLU A 95 4.242 12.741 -4.261 1.00 0.00 C ATOM 1622 CG GLU A 95 4.838 11.521 -3.555 1.00 0.00 C ATOM 1623 CD GLU A 95 6.295 11.772 -3.164 1.00 0.00 C ATOM 1624 OE1 GLU A 95 6.500 12.323 -2.061 1.00 0.00 O ATOM 1625 OE2 GLU A 95 7.172 11.407 -3.977 1.00 0.00 O ATOM 0 H GLU A 95 2.773 14.627 -4.934 1.00 0.00 H new ATOM 0 HA GLU A 95 3.026 13.124 -2.553 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.483 12.418 -4.974 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.018 13.251 -4.831 1.00 0.00 H new ATOM 0 HG2 GLU A 95 4.253 11.290 -2.665 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.778 10.652 -4.210 1.00 0.00 H new ATOM 1632 N LYS A 96 5.403 15.333 -3.157 1.00 0.00 N ATOM 1633 CA LYS A 96 6.464 16.105 -2.535 1.00 0.00 C ATOM 1634 C LYS A 96 5.863 17.027 -1.472 1.00 0.00 C ATOM 1635 O LYS A 96 6.582 17.558 -0.627 1.00 0.00 O ATOM 1636 CB LYS A 96 7.283 16.843 -3.596 1.00 0.00 C ATOM 1637 CG LYS A 96 8.694 16.260 -3.704 1.00 0.00 C ATOM 1638 CD LYS A 96 9.691 17.321 -4.173 1.00 0.00 C ATOM 1639 CE LYS A 96 9.606 17.522 -5.687 1.00 0.00 C ATOM 1640 NZ LYS A 96 10.951 17.775 -6.252 1.00 0.00 N ATOM 0 H LYS A 96 5.252 15.535 -4.145 1.00 0.00 H new ATOM 0 HA LYS A 96 7.166 15.445 -2.025 1.00 0.00 H new ATOM 0 HB2 LYS A 96 6.782 16.773 -4.561 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.342 17.902 -3.344 1.00 0.00 H new ATOM 0 HG2 LYS A 96 9.004 15.867 -2.736 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.693 15.423 -4.402 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.489 18.264 -3.665 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.702 17.021 -3.899 1.00 0.00 H new ATOM 0 HE2 LYS A 96 9.169 16.639 -6.153 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.947 18.360 -5.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 10.876 17.909 -7.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 11.354 18.631 -5.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.569 16.963 -6.053 1.00 0.00 H new ATOM 1654 N LYS A 97 4.550 17.190 -1.549 1.00 0.00 N ATOM 1655 CA LYS A 97 3.844 18.038 -0.604 1.00 0.00 C ATOM 1656 C LYS A 97 3.859 17.378 0.776 1.00 0.00 C ATOM 1657 O LYS A 97 4.357 17.958 1.740 1.00 0.00 O ATOM 1658 CB LYS A 97 2.439 18.359 -1.118 1.00 0.00 C ATOM 1659 CG LYS A 97 2.236 19.869 -1.252 1.00 0.00 C ATOM 1660 CD LYS A 97 1.210 20.190 -2.341 1.00 0.00 C ATOM 1661 CE LYS A 97 -0.165 20.473 -1.733 1.00 0.00 C ATOM 1662 NZ LYS A 97 -0.420 21.930 -1.682 1.00 0.00 N ATOM 0 H LYS A 97 3.957 16.749 -2.252 1.00 0.00 H new ATOM 0 HA LYS A 97 4.348 18.999 -0.503 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.283 17.880 -2.085 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.695 17.948 -0.435 1.00 0.00 H new ATOM 0 HG2 LYS A 97 1.902 20.280 -0.300 1.00 0.00 H new ATOM 0 HG3 LYS A 97 3.186 20.348 -1.490 1.00 0.00 H new ATOM 0 HD2 LYS A 97 1.543 21.055 -2.915 1.00 0.00 H new ATOM 0 HD3 LYS A 97 1.139 19.354 -3.036 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -0.938 19.983 -2.325 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.218 20.053 -0.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.357 22.104 -1.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 0.308 22.390 -1.