USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 947 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 92 LYS NZ :NH3+ -123:sc= -0.0861 (180deg=-0.439) USER MOD Set 1.2: A 99 LYS NZ :NH3+ -151:sc= -0.502 (180deg=-1.06) USER MOD Set 2.1: A 75 THR OG1 : rot 180:sc= 0.0127 USER MOD Set 2.2: A 78 MET CE :methyl -148:sc= -2.3! (180deg=-4.43!) USER MOD Single : A 1 MET CE :methyl 136:sc= -0.156 (180deg=-0.993) USER MOD Single : A 1 MET N :NH3+ -156:sc= -0.0328 (180deg=-0.856) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot -100:sc= -0.239 USER MOD Single : A 8 THR OG1 : rot 81:sc= -2.78! USER MOD Single : A 10 ASN : amide:sc= -7.11! C(o=-7.1!,f=-17!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= -0.594 K(o=-0.59,f=-4.9!) USER MOD Single : A 33 LYS NZ :NH3+ -108:sc= -0.333 (180deg=-3.86!) USER MOD Single : A 35 HIS : no HD1:sc= -0.0515 X(o=-0.052,f=-0.0053) USER MOD Single : A 41 SER OG : rot -64:sc= 0.874 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -174:sc= -1.42 (180deg=-1.46) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 165:sc= -0.106 (180deg=-0.158) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 85:sc= 0.0774 USER MOD Single : A 70 LYS NZ :NH3+ -170:sc= -1.05 (180deg=-1.27) USER MOD Single : A 73 THR OG1 : rot -83:sc= -1.66! USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.034) USER MOD Single : A 91 GLN : amide:sc= -0.677 K(o=-0.68,f=0) USER MOD Single : A 95 GLN : amide:sc= -0.067 K(o=-0.067,f=-0.95) 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 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 146:sc= 0 (180deg=-0.0118) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ -156:sc= -0.0854 (180deg=-0.87) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.157 8.311 14.122 1.00 0.00 N ATOM 2 CA MET A 1 -12.043 6.825 14.059 1.00 0.00 C ATOM 3 C MET A 1 -13.197 6.237 13.240 1.00 0.00 C ATOM 4 O MET A 1 -14.087 5.599 13.769 1.00 0.00 O ATOM 5 CB MET A 1 -12.126 6.364 15.513 1.00 0.00 C ATOM 6 CG MET A 1 -10.927 6.911 16.292 1.00 0.00 C ATOM 7 SD MET A 1 -10.931 6.224 17.966 1.00 0.00 S ATOM 8 CE MET A 1 -10.442 4.539 17.520 1.00 0.00 C ATOM 0 H1 MET A 1 -11.219 8.724 14.302 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.526 8.670 13.218 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.805 8.577 14.890 1.00 0.00 H new ATOM 0 HA MET A 1 -11.120 6.500 13.579 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.055 6.712 15.963 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.138 5.275 15.560 1.00 0.00 H new ATOM 0 HG2 MET A 1 -9.999 6.650 15.783 1.00 0.00 H new ATOM 0 HG3 MET A 1 -10.973 7.999 16.334 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.684 4.183 18.218 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.312 3.884 17.565 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.035 4.534 16.509 1.00 0.00 H new ATOM 20 N LYS A 2 -13.187 6.443 11.952 1.00 0.00 N ATOM 21 CA LYS A 2 -14.273 5.899 11.091 1.00 0.00 C ATOM 22 C LYS A 2 -13.639 5.044 9.998 1.00 0.00 C ATOM 23 O LYS A 2 -12.568 4.526 10.182 1.00 0.00 O ATOM 24 CB LYS A 2 -14.967 7.130 10.507 1.00 0.00 C ATOM 25 CG LYS A 2 -15.668 7.903 11.624 1.00 0.00 C ATOM 26 CD LYS A 2 -16.447 9.074 11.019 1.00 0.00 C ATOM 27 CE LYS A 2 -17.057 9.920 12.140 1.00 0.00 C ATOM 28 NZ LYS A 2 -17.776 11.022 11.441 1.00 0.00 N ATOM 0 H LYS A 2 -12.467 6.969 11.456 1.00 0.00 H new ATOM 0 HA LYS A 2 -14.985 5.271 11.627 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -14.237 7.770 10.011 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -15.691 6.827 9.751 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -16.344 7.244 12.168 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -14.935 8.271 12.342 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -15.785 9.686 10.407 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -17.233 8.700 10.363 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -17.738 9.331 12.754 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -16.286 10.310 12.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -18.222 11.646 12.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -17.101 11.570 10.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -18.508 10.620 10.821 1.00 0.00 H new ATOM 42 N GLU A 3 -14.270 4.880 8.871 1.00 0.00 N ATOM 43 CA GLU A 3 -13.648 4.038 7.804 1.00 0.00 C ATOM 44 C GLU A 3 -13.160 4.897 6.633 1.00 0.00 C ATOM 45 O GLU A 3 -13.772 5.877 6.273 1.00 0.00 O ATOM 46 CB GLU A 3 -14.763 3.100 7.347 1.00 0.00 C ATOM 47 CG GLU A 3 -15.193 2.216 8.518 1.00 0.00 C ATOM 48 CD GLU A 3 -16.262 1.222 8.052 1.00 0.00 C ATOM 49 OE1 GLU A 3 -16.732 1.361 6.934 1.00 0.00 O ATOM 50 OE2 GLU A 3 -16.593 0.338 8.824 1.00 0.00 O ATOM 0 H GLU A 3 -15.177 5.285 8.640 1.00 0.00 H new ATOM 0 HA GLU A 3 -12.775 3.500 8.173 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -15.612 3.677 6.982 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -14.417 2.482 6.518 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -14.332 1.679 8.915 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -15.585 2.833 9.327 1.00 0.00 H new ATOM 57 N SER A 4 -12.078 4.510 6.012 1.00 0.00 N ATOM 58 CA SER A 4 -11.574 5.281 4.839 1.00 0.00 C ATOM 59 C SER A 4 -11.144 4.291 3.762 1.00 0.00 C ATOM 60 O SER A 4 -10.512 3.293 4.049 1.00 0.00 O ATOM 61 CB SER A 4 -10.380 6.084 5.349 1.00 0.00 C ATOM 62 OG SER A 4 -10.151 7.187 4.480 1.00 0.00 O ATOM 0 H SER A 4 -11.522 3.694 6.266 1.00 0.00 H new ATOM 0 HA SER A 4 -12.326 5.944 4.410 1.00 0.00 H new ATOM 0 HB2 SER A 4 -10.571 6.438 6.362 1.00 0.00 H new ATOM 0 HB3 SER A 4 -9.494 5.451 5.394 1.00 0.00 H new ATOM 0 HG SER A 4 -9.414 6.975 3.870 1.00 0.00 H new ATOM 68 N VAL A 5 -11.515 4.519 2.534 1.00 0.00 N ATOM 69 CA VAL A 5 -11.156 3.537 1.477 1.00 0.00 C ATOM 70 C VAL A 5 -9.806 3.856 0.834 1.00 0.00 C ATOM 71 O VAL A 5 -9.518 4.969 0.439 1.00 0.00 O ATOM 72 CB VAL A 5 -12.290 3.630 0.448 1.00 0.00 C ATOM 73 CG1 VAL A 5 -12.234 4.980 -0.273 1.00 0.00 C ATOM 74 CG2 VAL A 5 -12.143 2.503 -0.577 1.00 0.00 C ATOM 0 H VAL A 5 -12.045 5.332 2.220 1.00 0.00 H new ATOM 0 HA VAL A 5 -11.050 2.533 1.888 1.00 0.00 H new ATOM 0 HB VAL A 5 -13.246 3.537 0.963 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -13.043 5.037 -1.002 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -12.343 5.785 0.454 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -11.277 5.080 -0.785 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -12.949 2.569 -1.308 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -11.183 2.596 -1.085 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -12.192 1.540 -0.069 1.00 0.00 H new ATOM 84 N VAL A 6 -8.998 2.845 0.714 1.00 0.00 N ATOM 85 CA VAL A 6 -7.665 2.976 0.084 1.00 0.00 C ATOM 86 C VAL A 6 -7.525 1.855 -0.940 1.00 0.00 C ATOM 87 O VAL A 6 -8.131 0.810 -0.806 1.00 0.00 O ATOM 88 CB VAL A 6 -6.656 2.841 1.221 1.00 0.00 C ATOM 89 CG1 VAL A 6 -5.241 3.051 0.673 1.00 0.00 C ATOM 90 CG2 VAL A 6 -6.956 3.906 2.277 1.00 0.00 C ATOM 0 H VAL A 6 -9.217 1.903 1.038 1.00 0.00 H new ATOM 0 HA VAL A 6 -7.512 3.923 -0.434 1.00 0.00 H new ATOM 0 HB VAL A 6 -6.728 1.848 1.665 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -4.519 2.955 1.484 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -5.031 2.302 -0.090 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -5.164 4.046 0.235 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -6.241 3.819 3.095 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -6.876 4.896 1.828 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -7.966 3.763 2.661 1.00 0.00 H new ATOM 100 N TRP A 7 -6.777 2.055 -1.972 1.00 0.00 N ATOM 101 CA TRP A 7 -6.661 0.981 -2.996 1.00 0.00 C ATOM 102 C TRP A 7 -5.223 0.467 -3.166 1.00 0.00 C ATOM 103 O TRP A 7 -4.249 1.102 -2.821 1.00 0.00 O ATOM 104 CB TRP A 7 -7.168 1.613 -4.292 1.00 0.00 C ATOM 105 CG TRP A 7 -8.502 1.034 -4.644 1.00 0.00 C ATOM 106 CD1 TRP A 7 -9.519 0.841 -3.774 1.00 0.00 C ATOM 107 CD2 TRP A 7 -8.981 0.577 -5.942 1.00 0.00 C ATOM 108 NE1 TRP A 7 -10.593 0.294 -4.455 1.00 0.00 N ATOM 109 CE2 TRP A 7 -10.310 0.113 -5.794 1.00 0.00 C ATOM 110 CE3 TRP A 7 -8.397 0.520 -7.219 1.00 0.00 C ATOM 111 CZ2 TRP A 7 -11.034 -0.390 -6.877 1.00 0.00 C ATOM 112 CZ3 TRP A 7 -9.123 0.015 -8.311 1.00 0.00 C ATOM 113 CH2 TRP A 7 -10.439 -0.438 -8.140 1.00 0.00 C ATOM 0 H TRP A 7 -6.242 2.903 -2.158 1.00 0.00 H new ATOM 0 HA TRP A 7 -7.237 0.104 -2.700 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -7.249 2.694 -4.174 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -6.458 1.433 -5.099 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -9.497 1.075 -2.720 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -11.484 0.054 -4.021 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -7.384 0.866 -7.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -12.047 -0.739 -6.739 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -8.665 -0.024 -9.288 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -10.992 -0.824 -8.984 1.00 0.00 H new ATOM 124 N THR A 8 -5.136 -0.680 -3.765 1.00 0.00 N ATOM 125 CA THR A 8 -3.801 -1.280 -4.065 1.00 0.00 C ATOM 126 C THR A 8 -3.148 -0.487 -5.204 1.00 0.00 C ATOM 127 O THR A 8 -1.964 -0.217 -5.201 1.00 0.00 O ATOM 128 CB THR A 8 -4.057 -2.725 -4.474 1.00 0.00 C ATOM 129 OG1 THR A 8 -5.077 -3.258 -3.653 1.00 0.00 O ATOM 130 CG2 THR A 8 -2.783 -3.540 -4.274 1.00 0.00 C ATOM 0 H THR A 8 -5.936 -1.238 -4.065 1.00 0.00 H new ATOM 0 HA THR A 8 -3.128 -1.248 -3.208 1.00 0.00 H new ATOM 0 HB THR A 8 -4.358 -2.765 -5.521 1.00 0.00 H new ATOM 0 HG1 THR A 8 -5.951 -2.968 -3.988 1.00 0.00 H new ATOM 0 HG21 THR A 8 -2.963 -4.575 -4.566 1.00 0.00 H new ATOM 0 HG22 THR A 8 -1.985 -3.124 -4.888 1.00 0.00 H new ATOM 0 HG23 THR A 8 -2.490 -3.505 -3.225 1.00 0.00 H new ATOM 138 N VAL A 9 -3.935 -0.133 -6.186 1.00 0.00 N ATOM 139 CA VAL A 9 -3.417 0.629 -7.363 1.00 0.00 C ATOM 140 C VAL A 9 -3.304 2.137 -7.084 1.00 0.00 C ATOM 141 O VAL A 9 -2.499 2.821 -7.683 1.00 0.00 O ATOM 142 CB VAL A 9 -4.453 0.368 -8.459 1.00 0.00 C ATOM 143 CG1 VAL A 9 -4.133 1.210 -9.696 1.00 0.00 C ATOM 144 CG2 VAL A 9 -4.432 -1.115 -8.831 1.00 0.00 C ATOM 0 H VAL A 9 -4.932 -0.343 -6.223 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.410 0.310 -7.631 1.00 0.00 H new ATOM 0 HB VAL A 9 -5.442 0.642 -8.090 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -4.876 1.017 -10.470 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -4.151 2.267 -9.431 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.143 0.947 -10.069 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.169 -1.305 -9.612 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -3.440 -1.385 -9.195 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.672 -1.714 -7.952 1.00 0.00 H new ATOM 154 N ASN A 10 -4.117 2.672 -6.213 1.00 0.00 N ATOM 155 CA ASN A 10 -4.054 4.142 -5.955 1.00 0.00 C ATOM 156 C ASN A 10 -2.652 4.565 -5.507 1.00 0.00 C ATOM 157 O ASN A 10 -2.183 5.632 -5.845 1.00 0.00 O ATOM 158 CB ASN A 10 -5.115 4.408 -4.868 1.00 0.00 C ATOM 159 CG ASN A 10 -4.518 4.323 -3.450 1.00 0.00 C ATOM 160 OD1 ASN A 10 -4.830 3.425 -2.701 1.00 0.00 O ATOM 161 ND2 ASN A 10 -3.676 5.236 -3.049 1.00 0.00 N ATOM 0 H ASN A 10 -4.816 2.162 -5.673 1.00 0.00 H new ATOM 0 HA ASN A 10 -4.256 4.725 -6.853 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -5.551 5.395 -5.020 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -5.924 3.684 -4.965 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -3.284 5.191 -2.108 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -3.410 5.995 -3.676 1.00 0.00 H new ATOM 168 N LEU A 11 -1.984 3.749 -4.745 1.00 0.00 N ATOM 169 CA LEU A 11 -0.622 4.121 -4.276 1.00 0.00 C ATOM 170 C LEU A 11 0.395 3.967 -5.408 1.00 0.00 C ATOM 171 O LEU A 11 1.540 4.352 -5.277 1.00 0.00 O ATOM 172 CB LEU A 11 -0.322 3.135 -3.148 1.00 0.00 C ATOM 173 CG LEU A 11 0.268 3.884 -1.954 1.00 0.00 C ATOM 174 CD1 LEU A 11 -0.804 4.048 -0.876 1.00 0.00 C ATOM 175 CD2 LEU A 11 1.443 3.090 -1.381 1.00 0.00 C ATOM 0 H LEU A 11 -2.321 2.841 -4.426 1.00 0.00 H new ATOM 0 HA LEU A 11 -0.566 5.158 -3.946 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -1.235 2.618 -2.851 1.00 0.00 H new ATOM 0 HB3 LEU A 11 0.377 2.373 -3.494 1.00 0.00 H new ATOM 0 HG LEU A 11 0.615 4.865 -2.278 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -0.384 4.582 -0.024 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -1.644 4.613 -1.281 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -1.150 3.066 -0.554 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.863 3.625 -0.529 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.096 2.109 -1.057 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.209 2.969 -2.147 1.00 0.00 H new ATOM 187 N ASP A 12 -0.003 3.401 -6.516 1.00 0.00 N ATOM 188 CA ASP A 12 0.957 3.218 -7.636 1.00 0.00 C ATOM 189 C ASP A 12 0.870 4.374 -8.634 1.00 0.00 C ATOM 190 O ASP A 12 -0.196 4.739 -9.091 1.00 0.00 O ATOM 191 CB ASP A 12 0.540 1.907 -8.305 1.00 0.00 C ATOM 192 CG ASP A 12 0.725 0.743 -7.328 1.00 0.00 C ATOM 193 OD1 ASP A 12 1.364 0.941 -6.309 1.00 0.00 O ATOM 194 OD2 ASP A 12 0.220 -0.329 -7.617 1.00 0.00 O ATOM 0 H ASP A 12 -0.948 3.060 -6.691 1.00 0.00 H new ATOM 0 HA ASP A 12 1.987 3.195 -7.281 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -0.501 1.965 -8.622 1.00 0.00 H new ATOM 0 HB3 ASP A 12 1.137 1.740 -9.201 1.00 0.00 H new ATOM 199 N SER A 13 1.992 4.935 -8.988 1.00 0.00 N ATOM 200 CA SER A 13 1.993 6.051 -9.974 1.00 0.00 C ATOM 201 C SER A 13 2.009 5.489 -11.402 1.00 0.00 C ATOM 202 O SER A 13 1.764 6.196 -12.358 1.00 0.00 O ATOM 203 CB SER A 13 3.274 6.831 -9.688 1.00 0.00 C ATOM 204 OG SER A 13 3.661 7.541 -10.856 1.00 0.00 O ATOM 0 H SER A 13 2.911 4.668 -8.636 1.00 0.00 H new ATOM 0 HA SER A 13 1.108 6.682 -9.889 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.115 7.525 -8.863 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.068 6.150 -9.383 1.00 0.00 H new ATOM 0 HG SER A 13 4.482 8.044 -10.676 1.00 0.00 H new ATOM 210 N LYS A 14 2.282 4.215 -11.555 1.00 0.00 N ATOM 211 CA LYS A 14 2.294 3.614 -12.921 1.00 0.00 C ATOM 212 C LYS A 14 0.904 3.739 -13.547 1.00 0.00 C ATOM 213 O LYS A 14 0.755 3.863 -14.746 1.00 0.00 O ATOM 214 CB LYS A 14 2.662 2.143 -12.710 1.00 0.00 C ATOM 215 CG LYS A 14 2.842 1.463 -14.069 1.00 0.00 C ATOM 216 CD LYS A 14 3.177 -0.017 -13.861 1.00 0.00 C ATOM 217 CE LYS A 14 3.496 -0.664 -15.212 1.00 0.00 C ATOM 218 NZ LYS A 14 2.640 -1.882 -15.265 1.00 0.00 N ATOM 0 H LYS A 14 2.496 3.570 -10.795 1.00 0.00 H new ATOM 0 HA LYS A 14 2.997 4.109 -13.590 1.00 0.00 H new ATOM 0 HB2 LYS A 14 3.581 2.067 -12.128 1.00 0.00 H new ATOM 0 HB3 LYS A 14 1.881 1.640 -12.140 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.931 1.561 -14.660 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.639 1.952 -14.629 1.00 0.00 H new ATOM 0 HD2 LYS A 14 4.029 -0.117 -13.188 1.00 0.00 H new ATOM 0 HD3 LYS A 14 2.337 -0.528 -13.390 1.00 0.00 H new ATOM 0 HE2 LYS A 14 3.272 0.013 -16.037 1.00 0.00 H new ATOM 0 HE3 LYS A 14 4.553 -0.920 -15.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.802 -2.381 -16.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.880 -2.510 -14.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 1.639 -1.606 -15.197 1.00 0.00 H new ATOM 232 N LYS A 15 -0.113 3.700 -12.732 1.00 0.00 N ATOM 233 CA LYS A 15 -1.503 3.808 -13.253 1.00 0.00 C ATOM 234 C LYS A 15 -1.923 5.278 -13.349 1.00 0.00 C ATOM 235 O LYS A 15 -1.450 6.121 -12.613 1.00 0.00 O ATOM 236 CB LYS A 15 -2.357 3.056 -12.236 1.00 0.00 C ATOM 237 CG LYS A 15 -1.879 1.605 -12.158 1.00 0.00 C ATOM 238 CD LYS A 15 -2.101 0.930 -13.512 1.00 0.00 C ATOM 239 CE LYS A 15 -1.917 -0.581 -13.367 1.00 0.00 C ATOM 240 NZ LYS A 15 -3.279 -1.102 -13.062 1.00 0.00 N ATOM 0 H LYS A 15 -0.039 3.597 -11.720 1.00 0.00 H new ATOM 0 HA LYS A 15 -1.608 3.393 -14.256 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -2.281 3.530 -11.257 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.407 3.091 -12.527 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -0.823 1.571 -11.890 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -2.423 1.072 -11.379 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -3.103 1.151 -13.880 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -1.398 1.324 -14.246 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -1.521 -1.021 -14.282 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -1.214 -0.819 -12.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -3.238 -2.135 -12.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -3.627 -0.670 -12.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -3.924 -0.865 -13.843 1.00 0.00 H new ATOM 254 N SER A 16 -2.802 5.589 -14.261 1.00 0.00 N ATOM 255 CA SER A 16 -3.253 7.003 -14.429 1.00 0.00 C ATOM 256 C SER A 16 -4.359 7.356 -13.427 1.00 0.00 C ATOM 257 O SER A 16 -4.843 6.520 -12.691 1.00 0.00 O ATOM 258 CB SER A 16 -3.790 7.077 -15.857 1.00 0.00 C ATOM 259 OG SER A 16 -2.728 6.842 -16.771 1.00 0.00 O ATOM 0 H SER A 16 -3.231 4.922 -14.902 1.00 0.00 H new ATOM 0 HA SER A 16 -2.440 7.707 -14.251 1.00 0.00 H new ATOM 0 HB2 SER A 16 -4.578 6.338 -16.000 1.00 0.00 H new ATOM 0 HB3 SER A 16 -4.233 8.056 -16.041 1.00 0.00 H new ATOM 0 HG SER A 16 -3.070 6.887 -17.688 1.00 0.00 H new ATOM 265 N ARG A 17 -4.749 8.602 -13.398 1.00 0.00 N ATOM 266 CA ARG A 17 -5.815 9.046 -12.452 1.00 0.00 C ATOM 267 C ARG A 17 -7.087 8.216 -12.635 1.00 0.00 C ATOM 268 O ARG A 17 -7.738 7.847 -11.677 1.00 0.00 O ATOM 269 CB ARG A 17 -6.080 10.504 -12.823 1.00 0.00 C ATOM 270 CG ARG A 17 -7.113 11.097 -11.862 1.00 0.00 C ATOM 271 CD ARG A 17 -6.455 11.370 -10.508 1.00 0.00 C ATOM 272 NE ARG A 17 -7.559 11.860 -9.638 1.00 0.00 N ATOM 273 CZ ARG A 17 -7.658 13.133 -9.366 1.00 0.00 C ATOM 274 NH1 ARG A 17 -7.672 14.007 -10.335 1.00 0.00 N ATOM 275 NH2 ARG A 17 -7.743 13.531 -8.127 1.00 0.00 N ATOM 0 H ARG A 17 -4.372 9.338 -13.994 1.00 0.00 H new ATOM 0 HA ARG A 17 -5.511 8.927 -11.412 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -5.154 11.076 -12.776 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -6.443 10.569 -13.849 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -7.519 12.021 -12.273 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -7.949 10.408 -11.740 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -6.001 10.467 -10.100 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -5.662 12.113 -10.597 1.00 0.00 H new ATOM 0 HE ARG A 17 -8.237 11.202 -9.255 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -7.606 13.695 -11.304 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -7.749 15.002 -10.123 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -7.732 12.848 -7.370 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -7.820 14.526 -7.915 1.00 0.00 H new ATOM 289 N ALA A 18 -7.452 7.919 -13.852 1.00 0.00 N ATOM 290 CA ALA A 18 -8.687 7.116 -14.076 1.00 0.00 C ATOM 291 C ALA A 18 -8.575 5.789 -13.325 1.00 0.00 C ATOM 292 O ALA A 18 -9.531 5.297 -12.758 1.00 0.00 O ATOM 293 CB ALA A 18 -8.736 6.879 -15.585 1.00 0.00 C ATOM 0 H ALA A 18 -6.952 8.196 -14.697 1.00 0.00 H new ATOM 0 HA ALA A 18 -9.587 7.617 -13.718 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -9.620 6.292 -15.833 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -8.780 7.837 -16.103 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -7.843 6.338 -15.898 1.00 0.00 H new ATOM 299 N GLU A 19 -7.407 5.213 -13.314 1.00 0.00 N ATOM 300 CA GLU A 19 -7.221 3.919 -12.595 1.00 0.00 C ATOM 301 C GLU A 19 -7.533 4.106 -11.106 1.00 0.00 C ATOM 302 O GLU A 19 -7.975 3.195 -10.434 1.00 0.00 O ATOM 303 CB GLU A 19 -5.750 3.555 -12.798 1.00 0.00 C ATOM 304 CG GLU A 19 -5.484 3.301 -14.284 1.00 0.00 C ATOM 305 CD GLU A 19 -6.327 2.117 -14.764 1.00 0.00 C ATOM 306 OE1 GLU A 19 -6.805 1.374 -13.924 1.00 0.00 O ATOM 307 OE2 GLU A 19 -6.479 1.972 -15.966 1.00 0.00 O ATOM 0 H GLU A 19 -6.572 5.580 -13.771 1.00 0.00 H new ATOM 0 HA GLU A 19 -7.882 3.136 -12.967 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -5.112 4.362 -12.437 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -5.501 2.667 -12.217 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -5.727 4.191 -14.864 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -4.426 3.095 -14.444 1.00 0.00 H new ATOM 314 N GLY A 20 -7.307 5.283 -10.590 1.00 0.00 N ATOM 315 CA GLY A 20 -7.587 5.543 -9.147 1.00 0.00 C ATOM 316 C GLY A 20 -6.647 6.640 -8.650 1.00 0.00 C ATOM 317 O GLY A 20 -7.054 7.754 -8.386 1.00 0.00 O ATOM 0 H GLY A 20 -6.938 6.081 -11.108 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -8.625 5.847 -9.013 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -7.444 4.632 -8.565 1.00 0.00 H new ATOM 321 N ARG A 21 -5.386 6.330 -8.538 1.00 0.00 N ATOM 322 CA ARG A 21 -4.386 7.338 -8.076 1.00 0.00 C ATOM 323 C ARG A 21 -4.890 8.118 -6.853 1.00 0.00 C ATOM 324 O ARG A 21 -5.614 9.087 -6.968 1.00 0.00 O ATOM 325 CB ARG A 21 -4.193 8.271 -9.273 1.00 0.00 C ATOM 326 CG ARG A 21 -3.002 9.196 -9.016 1.00 0.00 C ATOM 327 CD ARG A 21 -2.807 10.122 -10.217 1.00 0.00 C ATOM 328 NE ARG A 21 -1.547 10.862 -9.930 1.00 0.00 N ATOM 329 CZ ARG A 21 -1.343 12.031 -10.467 1.00 0.00 C ATOM 330 NH1 ARG A 21 -1.187 12.138 -11.758 1.00 0.00 N ATOM 331 NH2 ARG A 21 -1.296 13.097 -9.714 1.00 0.00 N ATOM 0 H ARG A 21 -4.999 5.410 -8.749 1.00 0.00 H new ATOM 0 HA ARG A 21 -3.456 6.866 -7.761 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -4.025 7.688 -10.178 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.095 8.860 -9.437 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -3.172 9.784 -8.114 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -2.100 8.607 -8.847 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -2.729 9.555 -11.145 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -3.649 10.805 -10.330 1.00 0.00 H new ATOM 0 HE ARG A 21 -0.844 10.454 -9.313 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -1.225 11.306 -12.347 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -1.027 13.054 -12.178 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -1.419 13.014 -8.705 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -1.136 14.012 -10.135 1.00 0.00 H new ATOM 345 N ARG A 22 -4.476 7.707 -5.686 1.00 0.00 N ATOM 346 CA ARG A 22 -4.876 8.408 -4.431 1.00 0.00 C ATOM 347 C ARG A 22 -3.625 8.529 -3.559 1.00 0.00 C ATOM 348 O ARG A 22 -3.637 8.281 -2.368 1.00 0.00 O ATOM 349 CB ARG A 22 -5.924 7.500 -3.788 1.00 0.00 C ATOM 350 CG ARG A 22 -7.057 7.256 -4.787 1.00 0.00 C ATOM 351 CD ARG A 22 -8.066 6.271 -4.194 1.00 0.00 C ATOM 352 NE ARG A 22 -8.995 5.959 -5.316 1.00 0.00 N ATOM 353 CZ ARG A 22 -10.282 5.912 -5.105 1.00 0.00 C ATOM 354 NH1 ARG A 22 -10.888 6.925 -4.549 1.00 0.00 N ATOM 355 NH2 ARG A 22 -10.961 4.851 -5.447 1.00 0.00 N ATOM 0 H ARG A 22 -3.867 6.901 -5.546 1.00 0.00 H new ATOM 0 HA ARG A 22 -5.282 9.408 -4.583 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -5.471 6.553 -3.494 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -6.315 7.961 -2.881 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -7.552 8.197 -5.027 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -6.654 6.861 -5.719 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -7.572 5.371 -3.827 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -8.598 6.709 -3.350 1.00 0.00 H new ATOM 0 HE ARG A 22 -8.625 5.782 -6.250 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -10.356 7.752 -4.280 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.894 6.889 -4.384 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.486 4.059 -5.879 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -11.967 4.814 -5.282 1.00 0.00 H new ATOM 369 N ILE A 23 -2.537 8.884 -4.185 1.00 0.00 N ATOM 370 CA ILE A 23 -1.242 9.005 -3.454 1.00 0.00 C ATOM 371 C ILE A 23 -0.386 10.149 -4.031 1.00 0.00 C ATOM 372 O ILE A 23 -0.384 10.373 -5.225 1.00 0.00 O ATOM 373 CB ILE A 23 -0.581 7.633 -3.660 1.00 0.00 C ATOM 374 CG1 ILE A 23 0.589 7.466 -2.690 1.00 0.00 C ATOM 375 CG2 ILE A 23 -0.074 7.488 -5.101 1.00 0.00 C ATOM 376 CD1 ILE A 23 0.056 7.288 -1.266 1.00 0.00 C ATOM 0 H ILE A 23 -2.489 9.098 -5.181 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.366 9.250 -2.399 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.327 6.861 -3.469 1.00 0.00 H new ATOM 0 HG12 ILE A 23 1.190 6.602 -2.975 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.242 8.338 -2.738 1.00 0.00 H new ATOM 0 HG21 ILE A 23 0.391 6.510 -5.227 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.911 7.584 -5.793 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.659 8.267 -5.309 1.00 0.00 H new ATOM 0 HD11 ILE A 23 0.892 7.169 -0.577 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -0.526 8.165 -0.983 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.578 6.403 -1.223 1.00 0.00 H new ATOM 