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -0.390 22.322 -2.645 1.00 0.00 H new ATOM 1676 N TYR A 98 3.306 16.175 0.828 1.00 0.00 N ATOM 1677 CA TYR A 98 3.249 15.431 2.074 1.00 0.00 C ATOM 1678 C TYR A 98 4.369 14.391 2.143 1.00 0.00 C ATOM 1679 O TYR A 98 5.114 14.340 3.120 1.00 0.00 O ATOM 1680 CB TYR A 98 1.899 14.710 2.073 1.00 0.00 C ATOM 1681 CG TYR A 98 0.717 15.603 2.458 1.00 0.00 C ATOM 1682 CD1 TYR A 98 0.551 16.002 3.769 1.00 0.00 C ATOM 1683 CD2 TYR A 98 -0.183 16.009 1.494 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.561 16.842 4.130 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.295 16.849 1.855 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.429 17.224 3.156 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.480 18.017 3.497 1.00 0.00 O ATOM 0 H TYR A 98 2.893 15.697 0.027 1.00 0.00 H new ATOM 0 HA TYR A 98 3.365 16.100 2.927 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.720 14.296 1.081 1.00 0.00 H new ATOM 0 HB3 TYR A 98 1.947 13.869 2.765 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.255 15.684 4.524 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.053 15.696 0.468 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.702 17.162 5.152 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -2.006 17.174 1.110 1.00 0.00 H new ATOM 0 HH TYR A 98 -3.015 18.211 2.700 1.00 0.00 H new ATOM 1697 N GLY A 99 4.452 13.587 1.093 1.00 0.00 N ATOM 1698 CA GLY A 99 5.468 12.551 1.022 1.00 0.00 C ATOM 1699 C GLY A 99 4.833 11.172 0.830 1.00 0.00 C ATOM 1700 O GLY A 99 3.924 11.011 0.017 1.00 0.00 O ATOM 0 H GLY A 99 3.832 13.632 0.284 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.148 12.760 0.197 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.063 12.557 1.935 1.00 0.00 H new ATOM 1704 N VAL A 100 5.337 10.212 1.592 1.00 0.00 N ATOM 1705 CA VAL A 100 4.830 8.853 1.516 1.00 0.00 C ATOM 1706 C VAL A 100 4.593 8.321 2.931 1.00 0.00 C ATOM 1707 O VAL A 100 5.235 8.767 3.880 1.00 0.00 O ATOM 1708 CB VAL A 100 5.790 7.982 0.702 1.00 0.00 C ATOM 1709 CG1 VAL A 100 5.060 6.784 0.092 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.494 8.804 -0.379 1.00 0.00 C ATOM 0 H VAL A 100 6.091 10.349 2.265 1.00 0.00 H new ATOM 0 HA VAL A 100 3.872 8.831 0.997 1.00 0.00 H new ATOM 0 HB VAL A 100 6.552 7.599 1.381 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.765 6.182 -0.481 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.628 6.178 0.888 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.266 7.138 -0.566 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.170 8.161 -0.942 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.751 9.230 -1.054 1.00 0.00 H new ATOM 0 HG23 VAL A 100 7.063 9.608 0.088 1.00 0.00 H new ATOM 1720 N VAL A 101 3.670 7.376 3.026 1.00 0.00 N ATOM 1721 CA VAL A 101 3.340 6.779 4.309 1.00 0.00 C ATOM 1722 C VAL A 101 3.193 5.265 4.140 1.00 0.00 C ATOM 1723 O VAL A 101 2.240 4.796 3.519 1.00 0.00 O ATOM 1724 CB VAL A 101 2.088 7.440 4.888 1.00 0.00 C ATOM 1725 CG1 VAL A 101 2.405 8.834 5.433 1.00 0.00 C ATOM 1726 CG2 VAL A 101 0.969 7.500 3.846 1.00 0.00 C ATOM 0 H VAL A 101 3.140 7.009 2.236 1.00 0.00 H new ATOM 0 HA VAL A 101 4.142 6.950 5.027 1.00 0.00 H new ATOM 0 HB VAL A 101 1.740 6.827 5.720 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.497 9.281 5.839 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.154 8.755 6.221 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.790 9.460 4.628 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.090 7.974 4.283 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.304 8.079 2.985 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.715 6.489 3.527 1.00 0.00 H new ATOM 1736 N ALA A 102 4.151 4.543 4.702 1.00 0.00 N ATOM 1737 CA ALA A 102 4.140 3.092 4.621 1.00 0.00 C ATOM 1738 C ALA A 102 3.213 2.532 5.702 1.00 0.00 C ATOM 1739 O ALA A 102 3.614 2.392 6.857 1.00 0.00 O ATOM 1740 CB ALA A 102 5.570 2.563 4.748 1.00 0.00 C ATOM 0 H ALA A 102 4.940 4.936 5.215 1.00 0.00 H new ATOM 0 HA ALA A 102 3.756 2.764 3.655 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.562 1.475 4.687 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.180 2.967 3.940 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.988 2.870 5.707 1.00 0.00 H new ATOM 1746 N ILE A 103 1.992 2.227 5.289 1.00 0.00 N ATOM 1747 CA ILE A 103 1.005 1.686 6.207 1.00 0.00 C ATOM 1748 C ILE A 103 1.106 0.159 6.216 1.00 0.00 C ATOM 1749 O ILE A 103 1.212 -0.465 5.162 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.391 2.208 5.862 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.379 3.727 5.678 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -1.416 1.766 6.909 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -0.499 4.100 4.199 1.00 0.00 C ATOM 0 H ILE A 103 1.664 2.344 4.330 1.00 0.00 H new ATOM 0 HA ILE A 103 1.204 2.025 7.224 1.00 0.00 H new ATOM 0 HB ILE A 103 -0.693 1.771 4.910 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -1.203 4.171 6.237 1.00 0.00 H new ATOM 0 HG13 ILE A 103 0.543 4.139 6.087 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -2.400 2.150 6.640 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -1.450 0.677 6.948 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -1.129 2.155 7.886 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -0.488 5.185 4.095 1.00 0.00 H new ATOM 0 HD12 ILE A 103 0.339 3.674 3.647 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -1.434 3.707 3.799 1.00 0.00 H new ATOM 1765 N GLU A 104 1.070 -0.398 7.418 1.00 0.00 N ATOM 1766 CA GLU A 104 1.156 -1.839 7.577 1.00 0.00 C ATOM 1767 C GLU A 104 -0.244 -2.456 7.594 1.00 0.00 C ATOM 1768 O GLU A 104 -1.021 -2.217 8.517 1.00 0.00 O ATOM 1769 CB GLU A 104 1.931 -2.205 8.844 1.00 0.00 C ATOM 1770 CG GLU A 104 2.360 -3.674 8.820 1.00 0.00 C ATOM 1771 CD GLU A 104 3.577 -3.905 9.718 1.00 0.00 C ATOM 1772 OE1 GLU A 104 3.369 -3.977 10.949 1.00 0.00 O ATOM 1773 OE2 GLU A 104 4.688 -4.004 9.154 1.00 0.00 O ATOM 0 H GLU A 104 0.982 0.123 8.290 1.00 0.00 H new ATOM 0 HA GLU A 104 1.701 -2.247 6.726 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.810 -1.567 8.934 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.311 -2.018 9.721 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.534 -4.303 9.152 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.596 -3.971 7.798 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.524 -3.238 6.562 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.817 -3.891 6.446 1.00 0.00 C ATOM 1782 C ILE A 105 -1.617 -5.408 6.427 1.00 0.00 C ATOM 1783 O ILE A 105 -0.494 -5.888 6.282 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.580 -3.356 5.233 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -2.208 -4.129 3.966 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.365 -1.850 5.070 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -0.733 -3.927 3.614 1.00 0.00 C ATOM 0 H ILE A 105 0.123 -3.434 5.798 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.439 -3.662 7.311 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.645 -3.512 5.404 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -2.409 -5.190 4.111 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.832 -3.797 3.137 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.918 -1.495 4.200 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.720 -1.333 5.962 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.303 -1.647 4.932 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.495 -4.487 2.710 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.541 -2.867 3.446 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -0.111 -4.283 4.435 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.725 -6.120 6.576 1.00 0.00 N ATOM 1800 CA GLU A 106 -2.686 -7.572 6.577 1.00 0.00 C ATOM 1801 C GLU A 106 -4.070 -8.141 6.257 1.00 0.00 C ATOM 1802 O GLU A 106 -5.004 -7.990 7.043 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.171 -8.105 7.916 1.00 0.00 C ATOM 1804 CG GLU A 106 -2.617 -7.208 9.072 1.00 0.00 C ATOM 1805 CD GLU A 106 -2.828 -8.023 10.349 1.00 0.00 C ATOM 1806 OE1 GLU A 106 -2.771 -9.267 10.244 1.00 0.00 O ATOM 1807 OE2 GLU A 106 -3.041 -7.383 11.402 1.00 0.00 O ATOM 0 H GLU A 106 -3.655 -5.718 6.697 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.993 -7.898 5.802 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.540 -9.118 8.074 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -1.083 -8.162 7.894 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -1.867 -6.437 9.248 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -3.542 -6.698 8.805 1.00 0.00 H new ATOM 1814 N PRO A 107 -4.160 -8.800 5.071 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.414 -9.392 4.637 1.00 0.00 C ATOM 1816 C PRO A 107 -5.711 -10.677 5.412 1.00 0.00 C ATOM 1817 O PRO A 107 -5.011 -11.676 5.257 1.00 0.00 O ATOM 1818 CB PRO A 107 -5.243 -9.625 3.144 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.745 -9.589 2.886 1.00 0.00 C ATOM 1820 CD PRO A 107 -3.074 -8.998 4.115 1.00 0.00 C ATOM 0 HA PRO A 107 -6.272 -8.749 4.831 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.668 -10.584 2.847 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.757 -8.856 2.567 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.367 -10.593 2.690 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.524 -8.988 2.004 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.314 -9.670 4.513 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.576 -8.057 3.881 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.750 -10.608 6.231 1.00 0.00 N ATOM 1829 CA LEU A 108 -7.149 -11.754 7.032 1.00 0.00 C ATOM 1830 C LEU A 108 -8.217 -12.550 6.279 1.00 0.00 C ATOM 1831 O LEU A 108 -9.410 -12.392 6.535 1.00 0.00 O ATOM 1832 CB LEU A 108 -7.586 -11.306 8.428 1.00 0.00 C ATOM 1833 CG LEU A 108 -8.498 -10.078 8.483 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -9.590 -10.253 9.540 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -7.685 -8.801 8.706 1.00 0.00 C ATOM 0 H LEU A 108 -7.328 -9.777 6.358 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.303 -12.423 7.188 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -8.100 -12.137 8.911 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -6.693 -11.098 9.017 1.00 0.00 H new ATOM 0 HG LEU A 108 -8.996 -9.979 7.518 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -10.224 -9.366 9.558 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -10.195 -11.127 9.297 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.130 -10.391 10.519 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.357 -7.943 8.741 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -7.142 -8.875 9.648 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -6.976 -8.673 7.888 1.00 0.00 H new