388 N PRO A 24 0.317 10.838 -3.159 1.00 0.00 N ATOM 389 CA PRO A 24 1.183 11.965 -3.595 1.00 0.00 C ATOM 390 C PRO A 24 2.398 11.454 -4.370 1.00 0.00 C ATOM 391 O PRO A 24 2.994 10.453 -4.027 1.00 0.00 O ATOM 392 CB PRO A 24 1.629 12.604 -2.285 1.00 0.00 C ATOM 393 CG PRO A 24 1.536 11.503 -1.284 1.00 0.00 C ATOM 394 CD PRO A 24 0.378 10.643 -1.705 1.00 0.00 C ATOM 0 HA PRO A 24 0.664 12.657 -4.259 1.00 0.00 H new ATOM 0 HB2 PRO A 24 2.646 12.990 -2.357 1.00 0.00 H new ATOM 0 HB3 PRO A 24 0.988 13.443 -2.014 1.00 0.00 H new ATOM 0 HG2 PRO A 24 2.459 10.924 -1.256 1.00 0.00 H new ATOM 0 HG3 PRO A 24 1.379 11.902 -0.282 1.00 0.00 H new ATOM 0 HD2 PRO A 24 0.541 9.597 -1.447 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -0.548 10.951 -1.220 1.00 0.00 H new ATOM 402 N ARG A 25 2.777 12.153 -5.399 1.00 0.00 N ATOM 403 CA ARG A 25 3.963 11.739 -6.201 1.00 0.00 C ATOM 404 C ARG A 25 5.224 11.720 -5.327 1.00 0.00 C ATOM 405 O ARG A 25 6.115 10.917 -5.517 1.00 0.00 O ATOM 406 CB ARG A 25 4.079 12.815 -7.278 1.00 0.00 C ATOM 407 CG ARG A 25 5.210 12.461 -8.245 1.00 0.00 C ATOM 408 CD ARG A 25 5.346 13.568 -9.291 1.00 0.00 C ATOM 409 NE ARG A 25 6.373 13.071 -10.247 1.00 0.00 N ATOM 410 CZ ARG A 25 6.879 13.877 -11.139 1.00 0.00 C ATOM 411 NH1 ARG A 25 6.105 14.708 -11.783 1.00 0.00 N ATOM 412 NH2 ARG A 25 8.159 13.852 -11.389 1.00 0.00 N ATOM 0 H ARG A 25 2.313 13.002 -5.724 1.00 0.00 H new ATOM 0 HA ARG A 25 3.858 10.737 -6.617 1.00 0.00 H new ATOM 0 HB2 ARG A 25 3.138 12.902 -7.821 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.272 13.784 -6.818 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.146 12.343 -7.700 1.00 0.00 H new ATOM 0 HG3 ARG A 25 5.003 11.508 -8.732 1.00 0.00 H new ATOM 0 HD2 ARG A 25 4.397 13.755 -9.793 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.655 14.508 -8.833 1.00 0.00 H new ATOM 0 HE ARG A 25 6.681 12.100 -10.205 1.00 0.00 H new ATOM 0 HH11 ARG A 25 5.104 14.727 -11.589 1.00 0.00 H new ATOM 0 HH12 ARG A 25 6.501 15.338 -12.480 1.00 0.00 H new ATOM 0 HH21 ARG A 25 8.764 13.202 -10.887 1.00 0.00 H new ATOM 0 HH22 ARG A 25 8.555 14.482 -12.087 1.00 0.00 H new ATOM 426 N ARG A 26 5.306 12.615 -4.382 1.00 0.00 N ATOM 427 CA ARG A 26 6.508 12.680 -3.498 1.00 0.00 C ATOM 428 C ARG A 26 6.696 11.376 -2.724 1.00 0.00 C ATOM 429 O ARG A 26 7.807 10.945 -2.481 1.00 0.00 O ATOM 430 CB ARG A 26 6.224 13.829 -2.530 1.00 0.00 C ATOM 431 CG ARG A 26 6.138 15.144 -3.307 1.00 0.00 C ATOM 432 CD ARG A 26 5.975 16.305 -2.324 1.00 0.00 C ATOM 433 NE ARG A 26 5.664 17.486 -3.174 1.00 0.00 N ATOM 434 CZ ARG A 26 6.599 18.354 -3.450 1.00 0.00 C ATOM 435 NH1 ARG A 26 7.808 17.945 -3.725 1.00 0.00 N ATOM 436 NH2 ARG A 26 6.327 19.630 -3.449 1.00 0.00 N ATOM 0 H ARG A 26 4.587 13.310 -4.181 1.00 0.00 H new ATOM 0 HA ARG A 26 7.421 12.833 -4.074 1.00 0.00 H new ATOM 0 HB2 ARG A 26 5.290 13.647 -1.998 1.00 0.00 H new ATOM 0 HB3 ARG A 26 7.012 13.889 -1.779 1.00 0.00 H new ATOM 0 HG2 ARG A 26 7.037 15.284 -3.907 1.00 0.00 H new ATOM 0 HG3 ARG A 26 5.295 15.117 -3.998 1.00 0.00 H new ATOM 0 HD2 ARG A 26 5.174 16.109 -1.611 1.00 0.00 H new ATOM 0 HD3 ARG A 26 6.885 16.463 -1.745 1.00 0.00 H new ATOM 0 HE ARG A 26 4.721 17.617 -3.541 1.00 0.00 H new ATOM 0 HH11 ARG A 26 8.022 16.948 -3.724 1.00 0.00 H new ATOM 0 HH12 ARG A 26 8.539 18.623 -3.941 1.00 0.00 H new ATOM 0 HH21 ARG A 26 5.383 19.950 -3.232 1.00 0.00 H new ATOM 0 HH22 ARG A 26 7.058 20.308 -3.665 1.00 0.00 H new ATOM 450 N PHE A 27 5.630 10.743 -2.327 1.00 0.00 N ATOM 451 CA PHE A 27 5.766 9.472 -1.566 1.00 0.00 C ATOM 452 C PHE A 27 4.798 8.420 -2.105 1.00 0.00 C ATOM 453 O PHE A 27 4.177 7.694 -1.356 1.00 0.00 O ATOM 454 CB PHE A 27 5.423 9.834 -0.120 1.00 0.00 C ATOM 455 CG PHE A 27 6.502 10.728 0.445 1.00 0.00 C ATOM 456 CD1 PHE A 27 7.685 10.169 0.945 1.00 0.00 C ATOM 457 CD2 PHE A 27 6.320 12.116 0.469 1.00 0.00 C ATOM 458 CE1 PHE A 27 8.686 10.997 1.468 1.00 0.00 C ATOM 459 CE2 PHE A 27 7.321 12.944 0.992 1.00 0.00 C ATOM 460 CZ PHE A 27 8.504 12.386 1.491 1.00 0.00 C ATOM 0 H PHE A 27 4.672 11.050 -2.496 1.00 0.00 H new ATOM 0 HA PHE A 27 6.766 9.048 -1.651 1.00 0.00 H new ATOM 0 HB2 PHE A 27 4.458 10.340 -0.080 1.00 0.00 H new ATOM 0 HB3 PHE A 27 5.334 8.929 0.481 1.00 0.00 H new ATOM 0 HD1 PHE A 27 7.825 9.098 0.927 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.408 12.548 0.084 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.598 10.565 1.853 1.00 0.00 H new ATOM 0 HE2 PHE A 27 7.180 14.015 1.010 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.276 13.026 1.893 1.00 0.00 H new ATOM 470 N ALA A 28 4.673 8.320 -3.400 1.00 0.00 N ATOM 471 CA ALA A 28 3.750 7.297 -3.970 1.00 0.00 C ATOM 472 C ALA A 28 4.532 6.036 -4.350 1.00 0.00 C ATOM 473 O ALA A 28 5.600 6.110 -4.924 1.00 0.00 O ATOM 474 CB ALA A 28 3.151 7.952 -5.214 1.00 0.00 C ATOM 0 H ALA A 28 5.165 8.896 -4.083 1.00 0.00 H new ATOM 0 HA ALA A 28 2.980 6.993 -3.261 1.00 0.00 H new ATOM 0 HB1 ALA A 28 2.458 7.259 -5.692 1.00 0.00 H new ATOM 0 HB2 ALA A 28 2.618 8.858 -4.927 1.00 0.00 H new ATOM 0 HB3 ALA A 28 3.949 8.206 -5.912 1.00 0.00 H new ATOM 480 N VAL A 29 4.022 4.877 -4.017 1.00 0.00 N ATOM 481 CA VAL A 29 4.756 3.619 -4.341 1.00 0.00 C ATOM 482 C VAL A 29 4.169 2.980 -5.604 1.00 0.00 C ATOM 483 O VAL A 29 3.057 2.498 -5.580 1.00 0.00 O ATOM 484 CB VAL A 29 4.502 2.700 -3.146 1.00 0.00 C ATOM 485 CG1 VAL A 29 5.297 1.403 -3.306 1.00 0.00 C ATOM 486 CG2 VAL A 29 4.913 3.397 -1.845 1.00 0.00 C ATOM 0 H VAL A 29 3.132 4.749 -3.536 1.00 0.00 H new ATOM 0 HA VAL A 29 5.817 3.797 -4.519 1.00 0.00 H new ATOM 0 HB VAL A 29 3.438 2.468 -3.105 1.00 0.00 H new ATOM 0 HG11 VAL A 29 5.110 0.754 -2.450 1.00 0.00 H new ATOM 0 HG12 VAL A 29 4.987 0.897 -4.220 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.361 1.633 -3.362 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.727 2.732 -1.002 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.974 3.645 -1.885 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.331 4.310 -1.722 1.00 0.00 H new ATOM 496 N PRO A 30 4.941 2.986 -6.661 1.00 0.00 N ATOM 497 CA PRO A 30 4.486 2.395 -7.947 1.00 0.00 C ATOM 498 C PRO A 30 4.337 0.878 -7.818 1.00 0.00 C ATOM 499 O PRO A 30 5.018 0.249 -7.035 1.00 0.00 O ATOM 500 CB PRO A 30 5.602 2.761 -8.925 1.00 0.00 C ATOM 501 CG PRO A 30 6.805 2.970 -8.065 1.00 0.00 C ATOM 502 CD PRO A 30 6.299 3.524 -6.760 1.00 0.00 C ATOM 0 HA PRO A 30 3.512 2.763 -8.268 1.00 0.00 H new ATOM 0 HB2 PRO A 30 5.768 1.966 -9.652 1.00 0.00 H new ATOM 0 HB3 PRO A 30 5.356 3.661 -9.488 1.00 0.00 H new ATOM 0 HG2 PRO A 30 7.339 2.033 -7.909 1.00 0.00 H new ATOM 0 HG3 PRO A 30 7.504 3.661 -8.536 1.00 0.00 H new ATOM 0 HD2 PRO A 30 6.919 3.205 -5.922 1.00 0.00 H new ATOM 0 HD3 PRO A 30 6.299 4.614 -6.760 1.00 0.00 H new ATOM 510 N ASN A 31 3.441 0.295 -8.576 1.00 0.00 N ATOM 511 CA ASN A 31 3.227 -1.181 -8.508 1.00 0.00 C ATOM 512 C ASN A 31 2.762 -1.590 -7.109 1.00 0.00 C ATOM 513 O ASN A 31 3.346 -1.227 -6.109 1.00 0.00 O ATOM 514 CB ASN A 31 4.576 -1.827 -8.851 1.00 0.00 C ATOM 515 CG ASN A 31 5.022 -1.369 -10.241 1.00 0.00 C ATOM 516 OD1 ASN A 31 4.204 -1.034 -11.075 1.00 0.00 O ATOM 517 ND2 ASN A 31 6.295 -1.338 -10.527 1.00 0.00 N ATOM 0 H ASN A 31 2.845 0.784 -9.244 1.00 0.00 H new ATOM 0 HA ASN A 31 2.453 -1.505 -9.204 1.00 0.00 H new ATOM 0 HB2 ASN A 31 5.324 -1.550 -8.108 1.00 0.00 H new ATOM 0 HB3 ASN A 31 4.488 -2.913 -8.825 1.00 0.00 H new ATOM 0 HD21 ASN A 31 6.603 -1.033 -11.450 1.00 0.00 H new ATOM 0 HD22 ASN A 31 6.982 -1.619 -9.827 1.00 0.00 H new ATOM 524 N VAL A 32 1.696 -2.330 -7.046 1.00 0.00 N ATOM 525 CA VAL A 32 1.142 -2.770 -5.729 1.00 0.00 C ATOM 526 C VAL A 32 2.178 -3.582 -4.935 1.00 0.00 C ATOM 527 O VAL A 32 2.957 -4.334 -5.488 1.00 0.00 O ATOM 528 CB VAL A 32 -0.076 -3.634 -6.084 1.00 0.00 C ATOM 529 CG1 VAL A 32 -1.027 -2.839 -6.978 1.00 0.00 C ATOM 530 CG2 VAL A 32 0.386 -4.892 -6.824 1.00 0.00 C ATOM 0 H VAL A 32 1.174 -2.656 -7.859 1.00 0.00 H new ATOM 0 HA VAL A 32 0.875 -1.924 -5.096 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.593 -3.920 -5.168 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.891 -3.455 -7.229 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -1.359 -1.945 -6.451 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -0.510 -2.550 -7.893 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -0.480 -5.505 -7.076 1.00 0.00 H new ATOM 0 HG22 VAL A 32 0.906 -4.606 -7.738 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.061 -5.462 -6.186 1.00 0.00 H new ATOM 540 N LYS A 33 2.166 -3.442 -3.633 1.00 0.00 N ATOM 541 CA LYS A 33 3.113 -4.207 -2.778 1.00 0.00 C ATOM 542 C LYS A 33 2.379 -4.643 -1.512 1.00 0.00 C ATOM 543 O LYS A 33 2.281 -3.898 -0.563 1.00 0.00 O ATOM 544 CB LYS A 33 4.244 -3.220 -2.442 1.00 0.00 C ATOM 545 CG LYS A 33 5.441 -3.978 -1.846 1.00 0.00 C ATOM 546 CD LYS A 33 6.545 -2.988 -1.433 1.00 0.00 C ATOM 547 CE LYS A 33 7.887 -3.719 -1.381 1.00 0.00 C ATOM 548 NZ LYS A 33 7.980 -4.264 0.001 1.00 0.00 N ATOM 0 H LYS A 33 1.533 -2.824 -3.125 1.00 0.00 H new ATOM 0 HA LYS A 33 3.505 -5.101 -3.263 1.00 0.00 H new ATOM 0 HB2 LYS A 33 4.552 -2.686 -3.341 1.00 0.00 H new ATOM 0 HB3 LYS A 33 3.887 -2.472 -1.734 1.00 0.00 H new ATOM 0 HG2 LYS A 33 5.119 -4.557 -0.980 1.00 0.00 H new ATOM 0 HG3 LYS A 33 5.832 -4.686 -2.576 1.00 0.00 H new ATOM 0 HD2 LYS A 33 6.594 -2.164 -2.144 1.00 0.00 H new ATOM 0 HD3 LYS A 33 6.316 -2.556 -0.459 1.00 0.00 H new ATOM 0 HE2 LYS A 33 7.930 -4.517 -2.123 1.00 0.00 H new ATOM 0 HE3 LYS A 33 8.714 -3.041 -1.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 8.689 -3.726 0.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 7.055 -4.183 0.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 8.262 -5.264 -0.039 1.00 0.00 H new ATOM 562 N LEU A 34 1.855 -5.841 -1.477 1.00 0.00 N ATOM 563 CA LEU A 34 1.130 -6.280 -0.246 1.00 0.00 C ATOM 564 C LEU A 34 2.053 -6.125 0.949 1.00 0.00 C ATOM 565 O LEU A 34 1.643 -5.763 2.034 1.00 0.00 O ATOM 566 CB LEU A 34 0.794 -7.754 -0.455 1.00 0.00 C ATOM 567 CG LEU A 34 0.091 -8.287 0.798 1.00 0.00 C ATOM 568 CD1 LEU A 34 -1.367 -7.825 0.801 1.00 0.00 C ATOM 569 CD2 LEU A 34 0.140 -9.816 0.799 1.00 0.00 C ATOM 0 H LEU A 34 1.896 -6.524 -2.233 1.00 0.00 H new ATOM 0 HA LEU A 34 0.230 -5.692 -0.067 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.151 -7.874 -1.327 1.00 0.00 H new ATOM 0 HB3 LEU A 34 1.703 -8.324 -0.648 1.00 0.00 H new ATOM 0 HG LEU A 34 0.595 -7.906 1.686 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.867 -8.204 1.692 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.403 -6.736 0.800 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.871 -8.206 -0.087 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.360 -10.195 1.690 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.364 -10.197 -0.090 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.179 -10.147 0.797 1.00 0.00 H new ATOM 581 N HIS A 35 3.307 -6.388 0.747 1.00 0.00 N ATOM 582 CA HIS A 35 4.276 -6.251 1.853 1.00 0.00 C ATOM 583 C HIS A 35 4.195 -4.852 2.465 1.00 0.00 C ATOM 584 O HIS A 35 4.320 -4.696 3.656 1.00 0.00 O ATOM 585 CB HIS A 35 5.646 -6.480 1.217 1.00 0.00 C ATOM 586 CG HIS A 35 5.889 -7.956 1.074 1.00 0.00 C ATOM 587 ND1 HIS A 35 6.256 -8.533 -0.131 1.00 0.00 N ATOM 588 CD2 HIS A 35 5.825 -8.986 1.979 1.00 0.00 C ATOM 589 CE1 HIS A 35 6.400 -9.855 0.079 1.00 0.00 C ATOM 590 NE2 HIS A 35 6.149 -10.185 1.349 1.00 0.00 N ATOM 0 H HIS A 35 3.702 -6.693 -0.142 1.00 0.00 H new ATOM 0 HA HIS A 35 4.078 -6.959 2.658 1.00 0.00 H new ATOM 0 HB2 HIS A 35 5.692 -5.996 0.241 1.00 0.00 H new ATOM 0 HB3 HIS A 35 6.425 -6.030 1.833 1.00 0.00 H new ATOM 0 HD2 HIS A 35 5.563 -8.882 3.022 1.00 0.00 H new ATOM 0 HE1 HIS A 35 6.684 -10.563 -0.686 1.00 0.00 H new ATOM 0 HE2 HIS A 35 6.187 -11.115 1.767 1.00 0.00 H new ATOM 598 N GLU A 36 3.981 -3.827 1.676 1.00 0.00 N ATOM 599 CA GLU A 36 3.898 -2.464 2.279 1.00 0.00 C ATOM 600 C GLU A 36 2.571 -2.263 3.024 1.00 0.00 C ATOM 601 O GLU A 36 2.537 -1.721 4.111 1.00 0.00 O ATOM 602 CB GLU A 36 4.097 -1.476 1.111 1.00 0.00 C ATOM 603 CG GLU A 36 2.761 -1.073 0.464 1.00 0.00 C ATOM 604 CD GLU A 36 3.026 -0.320 -0.844 1.00 0.00 C ATOM 605 OE1 GLU A 36 4.184 -0.073 -1.143 1.00 0.00 O ATOM 606 OE2 GLU A 36 2.066 -0.001 -1.525 1.00 0.00 O ATOM 0 H GLU A 36 3.863 -3.873 0.664 1.00 0.00 H new ATOM 0 HA GLU A 36 4.663 -2.305 3.039 1.00 0.00 H new ATOM 0 HB2 GLU A 36 4.608 -0.584 1.474 1.00 0.00 H new ATOM 0 HB3 GLU A 36 4.742 -1.929 0.358 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.159 -1.960 0.268 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.190 -0.444 1.147 1.00 0.00 H new ATOM 613 N LEU A 37 1.480 -2.680 2.448 1.00 0.00 N ATOM 614 CA LEU A 37 0.171 -2.490 3.132 1.00 0.00 C ATOM 615 C LEU A 37 0.029 -3.396 4.357 1.00 0.00 C ATOM 616 O LEU A 37 -0.279 -2.944 5.433 1.00 0.00 O ATOM 617 CB LEU A 37 -0.876 -2.852 2.082 1.00 0.00 C ATOM 618 CG LEU A 37 -1.098 -1.659 1.154 1.00 0.00 C ATOM 619 CD1 LEU A 37 -1.785 -2.132 -0.127 1.00 0.00 C ATOM 620 CD2 LEU A 37 -1.987 -0.631 1.860 1.00 0.00 C ATOM 0 H LEU A 37 1.437 -3.141 1.539 1.00 0.00 H new ATOM 0 HA LEU A 37 0.064 -1.470 3.502 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.546 -3.717 1.507 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.812 -3.129 2.567 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.139 -1.205 0.904 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.944 -1.282 -0.790 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.156 -2.869 -0.626 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.746 -2.583 0.121 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.149 0.223 1.202 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -2.946 -1.087 2.105 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -1.500 -0.296 2.776 1.00 0.00 H new ATOM 632 N VAL A 38 0.233 -4.670 4.206 1.00 0.00 N ATOM 633 CA VAL A 38 0.069 -5.583 5.374 1.00 0.00 C ATOM 634 C VAL A 38 1.152 -5.341 6.436 1.00 0.00 C ATOM 635 O VAL A 38 0.866 -5.235 7.612 1.00 0.00 O ATOM 636 CB VAL A 38 0.172 -6.987 4.780 1.00 0.00 C ATOM 637 CG1 VAL A 38 0.071 -8.025 5.899 1.00 0.00 C ATOM 638 CG2 VAL A 38 -0.975 -7.201 3.781 1.00 0.00 C ATOM 0 H VAL A 38 0.505 -5.121 3.332 1.00 0.00 H new ATOM 0 HA VAL A 38 -0.878 -5.423 5.890 1.00 0.00 H new ATOM 0 HB VAL A 38 1.129 -7.097 4.269 1.00 0.00 H new ATOM 0 HG11 VAL A 38 0.145 -9.026 5.474 1.00 0.00 H new ATOM 0 HG12 VAL A 38 0.882 -7.872 6.611 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -0.886 -7.917 6.410 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -0.905 -8.202 3.355 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -1.930 -7.092 4.295 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -0.905 -6.462 2.983 1.00 0.00 H new ATOM 648 N GLU A 39 2.390 -5.265 6.037 1.00 0.00 N ATOM 649 CA GLU A 39 3.491 -5.045 7.033 1.00 0.00 C ATOM 650 C GLU A 39 3.352 -3.702 7.771 1.00 0.00 C ATOM 651 O GLU A 39 3.755 -3.577 8.911 1.00 0.00 O ATOM 652 CB GLU A 39 4.789 -5.057 6.230 1.00 0.00 C ATOM 653 CG GLU A 39 5.978 -5.154 7.192 1.00 0.00 C ATOM 654 CD GLU A 39 7.291 -5.050 6.410 1.00 0.00 C ATOM 655 OE1 GLU A 39 7.234 -4.842 5.209 1.00 0.00 O ATOM 656 OE2 GLU A 39 8.336 -5.177 7.030 1.00 0.00 O ATOM 0 H GLU A 39 2.694 -5.345 5.066 1.00 0.00 H new ATOM 0 HA GLU A 39 3.462 -5.820 7.799 1.00 0.00 H new ATOM 0 HB2 GLU A 39 4.795 -5.900 5.539 1.00 0.00 H new ATOM 0 HB3 GLU A 39 4.866 -4.152 5.628 1.00 0.00 H new ATOM 0 HG2 GLU A 39 5.922 -4.358 7.934 1.00 0.00 H new ATOM 0 HG3 GLU A 39 5.942 -6.099 7.735 1.00 0.00 H new ATOM 663 N ALA A 40 2.812 -2.693 7.139 1.00 0.00 N ATOM 664 CA ALA A 40 2.687 -1.364 7.822 1.00 0.00 C ATOM 665 C ALA A 40 1.708 -1.420 9.002 1.00 0.00 C ATOM 666 O ALA A 40 1.985 -0.924 10.075 1.00 0.00 O ATOM 667 CB ALA A 40 2.159 -0.420 6.742 1.00 0.00 C ATOM 0 H ALA A 40 2.453 -2.727 6.185 1.00 0.00 H new ATOM 0 HA ALA A 40 3.641 -1.041 8.238 1.00 0.00 H new ATOM 0 HB1 ALA A 40 2.038 0.579 7.160 1.00 0.00 H new ATOM 0 HB2 ALA A 40 2.866 -0.384 5.913 1.00 0.00 H new ATOM 0 HB3 ALA A 40 1.196 -0.782 6.382 1.00 0.00 H new ATOM 673 N SER A 41 0.567 -2.012 8.808 1.00 0.00 N ATOM 674 CA SER A 41 -0.437 -2.093 9.915 1.00 0.00 C ATOM 675 C SER A 41 0.152 -2.819 11.128 1.00 0.00 C ATOM 676 O SER A 41 -0.164 -2.513 12.260 1.00 0.00 O ATOM 677 CB SER A 41 -1.608 -2.889 9.342 1.00 0.00 C ATOM 678 OG SER A 41 -1.194 -4.226 9.099 1.00 0.00 O ATOM 0 H SER A 41 0.280 -2.446 7.931 1.00 0.00 H new ATOM 0 HA SER A 41 -0.741 -1.103 10.255 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.446 -2.877 10.039 1.00 0.00 H new ATOM 0 HB3 SER A 41 -1.956 -2.430 8.417 1.00 0.00 H new ATOM 0 HG SER A 41 -0.493 -4.232 8.414 1.00 0.00 H new ATOM 684 N LYS A 42 0.997 -3.783 10.897 1.00 0.00 N ATOM 685 CA LYS A 42 1.602 -4.537 12.033 1.00 0.00 C ATOM 686 C LYS A 42 2.370 -3.581 12.946 1.00 0.00 C ATOM 687 O LYS A 42 2.419 -3.753 14.147 1.00 0.00 O ATOM 688 CB LYS A 42 2.550 -5.542 11.380 1.00 0.00 C ATOM 689 CG LYS A 42 3.085 -6.510 12.440 1.00 0.00 C ATOM 690 CD LYS A 42 1.983 -7.497 12.832 1.00 0.00 C ATOM 691 CE LYS A 42 2.554 -8.553 13.782 1.00 0.00 C ATOM 692 NZ LYS A 42 1.375 -9.094 14.515 1.00 0.00 N ATOM 0 H LYS A 42 1.297 -4.083 9.969 1.00 0.00 H new ATOM 0 HA LYS A 42 0.853 -5.031 12.651 1.00 0.00 H new ATOM 0 HB2 LYS A 42 2.028 -6.095 10.599 1.00 0.00 H new ATOM 0 HB3 LYS A 42 3.377 -5.018 10.901 1.00 0.00 H new ATOM 0 HG2 LYS A 42 3.950 -7.049 12.052 1.00 0.00 H new ATOM 0 HG3 LYS A 42 3.421 -5.957 13.317 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.161 -6.967 13.313 1.00 0.00 H new ATOM 0 HD3 LYS A 42 1.576 -7.976 11.941 1.00 0.00 H new ATOM 0 HE2 LYS A 42 3.071 -9.339 13.232 1.00 0.00 H new ATOM 0 HE3 LYS A 42 3.278 -8.115 14.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 1.688 -9.824 15.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.906 -8.325 15.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 0.706 -9.511 13.837 1.00 0.00 H new ATOM 706 N GLU A 43 2.976 -2.577 12.379 1.00 0.00 N ATOM 707 CA GLU A 43 3.750 -1.608 13.203 1.00 0.00 C ATOM 708 C GLU A 43 2.851 -0.968 14.271 1.00 0.00 C ATOM 709 O GLU A 43 3.244 -0.811 15.410 1.00 0.00 O ATOM 710 CB GLU A 43 4.217 -0.556 12.198 1.00 0.00 C ATOM 711 CG GLU A 43 5.277 -1.159 11.271 1.00 0.00 C ATOM 712 CD GLU A 43 6.467 -1.644 12.101 1.00 0.00 C ATOM 713 OE1 GLU A 43 6.593 -1.209 13.234 1.00 0.00 O ATOM 714 OE2 GLU A 43 7.233 -2.445 11.590 1.00 0.00 O ATOM 0 H GLU A 43 2.969 -2.385 11.377 1.00 0.00 H new ATOM 0 HA GLU A 43 4.577 -2.078 13.736 1.00 0.00 H new ATOM 0 HB2 GLU A 43 3.370 -0.198 11.613 1.00 0.00 H new ATOM 0 HB3 GLU A 43 4.628 0.306 12.724 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.852 -1.989 10.707 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.606 -0.415 10.545 1.00 0.00 H new ATOM 721 N LEU A 44 1.650 -0.601 13.914 1.00 0.00 N ATOM 722 CA LEU A 44 0.734 0.025 14.916 1.00 0.00 C ATOM 723 C LEU A 44 -0.319 -0.981 15.403 1.00 0.00 C ATOM 724 O LEU A 44 -1.045 -0.723 16.343 1.00 0.00 O ATOM 725 CB LEU A 44 0.067 1.185 14.173 1.00 0.00 C ATOM 726 CG LEU A 44 1.137 2.132 13.620 1.00 0.00 C ATOM 727 CD1 LEU A 44 0.462 3.340 12.965 1.00 0.00 C ATOM 728 CD2 LEU A 44 2.040 2.616 14.760 1.00 0.00 C ATOM 0 H LEU A 44 1.263 -0.706 12.976 1.00 0.00 H new ATOM 0 HA LEU A 44 1.272 0.359 15.803 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -0.548 0.802 13.359 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.597 1.726 14.847 1.00 0.00 H new ATOM 0 HG LEU A 44 1.737 1.601 12.881 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.224 4.013 12.572 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -0.179 3.002 12.151 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.140 3.866 13.706 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.799 3.289 14.362 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.439 3.144 15.501 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.524 1.760 15.229 1.00 0.00 H new ATOM 740 N GLY A 45 -0.400 -2.129 14.784 1.00 0.00 N ATOM 741 CA GLY A 45 -1.396 -3.152 15.225 1.00 0.00 C ATOM 742 C GLY A 45 -2.830 -2.706 14.889 1.00 0.00 C ATOM 743 O GLY A 45 -3.783 -3.383 15.218 1.00 0.00 O ATOM 0 H GLY A 45 0.180 -2.404 13.991 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.184 -4.104 14.739 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.304 -3.315 16.299 1.00 0.00 H new ATOM 747 N LEU A 46 -2.996 -1.583 14.237 1.00 0.00 N ATOM 748 CA LEU A 46 -4.372 -1.114 13.889 1.00 0.00 C ATOM 749 C LEU A 46 -4.289 0.160 13.045 1.00 0.00 C ATOM 750 O LEU A 46 -3.648 1.119 13.421 1.00 0.00 O ATOM 751 CB LEU A 46 -5.049 -0.825 15.232 1.00 0.00 C ATOM 752 CG LEU A 46 -6.558 -0.680 15.021 1.00 0.00 C ATOM 753 CD1 LEU A 46 -7.301 -1.232 16.239 1.00 0.00 C ATOM 754 CD2 LEU A 46 -6.904 0.801 14.847 1.00 0.00 C ATOM 0 H LEU A 46 -2.239 -0.971 13.931 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.927 -1.851 13.308 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -4.845 -1.632 15.935 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.642 0.088 15.668 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.855 -1.235 14.131 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.375 -1.128 16.088 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.053 -2.285 16.370 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.005 -0.676 17.129 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.978 0.908 14.696 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.606 1.352 15.739 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.375 1.199 13.981 1.00 0.00 H new ATOM 766 N LYS A 47 -4.930 0.177 11.907 1.00 0.00 N ATOM 767 CA LYS A 47 -4.884 1.382 11.037 1.00 0.00 C ATOM 768 C LYS A 47 -5.753 1.148 9.806 1.00 0.00 C ATOM 769 O LYS A 47 -6.506 2.006 9.390 1.00 0.00 O ATOM 770 CB LYS A 47 -3.417 1.530 10.622 1.00 0.00 C ATOM 771 CG LYS A 47 -2.761 2.654 11.425 1.00 0.00 C ATOM 772 CD LYS A 47 -1.798 3.427 10.521 1.00 0.00 C ATOM 773 CE LYS A 47 -0.706 2.484 10.010 1.00 0.00 C ATOM 774 NZ LYS A 47 -0.075 3.216 8.877 1.00 0.00 N ATOM 0 H LYS A 47 -5.486 -0.597 11.543 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.251 2.274 11.544 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.886 0.593 10.790 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.351 1.747 9.556 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -3.523 3.325 11.822 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -2.224 2.241 12.279 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.341 3.861 9.681 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -1.350 4.254 11.072 1.00 0.00 H new ATOM 0 HE2 LYS A 47 0.021 2.260 10.791 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -1.125 1.533 9.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.616 2.598 8.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -0.808 3.499 8.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 0.408 4.063 9.237 1.00 0.00 H new ATOM 788 N PHE A 48 -5.657 -0.016 9.220 1.00 0.00 N ATOM 789 CA PHE A 48 -6.482 -0.308 8.021 1.00 0.00 C ATOM 790 C PHE A 48 -6.811 -1.799 7.890 1.00 0.00 C ATOM 791 O PHE A 48 -6.390 -2.625 8.676 1.00 0.00 O ATOM 792 CB PHE A 48 -5.737 0.251 6.806 1.00 0.00 C ATOM 793 CG PHE A 48 -4.298 -0.180 6.767 1.00 0.00 C ATOM 794 CD1 PHE A 48 -3.949 -1.419 6.231 1.00 0.00 C ATOM 795 CD2 PHE A 48 -3.305 0.699 7.215 1.00 0.00 C ATOM 796 CE1 PHE A 48 -2.605 -1.785 6.140 1.00 0.00 C ATOM 797 CE2 PHE A 48 -1.959 0.333 7.134 1.00 0.00 C ATOM 798 CZ PHE A 48 -1.604 -0.906 6.594 1.00 0.00 C ATOM 0 H PHE A 48 -5.043 -0.773 9.522 1.00 0.00 H new ATOM 0 HA PHE A 48 -7.455 0.175 8.105 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -6.236 -0.077 5.895 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -5.787 1.340 6.822 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -4.718 -2.095 5.887 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -3.579 1.660 7.623 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -2.333 -2.743 5.721 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -1.193 1.007 7.489 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.564 -1.188 6.525 1.00 0.00 H new ATOM 808 N ARG A 49 -7.565 -2.125 6.880 1.00 0.00 N ATOM 809 CA ARG A 49 -7.956 -3.534 6.632 1.00 0.00 C ATOM 810 C ARG A 49 -7.785 -3.832 5.151 1.00 0.00 C ATOM 811 O ARG A 49 -7.989 -2.975 4.316 1.00 0.00 O ATOM 812 CB ARG A 49 -9.429 -3.612 7.035 1.00 0.00 C ATOM 813 CG ARG A 49 -9.554 -3.323 8.530 1.00 0.00 C ATOM 814 CD ARG A 49 -11.008 -3.519 8.971 1.00 0.00 C ATOM 815 NE ARG A 49 -11.803 -2.610 8.097 1.00 0.00 N ATOM 816 CZ ARG A 49 -12.912 -3.034 7.551 1.00 0.00 C ATOM 817 NH1 ARG A 49 -12.876 -3.667 6.411 1.00 0.00 N ATOM 818 NH2 ARG A 49 -14.054 -2.821 8.145 1.00 0.00 N ATOM 0 H ARG A 49 -7.933 -1.457 6.203 1.00 0.00 H new ATOM 0 HA ARG A 49 -7.355 -4.253 7.188 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -10.014 -2.892 6.463 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -9.829 -4.600 6.808 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -8.899 -3.987 9.095 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -9.233 -2.303 8.742 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -11.321 -4.556 8.850 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -11.138 -3.268 10.024 1.00 0.00 H new ATOM 0 HE ARG A 49 -11.481 -1.657 7.925 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -11.983 -3.831 5.947 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -13.741 -3.998 5.984 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -14.081 -2.324 9.035 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -14.920 -3.152 7.719 1.00 0.00 H new ATOM 832 N ALA A 50 -7.409 -5.026 4.808 1.00 0.00 N ATOM 833 CA ALA A 50 -7.230 -5.335 3.369 1.00 0.00 C ATOM 834 C ALA A 50 -8.374 -6.223 2.865 1.00 0.00 C ATOM 835 O ALA A 50 -8.903 -7.044 3.586 1.00 0.00 O ATOM 836 CB ALA A 50 -5.891 -6.066 3.276 1.00 0.00 C ATOM 0 H ALA A 50 -7.220 -5.793 5.453 1.00 0.00 H new ATOM 0 HA ALA A 50 -7.240 -4.436 2.753 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.691 -6.327 2.237 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -5.096 -5.419 3.647 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.930 -6.974 3.878 1.00 0.00 H new ATOM 842 N GLU A 51 -8.748 -6.061 1.627 1.00 0.00 N ATOM 843 CA GLU A 51 -9.846 -6.890 1.055 1.00 0.00 C ATOM 844 C GLU A 51 -9.400 -7.490 -0.279 1.00 0.00 C ATOM 845 O GLU A 51 -8.567 -6.936 -0.969 1.00 0.00 O ATOM 846 CB GLU A 51 -11.006 -5.916 0.841 1.00 0.00 C ATOM 847 CG GLU A 51 -11.414 -5.300 2.182 1.00 0.00 C ATOM 848 CD GLU A 51 -12.613 -4.369 1.977 1.00 0.00 C ATOM 849 OE1 GLU A 51 -12.917 -4.064 0.835 1.00 0.00 O ATOM 850 OE2 GLU A 51 -13.207 -3.978 2.968 1.00 0.00 O ATOM 0 H GLU A 51 -8.338 -5.385 0.982 1.00 0.00 H new ATOM 0 HA GLU A 51 -10.126 -7.719 1.705 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.712 -5.132 0.144 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -11.854 -6.437 0.396 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -11.669 -6.087 2.892 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -10.578 -4.745 2.608 1.00 0.00 H new ATOM 857 N GLU A 52 -9.944 -8.614 -0.655 1.00 0.00 N ATOM 858 CA GLU A 52 -9.540 -9.230 -1.950 1.00 0.00 C ATOM 859 C GLU A 52 -10.768 -9.754 -2.700 1.00 0.00 C ATOM 860 O GLU A 52 -11.666 -10.329 -2.118 1.00 0.00 O ATOM 861 CB GLU A 52 -8.614 -10.383 -1.568 1.00 0.00 C ATOM 862 CG GLU A 52 -7.397 -9.835 -0.818 1.00 0.00 C ATOM 863 CD GLU A 52 -6.432 -10.978 -0.493 1.00 0.00 C ATOM 864 OE1 GLU A 52 -6.807 -12.124 -0.687 1.00 0.00 O ATOM 865 OE2 GLU A 52 -5.331 -10.688 -0.054 1.00 0.00 O ATOM 0 H GLU A 52 -10.647 -9.130 -0.125 1.00 0.00 H new ATOM 0 HA GLU A 52 -9.051 -8.514 -2.610 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.147 -11.100 -0.943 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.293 -10.917 -2.462 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -6.893 -9.082 -1.424 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -7.716 -9.343 0.101 1.00 0.00 H new ATOM 872 N LYS A 53 -10.805 -9.570 -3.993 1.00 0.00 N ATOM 873 CA LYS A 53 -11.963 -10.065 -4.793 1.00 0.00 C ATOM 874 C LYS A 53 -13.292 -9.628 -4.164 1.00 0.00 C ATOM 875 O LYS A 53 -13.801 -10.263 -3.260 1.00 0.00 O ATOM 876 CB LYS A 53 -11.833 -11.589 -4.774 1.00 0.00 C ATOM 877 CG LYS A 53 -12.901 -12.202 -5.681 1.00 0.00 C ATOM 878 CD LYS A 53 -12.781 -13.727 -5.657 1.00 0.00 C ATOM 879 CE LYS A 53 -13.764 -14.329 -6.665 1.00 0.00 C ATOM 880 NZ LYS A 53 -14.149 -15.646 -6.088 1.00 0.00 N ATOM 0 H LYS A 53 -10.080 -9.096 -4.532 1.00 0.00 H new ATOM 0 HA LYS A 53 -11.957 -9.664 -5.806 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -10.840 -11.884 -5.112 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -11.947 -11.962 -3.756 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -13.893 -11.900 -5.347 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -12.782 -11.834 -6.700 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -11.762 -14.027 -5.902 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -12.992 -14.104 -4.656 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -14.635 -13.687 -6.799 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -13.302 -14.447 -7.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -14.822 -16.120 -6.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -13.301 -16.238 -5.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -14.593 -15.501 -5.159 1.00 0.00 H new ATOM 894 N LYS A 54 -13.861 -8.553 -4.641 1.00 0.00 N ATOM 895 CA LYS A 54 -15.159 -8.084 -4.077 1.00 0.00 C ATOM 896 C LYS A 54 -16.317 -8.718 -4.870 1.00 0.00 C ATOM 897 O LYS A 54 -16.330 -9.913 -5.090 1.00 0.00 O ATOM 898 CB LYS A 54 -15.130 -6.562 -4.236 1.00 0.00 C ATOM 899 CG LYS A 54 -16.140 -5.923 -3.276 1.00 0.00 C ATOM 900 CD LYS A 54 -15.578 -5.953 -1.852 1.00 0.00 C ATOM 901 CE LYS A 54 -16.580 -5.308 -0.893 1.00 0.00 C ATOM 902 NZ LYS A 54 -16.204 -3.867 -0.854 1.00 0.00 N ATOM 0 H LYS A 54 -13.483 -7.980 -5.396 1.00 0.00 H new ATOM 0 HA LYS A 54 -15.303 -8.365 -3.034 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -14.129 -6.184 -4.030 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -15.368 -6.289 -5.264 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -16.344 -4.895 -3.577 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -17.087 -6.461 -3.316 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -15.380 -6.981 -1.550 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -14.628 -5.421 -1.814 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -17.603 -5.439 -1.244 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -16.523 -5.758 0.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -16.979 -3.317 -0.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -15.343 -3.748 -0.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -16.027 -3.528 -1.821 1.00 0.00 H new ATOM 916 N TYR A 55 -17.284 -7.949 -5.309 1.00 0.00 N ATOM 917 CA TYR A 55 -18.406 -8.556 -6.084 1.00 0.00 C ATOM 918 C TYR A 55 -18.660 -7.758 -7.370 1.00 0.00 C ATOM 919 O TYR A 55 -19.759 -7.296 -7.604 1.00 0.00 O ATOM 920 CB TYR A 55 -19.617 -8.481 -5.153 1.00 0.00 C ATOM 921 CG TYR A 55 -20.209 -9.861 -4.989 1.00 0.00 C ATOM 922 CD1 TYR A 55 -19.528 -10.833 -4.248 1.00 0.00 C ATOM 923 CD2 TYR A 55 -21.439 -10.167 -5.581 1.00 0.00 C ATOM 924 CE1 TYR A 55 -20.079 -12.112 -4.099 1.00 0.00 C ATOM 925 CE2 TYR A 55 -21.990 -11.444 -5.432 1.00 0.00 C ATOM 926 CZ TYR A 55 -21.312 -12.418 -4.691 1.00 0.00 C ATOM 927 OH TYR A 55 -21.858 -13.680 -4.546 1.00 0.00 O ATOM 0 H TYR A 55 -17.344 -6.941 -5.166 1.00 0.00 H new ATOM 0 HA TYR A 55 -18.190 -9.580 -6.388 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -19.320 -8.083 -4.183 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -20.363 -7.799 -5.562 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -18.578 -10.597 -3.791 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -21.964 -9.417 -6.154 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -19.553 -12.863 -3.528 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -22.940 -11.678 -5.889 1.00 0.00 H new ATOM 0 HH TYR A 55 -22.716 -13.722 -5.018 1.00 0.00 H new ATOM 937 N PRO A 56 -17.631 -7.629 -8.173 1.00 0.00 N ATOM 938 CA PRO A 56 -17.756 -6.887 -9.452 1.00 0.00 C ATOM 939 C PRO A 56 -18.506 -7.729 -10.493 1.00 0.00 C ATOM 940 O PRO A 56 -18.924 -7.229 -11.519 1.00 0.00 O ATOM 941 CB PRO A 56 -16.309 -6.664 -9.879 1.00 0.00 C ATOM 942 CG PRO A 56 -15.531 -7.760 -9.223 1.00 0.00 C ATOM 943 CD PRO A 56 -16.272 -8.151 -7.969 1.00 0.00 C ATOM 0 HA PRO A 56 -18.317 -5.958 -9.353 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -16.208 -6.705 -10.964 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -15.952 -5.684 -9.562 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -15.432 -8.614 -9.893 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -14.522 -7.424 -8.984 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -16.278 -9.232 -7.831 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -15.809 -7.719 -7.082 1.00 0.00 H new ATOM 951 N LYS A 57 -18.663 -9.005 -10.243 1.00 0.00 N ATOM 952 CA LYS A 57 -19.369 -9.882 -11.223 1.00 0.00 C ATOM 953 C LYS A 57 -18.690 -9.786 -12.592 1.00 0.00 C ATOM 954 O LYS A 57 -19.292 -10.040 -13.616 1.00 0.00 O ATOM 955 CB LYS A 57 -20.806 -9.355 -11.286 1.00 0.00 C ATOM 956 CG LYS A 57 -21.478 -9.534 -9.923 1.00 0.00 C ATOM 957 CD LYS A 57 -22.908 -8.994 -9.982 1.00 0.00 C ATOM 958 CE LYS A 57 -23.743 -9.854 -10.935 1.00 0.00 C ATOM 959 NZ LYS A 57 -25.160 -9.523 -10.614 1.00 0.00 N ATOM 0 H LYS A 57 -18.332 -9.476 -9.401 1.00 0.00 H new ATOM 0 HA LYS A 57 -19.346 -10.931 -10.929 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -20.806 -8.302 -11.567 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -21.367 -9.890 -12.052 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -21.488 -10.588 -9.646 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -20.911 -9.008 -9.155 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -23.352 -9.001 -8.986 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -22.903 -7.958 -10.321 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -23.511 -9.628 -11.976 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -23.543 -10.915 -10.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -25.793 -10.075 -11.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -25.354 -9.755 -9.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -25.324 -8.508 -10.771 1.00 0.00 H new ATOM 973 N SER A 58 -17.435 -9.427 -12.609 1.00 0.00 N ATOM 974 CA SER A 58 -16.700 -9.317 -13.902 1.00 0.00 C ATOM 975 C SER A 58 -15.228 -9.681 -13.694 1.00 0.00 C ATOM 976 O SER A 58 -14.706 -9.590 -12.601 1.00 0.00 O ATOM 977 CB SER A 58 -16.839 -7.853 -14.316 1.00 0.00 C ATOM 978 OG SER A 58 -18.210 -7.561 -14.554 1.00 0.00 O ATOM 0 H SER A 58 -16.885 -9.204 -11.780 1.00 0.00 H new ATOM 0 HA SER A 58 -17.093 -9.990 -14.664 1.00 0.00 H new ATOM 0 HB2 SER A 58 -16.447 -7.203 -13.534 1.00 0.00 H new ATOM 0 HB3 SER A 58 -16.253 -7.660 -15.214 1.00 0.00 H new ATOM 0 HG SER A 58 -18.648 -7.334 -13.707 1.00 0.00 H new ATOM 984 N TRP A 59 -14.550 -10.088 -14.732 1.00 0.00 N ATOM 985 CA TRP A 59 -13.113 -10.450 -14.575 1.00 0.00 C ATOM 986 C TRP A 59 -12.244 -9.193 -14.679 1.00 0.00 C ATOM 987 O TRP A 59 -11.659 -8.913 -15.707 1.00 0.00 O ATOM 988 CB TRP A 59 -12.815 -11.406 -15.728 1.00 0.00 C ATOM 989 CG TRP A 59 -11.785 -12.398 -15.294 1.00 0.00 C ATOM 990 CD1 TRP A 59 -10.495 -12.411 -15.702 1.00 0.00 C ATOM 991 CD2 TRP A 59 -11.935 -13.517 -14.375 1.00 0.00 C ATOM 992 NE1 TRP A 59 -9.845 -13.468 -15.092 1.00 0.00 N ATOM 993 CE2 TRP A 59 -10.690 -14.180 -14.264 1.00 0.00 C ATOM 994 CE3 TRP A 59 -13.021 -14.017 -13.633 1.00 0.00 C ATOM 995 CZ2 TRP A 59 -10.528 -15.299 -13.448 1.00 0.00 C ATOM 996 CZ3 TRP A 59 -12.861 -15.143 -12.810 1.00 0.00 C ATOM 997 CH2 TRP A 59 -11.618 -15.783 -12.718 1.00 0.00 C ATOM 0 H TRP A 59 -14.925 -10.185 -15.675 1.00 0.00 H new ATOM 0 HA TRP A 59 -12.903 -10.906 -13.608 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -13.726 -11.921 -16.033 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -12.458 -10.849 -16.594 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -10.047 -11.711 -16.391 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -8.861 -13.694 -15.236 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -13.984 -13.532 -13.697 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -9.568 -15.788 -13.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 -13.701 -15.518 -12.244 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -11.502 -16.649 -12.084 1.00 0.00 H new ATOM 1008 N TRP A 60 -12.159 -8.434 -13.620 1.00 0.00 N ATOM 1009 CA TRP A 60 -11.331 -7.193 -13.651 1.00 0.00 C ATOM 1010 C TRP A 60 -10.728 -6.918 -12.272 1.00 0.00 C ATOM 1011 O TRP A 60 -10.936 -7.658 -11.331 1.00 0.00 O ATOM 1012 CB TRP A 60 -12.299 -6.075 -14.044 1.00 0.00 C ATOM 1013 CG TRP A 60 -12.440 -6.036 -15.531 1.00 0.00 C ATOM 1014 CD1 TRP A 60 -13.506 -6.493 -16.228 1.00 0.00 C ATOM 1015 CD2 TRP A 60 -11.501 -5.516 -16.516 1.00 0.00 C ATOM 1016 NE1 TRP A 60 -13.280 -6.288 -17.577 1.00 0.00 N ATOM 1017 CE2 TRP A 60 -12.058 -5.688 -17.805 1.00 0.00 C ATOM 1018 CE3 TRP A 60 -10.233 -4.917 -16.416 1.00 0.00 C ATOM 1019 CZ2 TRP A 60 -11.381 -5.281 -18.955 1.00 0.00 C ATOM 1020 CZ3 TRP A 60 -9.549 -4.507 -17.570 1.00 0.00 C ATOM 1021 CH2 TRP A 60 -10.121 -4.688 -18.836 1.00 0.00 C ATOM 0 H TRP A 60 -12.628 -8.620 -12.733 1.00 0.00 H new ATOM 0 HA TRP A 60 -10.498 -7.276 -14.349 1.00 0.00 H new ATOM 0 HB2 TRP A 60 -13.271 -6.242 -13.580 1.00 0.00 H new ATOM 0 HB3 TRP A 60 -11.932 -5.116 -13.678 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -14.389 -6.944 -15.801 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -13.936 -6.548 -18.313 1.00 0.00 H new ATOM 0 HE3 TRP A 60 -9.783 -4.772 -15.445 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -11.827 -5.423 -19.929 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 -8.575 -4.049 -17.482 1.00 0.00 H new ATOM 0 HH2 TRP A 60 -9.588 -4.369 -19.720 1.00 0.00 H new ATOM 1032 N GLU A 61 -9.983 -5.852 -12.148 1.00 0.00 N ATOM 1033 CA GLU A 61 -9.364 -5.512 -10.834 1.00 0.00 C ATOM 1034 C GLU A 61 -8.516 -6.679 -10.320 1.00 0.00 C ATOM 1035 O GLU A 61 -8.810 -7.273 -9.302 1.00 0.00 O ATOM 1036 CB GLU A 61 -10.542 -5.245 -9.897 1.00 0.00 C ATOM 1037 CG GLU A 61 -10.019 -4.744 -8.548 1.00 0.00 C ATOM 1038 CD GLU A 61 -11.188 -4.561 -7.574 1.00 0.00 C ATOM 1039 OE1 GLU A 61 -12.312 -4.836 -7.963 1.00 0.00 O ATOM 1040 OE2 GLU A 61 -10.939 -4.148 -6.454 1.00 0.00 O ATOM 0 H GLU A 61 -9.776 -5.199 -12.904 1.00 0.00 H new ATOM 0 HA GLU A 61 -8.698 -4.652 -10.905 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -11.210 -4.505 -10.337 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -11.123 -6.156 -9.758 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -9.301 -5.455 -8.139 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -9.492 -3.799 -8.680 1.00 0.00 H new ATOM 1047 N GLU A 62 -7.460 -7.002 -11.014 1.00 0.00 N ATOM 1048 CA GLU A 62 -6.578 -8.120 -10.566 1.00 0.00 C ATOM 1049 C GLU A 62 -5.811 -7.722 -9.296 1.00 0.00 C ATOM 1050 O GLU A 62 -5.144 -8.535 -8.685 1.00 0.00 O ATOM 1051 CB GLU A 62 -5.606 -8.347 -11.724 1.00 0.00 C ATOM 1052 CG GLU A 62 -6.385 -8.773 -12.973 1.00 0.00 C ATOM 1053 CD GLU A 62 -5.409 -9.063 -14.118 1.00 0.00 C ATOM 1054 OE1 GLU A 62 -4.235 -8.764 -13.966 1.00 0.00 O ATOM 1055 OE2 GLU A 62 -5.854 -9.581 -15.130 1.00 0.00 O ATOM 0 H GLU A 62 -7.168 -6.539 -11.875 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.147 -9.018 -10.325 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.046 -7.434 -11.926 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.879 -9.114 -11.457 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.980 -9.660 -12.757 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -7.080 -7.986 -13.266 1.00 0.00 H new ATOM 1062 N GLY A 63 -5.901 -6.482 -8.891 1.00 0.00 N ATOM 1063 CA GLY A 63 -5.182 -6.040 -7.664 1.00 0.00 C ATOM 1064 C GLY A 63 -6.023 -6.374 -6.433 1.00 0.00 C ATOM 1065 O GLY A 63 -6.792 -7.313 -6.431 1.00 0.00 O ATOM 0 H GLY A 63 -6.443 -5.756 -9.360 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -4.212 -6.534 -7.600 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -4.992 -4.968 -7.708 1.00 0.00 H new ATOM 1069 N GLY A 64 -5.885 -5.608 -5.387 1.00 0.00 N ATOM 1070 CA GLY A 64 -6.678 -5.874 -4.154 1.00 0.00 C ATOM 1071 C GLY A 64 -7.312 -4.568 -3.675 1.00 0.00 C ATOM 1072 O GLY A 64 -7.442 -3.622 -4.427 1.00 0.00 O ATOM 0 H GLY A 64 -5.256 -4.807 -5.333 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -7.451 -6.615 -4.357 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -6.036 -6.288 -3.376 1.00 0.00 H new ATOM 1076 N ARG A 65 -7.681 -4.491 -2.427 1.00 0.00 N ATOM 1077 CA ARG A 65 -8.273 -3.222 -1.909 1.00 0.00 C ATOM 1078 C ARG A 65 -8.001 -3.097 -0.410 1.00 0.00 C ATOM 1079 O ARG A 65 -8.046 -4.070 0.310 1.00 0.00 O ATOM 1080 CB ARG A 65 -9.771 -3.358 -2.177 1.00 0.00 C ATOM 1081 CG ARG A 65 -10.477 -2.044 -1.837 1.00 0.00 C ATOM 1082 CD ARG A 65 -11.983 -2.210 -2.052 1.00 0.00 C ATOM 1083 NE ARG A 65 -12.555 -0.849 -1.861 1.00 0.00 N ATOM 1084 CZ ARG A 65 -13.810 -0.625 -2.142 1.00 0.00 C ATOM 1085 NH1 ARG A 65 -14.744 -1.323 -1.556 1.00 0.00 N ATOM 1086 NH2 ARG A 65 -14.129 0.294 -3.013 1.00 0.00 N ATOM 0 H ARG A 65 -7.600 -5.246 -1.745 1.00 0.00 H new ATOM 0 HA ARG A 65 -7.853 -2.335 -2.383 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -9.941 -3.614 -3.223 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.185 -4.170 -1.579 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -10.274 -1.766 -0.803 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -10.095 -1.239 -2.465 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -12.199 -2.592 -3.050 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -12.407 -2.919 -1.341 1.00 0.00 H new ATOM 0 HE ARG A 65 -11.967 -0.092 -1.511 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -14.493 -2.043 -0.879 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -15.725 -1.148 -1.775 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -13.398 0.836 -3.473 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -15.109 0.470 -3.233 1.00 0.00 H new ATOM 1100 N VAL A 66 -7.730 -1.919 0.076 1.00 0.00 N ATOM 1101 CA VAL A 66 -7.476 -1.778 1.544 1.00 0.00 C ATOM 1102 C VAL A 66 -8.310 -0.632 2.132 1.00 0.00 C ATOM 1103 O VAL A 66 -8.599 0.345 1.476 1.00 0.00 O ATOM 1104 CB VAL A 66 -5.979 -1.496 1.668 1.00 0.00 C ATOM 1105 CG1 VAL A 66 -5.194 -2.643 1.029 1.00 0.00 C ATOM 1106 CG2 VAL A 66 -5.641 -0.190 0.952 1.00 0.00 C ATOM 0 H VAL A 66 -7.673 -1.057 -0.466 1.00 0.00 H new ATOM 0 HA VAL A 66 -7.761 -2.673 2.097 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.712 -1.410 2.721 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.126 -2.445 1.116 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -5.433 -3.576 1.539 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.463 -2.726 -0.024 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -4.573 0.008 1.042 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.907 -0.273 -0.102 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.201 0.628 1.404 1.00 0.00 H new ATOM 1116 N VAL A 67 -8.696 -0.751 3.371 1.00 0.00 N ATOM 1117 CA VAL A 67 -9.509 0.325 4.012 1.00 0.00 C ATOM 1118 C VAL A 67 -8.806 0.831 5.274 1.00 0.00 C ATOM 1119 O VAL A 67 -8.396 0.060 6.110 1.00 0.00 O ATOM 1120 CB VAL A 67 -10.836 -0.343 4.370 1.00 0.00 C ATOM 1121 CG1 VAL A 67 -11.787 0.694 4.968 1.00 0.00 C ATOM 1122 CG2 VAL A 67 -11.464 -0.938 3.106 1.00 0.00 C ATOM 0 H VAL A 67 -8.484 -1.548 3.971 1.00 0.00 H new ATOM 0 HA VAL A 67 -9.650 1.185 3.357 1.00 0.00 H new ATOM 0 HB VAL A 67 -10.658 -1.135 5.098 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -12.733 0.216 5.223 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -11.342 1.120 5.867 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -11.965 1.486 4.241 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -12.411 -1.415 3.360 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -11.641 -0.145 2.379 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -10.788 -1.678 2.678 1.00 0.00 H new ATOM 1132 N VAL A 68 -8.658 2.116 5.425 1.00 0.00 N ATOM 1133 CA VAL A 68 -7.968 2.639 6.644 1.00 0.00 C ATOM 1134 C VAL A 68 -8.962 3.377 7.526 1.00 0.00 C ATOM 1135 O VAL A 68 -9.810 4.098 7.040 1.00 0.00 O ATOM 1136 CB VAL A 68 -6.887 3.604 6.145 1.00 0.00 C ATOM 1137 CG1 VAL A 68 -5.995 4.008 7.320 1.00 0.00 C ATOM 1138 CG2 VAL A 68 -6.022 2.938 5.068 1.00 0.00 C ATOM 0 H VAL A 68 -8.980 2.825 4.766 1.00 0.00 H new ATOM 0 HA VAL A 68 -7.536 1.832 7.235 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.372 4.481 5.716 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.223 4.695 6.972 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.599 4.498 8.084 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.526 3.120 7.743 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -5.261 3.640 4.727 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -5.540 2.054 5.484 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -6.650 2.647 4.226 1.00 0.00 H new ATOM 1148 N GLU A 69 -8.890 3.204 8.821 1.00 0.00 N ATOM 1149 CA GLU A 69 -9.874 3.915 9.682 1.00 0.00 C ATOM 1150 C GLU A 69 -9.514 5.400 9.773 1.00 0.00 C ATOM 1151 O GLU A 69 -8.574 5.787 10.436 1.00 0.00 O ATOM 1152 CB GLU A 69 -9.716 3.243 11.051 1.00 0.00 C ATOM 1153 CG GLU A 69 -10.791 3.742 12.021 1.00 0.00 C ATOM 1154 CD GLU A 69 -10.473 3.250 13.438 1.00 0.00 C ATOM 1155 OE1 GLU A 69 -9.456 2.597 13.608 1.00 0.00 O ATOM 1156 OE2 GLU A 69 -11.254 3.537 14.330 1.00 0.00 O ATOM 0 H GLU A 69 -8.211 2.617 9.307 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.894 3.860 9.301 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.790 2.161 10.942 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.726 3.456 11.455 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.833 4.831 12.004 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -11.771 3.380 11.711 1.00 0.00 H new ATOM 1163 N LYS A 70 -10.272 6.223 9.087 1.00 0.00 N ATOM 1164 CA LYS A 70 -10.006 7.699 9.079 1.00 0.00 C ATOM 1165 C LYS A 70 -10.972 8.409 8.127 1.00 0.00 C ATOM 1166 O LYS A 70 -10.564 9.097 7.213 1.00 0.00 O ATOM 1167 CB LYS A 70 -8.558 7.856 8.576 1.00 0.00 C ATOM 1168 CG LYS A 70 -8.424 7.222 7.186 1.00 0.00 C ATOM 1169 CD LYS A 70 -6.952 7.200 6.754 1.00 0.00 C ATOM 1170 CE LYS A 70 -6.876 7.031 5.233 1.00 0.00 C ATOM 1171 NZ LYS A 70 -5.456 6.676 4.956 1.00 0.00 N ATOM 0 H LYS A 70 -11.073 5.932 8.526 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.144 8.138 10.067 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -8.290 8.912 8.533 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -7.867 7.380 9.272 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -8.821 6.207 7.201 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -9.015 7.785 6.463 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -6.459 8.124 7.054 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.427 6.383 7.249 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -7.553 6.249 4.888 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.161 7.949 4.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.283 6.710 3.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.829 7.353 5.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -5.263 5.717 5.308 1.00 0.00 H new ATOM 1185 N ARG A 71 -12.249 8.249 8.329 1.00 0.00 N ATOM 1186 CA ARG A 71 -13.231 8.914 7.425 1.00 0.00 C ATOM 1187 C ARG A 71 -13.331 10.410 7.738 1.00 0.00 C ATOM 1188 O ARG A 71 -13.060 10.847 8.839 1.00 0.00 O ATOM 1189 CB ARG A 71 -14.563 8.219 7.696 1.00 0.00 C ATOM 1190 CG ARG A 71 -15.298 8.017 6.373 1.00 0.00 C ATOM 1191 CD ARG A 71 -16.375 9.091 6.210 1.00 0.00 C ATOM 1192 NE ARG A 71 -16.407 9.381 4.750 1.00 0.00 N ATOM 1193 CZ ARG A 71 -17.550 9.460 4.126 1.00 0.00 C ATOM 1194 NH1 ARG A 71 -18.224 8.376 3.860 1.00 0.00 N ATOM 1195 NH2 ARG A 71 -18.016 10.625 3.766 1.00 0.00 N ATOM 0 H ARG A 71 -12.656 7.689 9.078 1.00 0.00 H new ATOM 0 HA ARG A 71 -12.935 8.834 6.379 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -14.394 7.259 8.183 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -15.169 8.819 8.375 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -14.593 8.067 5.543 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -15.752 7.026 6.346 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -17.343 8.737 6.564 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -16.133 9.984 6.785 1.00 0.00 H new ATOM 0 HE ARG A 71 -15.536 9.518 4.238 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -17.858 7.466 4.140 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -19.118 8.438 3.372 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -17.487 11.472 3.973 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -18.909 10.688 3.278 1.00 0.00 H new ATOM 1209 N GLY A 72 -13.710 11.196 6.768 1.00 0.00 N ATOM 1210 CA GLY A 72 -13.823 12.666 6.988 1.00 0.00 C ATOM 1211 C GLY A 72 -12.593 13.351 6.392 1.00 0.00 C ATOM 1212 O GLY A 72 -12.642 14.488 5.967 1.00 0.00 O ATOM 0 H GLY A 72 -13.948 10.881 5.827 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.731 13.048 6.521 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -13.896 12.883 8.054 1.00 0.00 H new ATOM 1216 N THR A 73 -11.491 12.655 6.352 1.00 0.00 N ATOM 1217 CA THR A 73 -10.247 13.245 5.777 1.00 0.00 C ATOM 1218 C THR A 73 -10.107 12.836 4.309 1.00 0.00 C ATOM 1219 O THR A 73 -10.773 11.933 3.842 1.00 0.00 O ATOM 1220 CB THR A 73 -9.107 12.658 6.610 1.00 0.00 C ATOM 1221 OG1 THR A 73 -9.027 11.261 6.373 1.00 0.00 O ATOM 1222 CG2 THR A 73 -9.367 12.915 8.097 1.00 0.00 C ATOM 0 H THR A 73 -11.397 11.699 6.694 1.00 0.00 H new ATOM 0 HA THR A 73 -10.250 14.335 5.807 1.00 0.00 H new ATOM 0 HB THR A 73 -8.167 13.131 6.326 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.673 10.795 6.944 1.00 0.00 H new ATOM 0 HG21 THR A 73 -8.552 12.495 8.687 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.428 13.989 8.275 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.306 12.445 8.389 1.00 0.00 H new ATOM 1230 N LYS A 74 -9.249 13.490 3.574 1.00 0.00 N ATOM 1231 CA LYS A 74 -9.079 13.128 2.137 1.00 0.00 C ATOM 1232 C LYS A 74 -7.686 12.511 1.895 1.00 0.00 C ATOM 1233 O LYS A 74 -7.249 11.648 2.630 1.00 0.00 O ATOM 1234 CB LYS A 74 -9.256 14.446 1.377 1.00 0.00 C ATOM 1235 CG LYS A 74 -10.635 15.033 1.681 1.00 0.00 C ATOM 1236 CD LYS A 74 -10.951 16.146 0.679 1.00 0.00 C ATOM 1237 CE LYS A 74 -9.966 17.304 0.863 1.00 0.00 C ATOM 1238 NZ LYS A 74 -9.681 17.788 -0.518 1.00 0.00 N ATOM 0 H LYS A 74 -8.661 14.255 3.904 1.00 0.00 H new ATOM 0 HA LYS A 74 -9.797 12.378 1.806 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -8.477 15.152 1.667 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -9.150 14.277 0.305 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -11.394 14.253 1.625 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.658 15.427 2.697 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -10.888 15.761 -0.339 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.972 16.499 0.823 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -10.396 18.095 1.478 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -9.055 16.972 1.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -9.012 18.583 -0.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -9.266 17.016 -1.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -10.566 18.103 -0.965 1.00 0.00 H new ATOM 1252 N THR A 75 -6.995 12.931 0.863 1.00 0.00 N ATOM 1253 CA THR A 75 -5.649 12.361 0.557 1.00 0.00 C ATOM 1254 C THR A 75 -4.674 12.551 1.716 1.00 0.00 C ATOM 1255 O THR A 75 -3.826 11.717 1.947 1.00 0.00 O ATOM 1256 CB THR A 75 -5.168 13.123 -0.679 1.00 0.00 C ATOM 1257 OG1 THR A 75 -6.158 13.047 -1.696 1.00 0.00 O ATOM 1258 CG2 THR A 75 -3.865 12.504 -1.189 1.00 0.00 C ATOM 0 H THR A 75 -7.311 13.652 0.214 1.00 0.00 H new ATOM 0 HA THR A 75 -5.705 11.285 0.390 1.00 0.00 H new ATOM 0 HB THR A 75 -4.994 14.166 -0.416 1.00 0.00 H new ATOM 0 HG1 THR A 75 -5.852 13.536 -2.488 1.00 0.00 H new ATOM 0 HG21 THR A 75 -3.524 13.048 -2.070 1.00 0.00 H new ATOM 0 HG22 THR A 75 -3.105 12.562 -0.410 1.00 0.00 H new ATOM 0 HG23 THR A 75 -4.036 11.460 -1.452 1.00 0.00 H new ATOM 1266 N LYS A 76 -4.748 13.642 2.423 1.00 0.00 N ATOM 1267 CA LYS A 76 -3.772 13.861 3.534 1.00 0.00 C ATOM 1268 C LYS A 76 -3.713 12.643 4.449 1.00 0.00 C ATOM 1269 O LYS A 76 -2.643 12.209 4.829 1.00 0.00 O ATOM 1270 CB LYS A 76 -4.286 15.064 4.307 1.00 0.00 C ATOM 1271 CG LYS A 76 -4.360 16.266 3.370 1.00 0.00 C ATOM 1272 CD LYS A 76 -4.622 17.537 4.178 1.00 0.00 C ATOM 1273 CE LYS A 76 -3.331 17.971 4.876 1.00 0.00 C ATOM 1274 NZ LYS A 76 -3.335 19.459 4.804 1.00 0.00 N ATOM 0 H LYS A 76 -5.432 14.386 2.285 1.00 0.00 H new ATOM 0 HA LYS A 76 -2.766 14.023 3.148 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -5.271 14.851 4.723 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.625 15.282 5.146 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -3.427 16.363 2.814 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -5.154 16.120 2.638 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -4.978 18.331 3.522 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -5.404 17.358 4.915 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -3.306 17.626 5.910 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.455 17.554 4.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -2.479 19.831 5.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.352 19.758 3.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -4.177 19.828 5.291 1.00 0.00 H new ATOM 1288 N LEU A 77 -4.830 12.057 4.783 1.00 0.00 N ATOM 1289 CA LEU A 77 -4.767 10.847 5.637 1.00 0.00 C ATOM 1290 C LEU A 77 -4.086 9.756 4.823 1.00 0.00 C ATOM 1291 O LEU A 77 -3.230 9.043 5.308 1.00 0.00 O ATOM 1292 CB LEU A 77 -6.217 10.496 5.963 1.00 0.00 C ATOM 1293 CG LEU A 77 -6.473 10.763 7.451 1.00 0.00 C ATOM 1294 CD1 LEU A 77 -5.511 9.929 8.301 1.00 0.00 C ATOM 1295 CD2 LEU A 77 -6.245 12.249 7.748 1.00 0.00 C ATOM 0 H LEU A 77 -5.764 12.359 4.506 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.206 10.981 6.562 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -6.895 11.091 5.352 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.413 9.450 5.729 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.500 10.490 7.692 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -5.697 10.123 9.357 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.666 8.870 8.093 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.483 10.199 8.058 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.427 12.441 8.806 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -5.217 12.516 7.502 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.929 12.849 7.148 1.00 0.00 H new ATOM 1307 N MET A 78 -4.430 9.653 3.565 1.00 0.00 N ATOM 1308 CA MET A 78 -3.761 8.642 2.701 1.00 0.00 C ATOM 1309 C MET A 78 -2.277 8.975 2.683 1.00 0.00 C ATOM 1310 O MET A 78 -1.423 8.110 2.694 1.00 0.00 O ATOM 1311 CB MET A 78 -4.393 8.773 1.316 1.00 0.00 C ATOM 1312 CG MET A 78 -5.825 8.236 1.374 1.00 0.00 C ATOM 1313 SD MET A 78 -6.407 7.861 -0.301 1.00 0.00 S ATOM 1314 CE MET A 78 -6.961 9.525 -0.740 1.00 0.00 C ATOM 0 H MET A 78 -5.140 10.222 3.104 1.00 0.00 H new ATOM 0 HA MET A 78 -3.878 7.617 3.053 1.00 0.00 H new ATOM 0 HB2 MET A 78 -4.394 9.816 0.999 1.00 0.00 H new ATOM 0 HB3 MET A 78 -3.811 8.217 0.581 1.00 0.00 H new ATOM 0 HG2 MET A 78 -5.862 7.338 1.991 1.00 0.00 H new ATOM 0 HG3 MET A 78 -6.480 8.971 1.841 1.00 0.00 H new ATOM 0 HE1 MET A 78 -7.814 9.458 -1.415 1.00 0.00 H new ATOM 0 HE2 MET A 78 -7.254 10.061 0.163 1.00 0.00 H new ATOM 0 HE3 MET A 78 -6.149 10.061 -1.233 1.00 0.00 H new ATOM 1324 N ILE A 79 -1.970 10.245 2.692 1.00 0.00 N ATOM 1325 CA ILE A 79 -0.544 10.669 2.716 1.00 0.00 C ATOM 1326 C ILE A 79 0.117 9.967 3.914 1.00 0.00 C ATOM 1327 O ILE A 79 1.191 9.409 3.806 1.00 0.00 O ATOM 1328 CB ILE A 79 -0.599 12.216 2.865 1.00 0.00 C ATOM 1329 CG1 ILE A 79 0.095 12.866 1.666 1.00 0.00 C ATOM 1330 CG2 ILE A 79 0.094 12.701 4.150 1.00 0.00 C ATOM 1331 CD1 ILE A 79 -0.806 12.769 0.431 1.00 0.00 C ATOM 0 H ILE A 79 -2.648 11.007 2.684 1.00 0.00 H new ATOM 0 HA ILE A 79 0.037 10.408 1.831 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.650 12.501 2.914 1.00 0.00 H new ATOM 0 HG12 ILE A 79 0.317 13.911 1.885 1.00 0.00 H new ATOM 0 HG13 ILE A 79 1.047 12.372 1.473 1.00 0.00 H new ATOM 0 HG21 ILE A 79 0.030 13.787 4.210 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -0.398 12.260 5.017 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.141 12.400 4.134 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -0.308 13.233 -0.420 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.005 11.721 0.208 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.747 13.284 0.626 1.00 0.00 H new ATOM 1343 N GLU A 80 -0.541 9.963 5.047 1.00 0.00 N ATOM 1344 CA GLU A 80 0.041 9.257 6.229 1.00 0.00 C ATOM 1345 C GLU A 80 0.178 7.762 5.916 1.00 0.00 C ATOM 1346 O GLU A 80 1.161 7.140 6.264 1.00 0.00 O ATOM 1347 CB GLU A 80 -0.950 9.485 7.371 1.00 0.00 C ATOM 1348 CG GLU A 80 -1.025 10.980 7.693 1.00 0.00 C ATOM 1349 CD GLU A 80 -1.950 11.208 8.892 1.00 0.00 C ATOM 1350 OE1 GLU A 80 -2.568 10.253 9.334 1.00 0.00 O ATOM 1351 OE2 GLU A 80 -2.027 12.338 9.347 1.00 0.00 O ATOM 0 H GLU A 80 -1.444 10.412 5.204 1.00 0.00 H new ATOM 0 HA GLU A 80 1.033 9.627 6.489 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -1.935 9.113 7.091 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.638 8.927 8.254 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.029 11.364 7.913 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -1.395 11.529 6.827 1.00 0.00 H new ATOM 1358 N LEU A 81 -0.779 7.176 5.239 1.00 0.00 N ATOM 1359 CA LEU A 81 -0.644 5.727 4.898 1.00 0.00 C ATOM 1360 C LEU A 81 0.635 5.534 4.085 1.00 0.00 C ATOM 1361 O LEU A 81 1.370 4.585 4.273 1.00 0.00 O ATOM 1362 CB LEU A 81 -1.876 5.386 4.062 1.00 0.00 C ATOM 1363 CG LEU A 81 -1.913 3.878 3.815 1.00 0.00 C ATOM 1364 CD1 LEU A 81 -2.463 3.170 5.054 1.00 0.00 C ATOM 1365 CD2 LEU A 81 -2.814 3.575 2.617 1.00 0.00 C ATOM 0 H LEU A 81 -1.633 7.629 4.913 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.582 5.086 5.778 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.781 5.704 4.579 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.846 5.922 3.113 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.903 3.523 3.609 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.489 2.095 4.877 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.821 3.382 5.909 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -3.472 3.528 5.260 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.839 2.499 2.443 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.823 3.933 2.821 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.423 4.077 1.732 1.00 0.00 H new ATOM 1377 N ALA A 82 0.931 6.462 3.217 1.00 0.00 N ATOM 1378 CA ALA A 82 2.190 6.378 2.427 1.00 0.00 C ATOM 1379 C ALA A 82 3.372 6.543 3.384 1.00 0.00 C ATOM 1380 O ALA A 82 4.438 6.004 3.184 1.00 0.00 O ATOM 1381 CB ALA A 82 2.126 7.538 1.432 1.00 0.00 C ATOM 0 H ALA A 82 0.352 7.278 3.021 1.00 0.00 H new ATOM 0 HA ALA A 82 2.308 5.428 1.906 1.00 0.00 H new ATOM 0 HB1 ALA A 82 3.024 7.538 0.815 1.00 0.00 H new ATOM 0 HB2 ALA A 82 1.248 7.424 0.796 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.059 8.480 1.976 1.00 0.00 H new ATOM 1387 N ARG A 83 3.164 7.288 4.434 1.00 0.00 N ATOM 1388 CA ARG A 83 4.258 7.491 5.425 1.00 0.00 C ATOM 1389 C ARG A 83 4.722 6.118 5.928 1.00 0.00 C ATOM 1390 O ARG A 83 5.897 5.807 5.919 1.00 0.00 O ATOM 1391 CB ARG A 83 3.642 8.311 6.561 1.00 0.00 C ATOM 1392 CG ARG A 83 4.761 8.911 7.416 1.00 0.00 C ATOM 1393 CD ARG A 83 4.159 9.847 8.467 1.00 0.00 C ATOM 1394 NE ARG A 83 3.486 8.950 9.445 1.00 0.00 N ATOM 1395 CZ ARG A 83 3.533 9.222 10.721 1.00 0.00 C ATOM 1396 NH1 ARG A 83 4.630 9.011 11.394 1.00 0.00 N ATOM 1397 NH2 ARG A 83 2.482 9.709 11.323 1.00 0.00 N ATOM 0 H ARG A 83 2.287 7.763 4.648 1.00 0.00 H new ATOM 0 HA ARG A 83 5.123 8.005 5.005 1.00 0.00 H new ATOM 0 HB2 ARG A 83 3.015 9.104 6.154 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.999 7.679 7.174 1.00 0.00 H new ATOM 0 HG2 ARG A 83 5.326 8.116 7.903 1.00 0.00 H new ATOM 0 HG3 ARG A 83 5.461 9.459 6.785 1.00 0.00 H new ATOM 0 HD2 ARG A 83 4.931 10.447 8.949 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.450 10.542 8.016 1.00 0.00 H new ATOM 0 HE ARG A 83 2.988 8.122 9.118 1.00 0.00 H new ATOM 0 HH11 ARG A 83 5.452 8.633 10.923 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.666 9.224 12.391 1.00 0.00 H new ATOM 0 HH21 ARG A 83 1.625 9.877 10.796 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.518 9.922 12.320 1.00 0.00 H new ATOM 1411 N LYS A 84 3.798 5.278 6.320 1.00 0.00 N ATOM 1412 CA LYS A 84 4.176 3.898 6.772 1.00 0.00 C ATOM 1413 C LYS A 84 4.533 3.023 5.567 1.00 0.00 C ATOM 1414 O LYS A 84 5.529 2.325 5.562 1.00 0.00 O ATOM 1415 CB LYS A 84 2.939 3.349 7.492 1.00 0.00 C ATOM 1416 CG LYS A 84 2.986 3.764 8.964 1.00 0.00 C ATOM 1417 CD LYS A 84 2.657 5.253 9.091 1.00 0.00 C ATOM 1418 CE LYS A 84 2.695 5.656 10.566 1.00 0.00 C ATOM 1419 NZ LYS A 84 4.132 5.924 10.853 1.00 0.00 N ATOM 0 H LYS A 84 2.799 5.484 6.348 1.00 0.00 H new ATOM 0 HA LYS A 84 5.048 3.908 7.425 1.00 0.00 H new ATOM 0 HB2 LYS A 84 2.032 3.731 7.023 1.00 0.00 H new ATOM 0 HB3 LYS A 84 2.908 2.263 7.409 1.00 0.00 H new ATOM 0 HG2 LYS A 84 2.274 3.174 9.541 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.975 3.564 9.377 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.374 5.845 8.522 1.00 0.00 H new ATOM 0 HD3 LYS A 84 1.671 5.456 8.672 1.00 0.00 H new ATOM 0 HE2 LYS A 84 2.084 6.540 10.750 1.00 0.00 H new ATOM 0 HE3 LYS A 84 2.306 4.861 11.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 4.229 6.304 11.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 4.673 5.039 10.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.499 6.616 10.169 1.00 0.00 H new ATOM 1433 N ILE A 85 3.723 3.060 4.544 1.00 0.00 N ATOM 1434 CA ILE A 85 4.006 2.235 3.328 1.00 0.00 C ATOM 1435 C ILE A 85 5.350 2.625 2.698 1.00 0.00 C ATOM 1436 O ILE A 85 6.088 1.789 2.215 1.00 0.00 O ATOM 1437 CB ILE A 85 2.852 2.537 2.369 1.00 0.00 C ATOM 1438 CG1 ILE A 85 1.547 1.984 2.946 1.00 0.00 C ATOM 1439 CG2 ILE A 85 3.120 1.895 1.010 1.00 0.00 C ATOM 1440 CD1 ILE A 85 0.396 2.306 1.993 1.00 0.00 C ATOM 0 H ILE A 85 2.876 3.626 4.495 1.00 0.00 H new ATOM 0 HA ILE A 85 4.077 1.174 3.566 1.00 0.00 H new ATOM 0 HB ILE A 85 2.767 3.616 2.244 1.00 0.00 H new ATOM 0 HG12 ILE A 85 1.627 0.906 3.087 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.356 2.421 3.926 1.00 0.00 H new ATOM 0 HG21 ILE A 85 2.294 2.115 0.334 1.00 0.00 H new ATOM 0 HG22 ILE A 85 4.045 2.295 0.595 1.00 0.00 H new ATOM 0 HG23 ILE A 85 3.213 0.816 1.130 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -0.535 1.913 2.401 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.313 3.386 1.875 1.00 0.00 H new ATOM 0 HD13 ILE A 85 0.588 1.848 1.023 1.00 0.00 H new ATOM 1452 N ALA A 86 5.654 3.889 2.679 1.00 0.00 N ATOM 1453 CA ALA A 86 6.928 4.355 2.060 1.00 0.00 C ATOM 1454 C ALA A 86 8.131 3.729 2.758 1.00 0.00 C ATOM 1455 O ALA A 86 9.135 3.458 2.130 1.00 0.00 O ATOM 1456 CB ALA A 86 6.927 5.873 2.240 1.00 0.00 C ATOM 0 H ALA A 86 5.070 4.629 3.069 1.00 0.00 H new ATOM 0 HA ALA A 86 6.998 4.069 1.011 1.00 0.00 H new ATOM 0 HB1 ALA A 86 7.836 6.291 1.808 1.00 0.00 H new ATOM 0 HB2 ALA A 86 6.058 6.298 1.738 1.00 0.00 H new ATOM 0 HB3 ALA A 86 6.886 6.113 3.302 1.00 0.00 H new ATOM 1462 N GLU A 87 8.039 3.458 4.036 1.00 0.00 N ATOM 1463 CA GLU A 87 9.207 2.809 4.691 1.00 0.00 C ATOM 1464 C GLU A 87 9.347 1.432 4.050 1.00 0.00 C ATOM 1465 O GLU A 87 10.407 1.038 3.615 1.00 0.00 O ATOM 1466 CB GLU A 87 8.841 2.691 6.173 1.00 0.00 C ATOM 1467 CG GLU A 87 10.036 2.131 6.951 1.00 0.00 C ATOM 1468 CD GLU A 87 11.146 3.181 7.007 1.00 0.00 C ATOM 1469 OE1 GLU A 87 10.830 4.355 6.904 1.00 0.00 O ATOM 1470 OE2 GLU A 87 12.294 2.794 7.149 1.00 0.00 O ATOM 0 H GLU A 87 7.235 3.651 4.633 1.00 0.00 H new ATOM 0 HA GLU A 87 10.144 3.355 4.583 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.561 3.667 6.568 1.00 0.00 H new ATOM 0 HB3 GLU A 87 7.976 2.038 6.294 1.00 0.00 H new ATOM 0 HG2 GLU A 87 9.730 1.856 7.960 1.00 0.00 H new ATOM 0 HG3 GLU A 87 10.403 1.224 6.471 1.00 0.00 H new ATOM 1477 N ILE A 88 8.285 0.669 4.079 1.00 0.00 N ATOM 1478 CA ILE A 88 8.400 -0.728 3.553 1.00 0.00 C ATOM 1479 C ILE A 88 9.041 -0.692 2.157 1.00 0.00 C ATOM 1480 O ILE A 88 10.051 -1.333 1.937 1.00 0.00 O ATOM 1481 CB ILE A 88 6.980 -1.276 3.493 1.00 0.00 C ATOM 1482 CG1 ILE A 88 6.421 -1.361 4.915 1.00 0.00 C ATOM 1483 CG2 ILE A 88 7.022 -2.676 2.872 1.00 0.00 C ATOM 1484 CD1 ILE A 88 4.960 -0.906 4.927 1.00 0.00 C ATOM 0 H ILE A 88 7.367 0.940 4.433 1.00 0.00 H new ATOM 0 HA ILE A 88 9.026 -1.359 4.184 1.00 0.00 H new ATOM 0 HB ILE A 88 6.345 -0.625 2.892 1.00 0.00 H new ATOM 0 HG12 ILE A 88 6.496 -2.384 5.284 1.00 0.00 H new ATOM 0 HG13 ILE A 88 7.011 -0.736 5.585 1.00 0.00 H new ATOM 0 HG21 ILE A 88 6.012 -3.082 2.822 1.00 0.00 H new ATOM 0 HG22 ILE A 88 7.439 -2.616 1.867 1.00 0.00 H new ATOM 0 HG23 ILE A 88 7.645 -3.327 3.485 1.00 0.00 H new ATOM 0 HD11 ILE A 88 4.568 -0.969 5.942 1.00 0.00 H new ATOM 0 HD12 ILE A 88 4.897 0.124 4.577 1.00 0.00 H new ATOM 0 HD13 ILE A 88 4.373 -1.549 4.271 1.00 0.00 H new ATOM 1496 N ARG A 89 8.523 0.064 1.221 1.00 0.00 N ATOM 1497 CA ARG A 89 9.199 0.122 -0.113 1.00 0.00 C ATOM 1498 C ARG A 89 10.649 0.576 0.110 1.00 0.00 C ATOM 1499 O ARG A 89 11.588 0.053 -0.456 1.00 0.00 O ATOM 1500 CB ARG A 89 8.425 1.188 -0.884 1.00 0.00 C ATOM 1501 CG ARG A 89 8.962 1.290 -2.310 1.00 0.00 C ATOM 1502 CD ARG A 89 8.418 2.563 -2.958 1.00 0.00 C ATOM 1503 NE ARG A 89 8.797 2.455 -4.393 1.00 0.00 N ATOM 1504 CZ ARG A 89 9.943 2.925 -4.804 1.00 0.00 C ATOM 1505 NH1 ARG A 89 10.213 4.194 -4.672 1.00 0.00 N ATOM 1506 NH2 ARG A 89 10.820 2.125 -5.345 1.00 0.00 N ATOM 0 H ARG A 89 7.681 0.632 1.317 1.00 0.00 H new ATOM 0 HA ARG A 89 9.214 -0.830 -0.643 1.00 0.00 H new ATOM 0 HB2 ARG A 89 7.364 0.938 -0.902 1.00 0.00 H new ATOM 0 HB3 ARG A 89 8.517 2.151 -0.382 1.00 0.00 H new ATOM 0 HG2 ARG A 89 10.052 1.308 -2.301 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.663 0.416 -2.888 1.00 0.00 H new ATOM 0 HD2 ARG A 89 7.337 2.636 -2.839 1.00 0.00 H new ATOM 0 HD3 ARG A 89 8.849 3.454 -2.502 1.00 0.00 H new ATOM 0 HE ARG A 89 8.160 2.013 -5.056 1.00 0.00 H new ATOM 0 HH11 ARG A 89 9.528 4.820 -4.247 1.00 0.00 H new ATOM 0 HH12 ARG A 89 11.109 4.561 -4.993 1.00 0.00 H new ATOM 0 HH21 ARG A 89 10.610 1.132 -5.447 1.00 0.00 H new ATOM 0 HH22 ARG A 89 11.716 2.492 -5.666 1.00 0.00 H new ATOM 1520 N GLU A 90 10.800 1.560 0.948 1.00 0.00 N ATOM 1521 CA GLU A 90 12.156 2.098 1.258 1.00 0.00 C ATOM 1522 C GLU A 90 13.036 0.977 1.826 1.00 0.00 C ATOM 1523 O GLU A 90 14.228 0.940 1.597 1.00 0.00 O ATOM 1524 CB GLU A 90 11.946 3.214 2.286 1.00 0.00 C ATOM 1525 CG GLU A 90 13.280 3.917 2.555 1.00 0.00 C ATOM 1526 CD GLU A 90 13.102 4.967 3.656 1.00 0.00 C ATOM 1527 OE1 GLU A 90 12.001 5.084 4.171 1.00 0.00 O ATOM 1528 OE2 GLU A 90 14.072 5.639 3.966 1.00 0.00 O ATOM 0 H GLU A 90 10.034 2.022 1.438 1.00 0.00 H new ATOM 0 HA GLU A 90 12.659 2.484 0.371 1.00 0.00 H new ATOM 0 HB2 GLU A 90 11.213 3.931 1.916 1.00 0.00 H new ATOM 0 HB3 GLU A 90 11.548 2.800 3.212 1.00 0.00 H new ATOM 0 HG2 GLU A 90 14.032 3.187 2.854 1.00 0.00 H new ATOM 0 HG3 GLU A 90 13.642 4.391 1.643 1.00 0.00 H new ATOM 1535 N GLN A 91 12.454 0.042 2.534 1.00 0.00 N ATOM 1536 CA GLN A 91 13.279 -1.087 3.066 1.00 0.00 C ATOM 1537 C GLN A 91 13.698 -1.992 1.905 1.00 0.00 C ATOM 1538 O GLN A 91 14.810 -2.480 1.845 1.00 0.00 O ATOM 1539 CB GLN A 91 12.385 -1.846 4.052 1.00 0.00 C ATOM 1540 CG GLN A 91 12.138 -0.986 5.293 1.00 0.00 C ATOM 1541 CD GLN A 91 11.546 -1.850 6.408 1.00 0.00 C ATOM 1542 OE1 GLN A 91 12.071 -1.892 7.504 1.00 0.00 O ATOM 1543 NE2 GLN A 91 10.470 -2.552 6.176 1.00 0.00 N ATOM 0 H GLN A 91 11.461 0.010 2.764 1.00 0.00 H new ATOM 0 HA GLN A 91 14.185 -0.738 3.561 1.00 0.00 H new ATOM 0 HB2 GLN A 91 11.436 -2.098 3.578 1.00 0.00 H new ATOM 0 HB3 GLN A 91 12.858 -2.786 4.337 1.00 0.00 H new ATOM 0 HG2 GLN A 91 13.072 -0.535 5.627 1.00 0.00 H new ATOM 0 HG3 GLN A 91 11.457 -0.169 5.052 1.00 0.00 H new ATOM 0 HE21 GLN A 91 10.027 -2.519 5.258 1.00 0.00 H new ATOM 0 HE22 GLN A 91 10.072 -3.134 6.913 1.00 0.00 H new ATOM 1552 N LYS A 92 12.807 -2.202 0.978 1.00 0.00 N ATOM 1553 CA LYS A 92 13.128 -3.056 -0.202 1.00 0.00 C ATOM 1554 C LYS A 92 14.202 -2.389 -1.064 1.00 0.00 C ATOM 1555 O LYS A 92 15.080 -3.035 -1.601 1.00 0.00 O ATOM 1556 CB LYS A 92 11.819 -3.169 -0.980 1.00 0.00 C ATOM 1557 CG LYS A 92 12.017 -4.127 -2.154 1.00 0.00 C ATOM 1558 CD LYS A 92 10.742 -4.186 -2.994 1.00 0.00 C ATOM 1559 CE LYS A 92 10.946 -5.144 -4.170 1.00 0.00 C ATOM 1560 NZ LYS A 92 10.911 -6.508 -3.572 1.00 0.00 N ATOM 0 H LYS A 92 11.863 -1.816 0.986 1.00 0.00 H new ATOM 0 HA LYS A 92 13.515 -4.032 0.092 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.024 -3.532 -0.328 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.511 -2.188 -1.343 1.00 0.00 H new ATOM 0 HG2 LYS A 92 12.854 -3.795 -2.769 1.00 0.00 H new ATOM 0 HG3 LYS A 92 12.267 -5.122 -1.785 1.00 0.00 H new ATOM 0 HD2 LYS A 92 9.905 -4.520 -2.380 1.00 0.00 H new ATOM 0 HD3 LYS A 92 10.490 -3.191 -3.362 1.00 0.00 H new ATOM 0 HE2 LYS A 92 10.163 -5.022 -4.918 1.00 0.00 H new ATOM 0 HE3 LYS A 92 11.896 -4.957 -4.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 11.793 -7.009 -3.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 10.812 -6.432 -2.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 10.103 -7.036 -3.959 1.00 0.00 H new ATOM 1574 N ARG A 93 14.130 -1.093 -1.202 1.00 0.00 N ATOM 1575 CA ARG A 93 15.129 -0.356 -2.028 1.00 0.00 C ATOM 1576 C ARG A 93 16.517 -0.411 -1.381 1.00 0.00 C ATOM 1577 O ARG A 93 17.526 -0.276 -2.043 1.00 0.00 O ATOM 1578 CB ARG A 93 14.612 1.082 -2.076 1.00 0.00 C ATOM 1579 CG ARG A 93 15.440 1.893 -3.075 1.00 0.00 C ATOM 1580 CD ARG A 93 14.951 3.343 -3.085 1.00 0.00 C ATOM 1581 NE ARG A 93 15.702 3.993 -4.194 1.00 0.00 N ATOM 1582 CZ ARG A 93 16.891 4.482 -3.976 1.00 0.00 C ATOM 1583 NH1 ARG A 93 17.023 5.696 -3.516 1.00 0.00 N ATOM 1584 NH2 ARG A 93 17.949 3.755 -4.216 1.00 0.00 N ATOM 0 H ARG A 93 13.414 -0.507 -0.773 1.00 0.00 H new ATOM 0 HA ARG A 93 15.237 -0.788 -3.023 1.00 0.00 H new ATOM 0 HB2 ARG A 93 13.562 1.092 -2.367 1.00 0.00 H new ATOM 0 HB3 ARG A 93 14.673 1.534 -1.086 1.00 0.00 H new ATOM 0 HG2 ARG A 93 16.495 1.856 -2.804 1.00 0.00 H new ATOM 0 HG3 ARG A 93 15.352 1.461 -4.072 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.875 3.396 -3.252 1.00 0.00 H new ATOM 0 HD3 ARG A 93 15.150 3.834 -2.132 1.00 0.00 H new ATOM 0 HE ARG A 93 15.287 4.056 -5.124 1.00 0.00 H new ATOM 0 HH11 ARG A 93 16.196 6.262 -3.327 1.00 0.00 H new ATOM 0 HH12 ARG A 93 17.953 6.078 -3.345 1.00 0.00 H new ATOM 0 HH21 ARG A 93 17.845 2.805 -4.574 1.00 0.00 H new ATOM 0 HH22 ARG A 93 18.879 4.137 -4.046 1.00 0.00 H new ATOM 1598 N GLU A 94 16.577 -0.577 -0.088 1.00 0.00 N ATOM 1599 CA GLU A 94 17.903 -0.608 0.596 1.00 0.00 C ATOM 1600 C GLU A 94 18.802 -1.711 0.019 1.00 0.00 C ATOM 1601 O GLU A 94 19.960 -1.470 -0.251 1.00 0.00 O ATOM 1602 CB GLU A 94 17.583 -0.891 2.063 1.00 0.00 C ATOM 1603 CG GLU A 94 18.864 -0.782 2.895 1.00 0.00 C ATOM 1604 CD GLU A 94 18.571 -1.155 4.351 1.00 0.00 C ATOM 1605 OE1 GLU A 94 17.441 -1.515 4.640 1.00 0.00 O ATOM 1606 OE2 GLU A 94 19.485 -1.073 5.156 1.00 0.00 O ATOM 0 H GLU A 94 15.769 -0.692 0.523 1.00 0.00 H new ATOM 0 HA GLU A 94 18.446 0.328 0.462 1.00 0.00 H new ATOM 0 HB2 GLU A 94 16.839 -0.183 2.427 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.153 -1.887 2.167 1.00 0.00 H new ATOM 0 HG2 GLU A 94 19.630 -1.442 2.488 1.00 0.00 H new ATOM 0 HG3 GLU A 94 19.257 0.233 2.842 1.00 0.00 H new ATOM 1613 N GLN A 95 18.266 -2.906 -0.174 1.00 0.00 N ATOM 1614 CA GLN A 95 19.057 -4.071 -0.740 1.00 0.00 C ATOM 1615 C GLN A 95 20.580 -3.883 -0.592 1.00 0.00 C ATOM 1616 O GLN A 95 21.262 -3.484 -1.512 1.00 0.00 O ATOM 1617 CB GLN A 95 18.646 -4.157 -2.217 1.00 0.00 C ATOM 1618 CG GLN A 95 19.038 -2.878 -2.968 1.00 0.00 C ATOM 1619 CD GLN A 95 18.307 -2.836 -4.312 1.00 0.00 C ATOM 1620 OE1 GLN A 95 17.137 -3.152 -4.390 1.00 0.00 O ATOM 1621 NE2 GLN A 95 18.953 -2.457 -5.381 1.00 0.00 N ATOM 0 H GLN A 95 17.294 -3.129 0.041 1.00 0.00 H new ATOM 0 HA GLN A 95 18.838 -4.990 -0.197 1.00 0.00 H new ATOM 0 HB2 GLN A 95 19.125 -5.018 -2.683 1.00 0.00 H new ATOM 0 HB3 GLN A 95 17.570 -4.312 -2.291 1.00 0.00 H new ATOM 0 HG2 GLN A 95 18.782 -2.001 -2.374 1.00 0.00 H new ATOM 0 HG3 GLN A 95 20.116 -2.852 -3.126 1.00 0.00 H new ATOM 0 HE21 GLN A 95 19.936 -2.192 -5.316 1.00 0.00 H new ATOM 0 HE22 GLN A 95 18.475 -2.426 -6.282 1.00 0.00 H new ATOM 1630 N LYS A 96 21.116 -4.154 0.568 1.00 0.00 N ATOM 1631 CA LYS A 96 22.585 -3.968 0.763 1.00 0.00 C ATOM 1632 C LYS A 96 23.348 -5.252 0.411 1.00 0.00 C ATOM 1633 O LYS A 96 23.971 -5.341 -0.627 1.00 0.00 O ATOM 1634 CB LYS A 96 22.748 -3.605 2.242 1.00 0.00 C ATOM 1635 CG LYS A 96 24.184 -3.152 2.503 1.00 0.00 C ATOM 1636 CD LYS A 96 24.365 -2.853 3.994 1.00 0.00 C ATOM 1637 CE LYS A 96 25.738 -2.219 4.225 1.00 0.00 C ATOM 1638 NZ LYS A 96 26.084 -2.555 5.634 1.00 0.00 N ATOM 0 H LYS A 96 20.606 -4.493 1.383 1.00 0.00 H new ATOM 0 HA LYS A 96 22.992 -3.192 0.114 1.00 0.00 H new ATOM 0 HB2 LYS A 96 22.051 -2.811 2.511 1.00 0.00 H new ATOM 0 HB3 LYS A 96 22.508 -4.465 2.867 1.00 0.00 H new ATOM 0 HG2 LYS A 96 24.883 -3.927 2.190 1.00 0.00 H new ATOM 0 HG3 LYS A 96 24.409 -2.263 1.914 1.00 0.00 H new ATOM 0 HD2 LYS A 96 23.580 -2.180 4.339 1.00 0.00 H new ATOM 0 HD3 LYS A 96 24.275 -3.772 4.573 1.00 0.00 H new ATOM 0 HE2 LYS A 96 26.478 -2.617 3.531 1.00 0.00 H new ATOM 0 HE3 LYS A 96 25.706 -1.140 4.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 27.014 -2.154 5.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 25.365 -2.158 6.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 26.114 -3.588 5.747 1.00 0.00 H new ATOM 1652 N LYS A 97 23.302 -6.251 1.252 1.00 0.00 N ATOM 1653 CA LYS A 97 24.023 -7.519 0.935 1.00 0.00 C ATOM 1654 C LYS A 97 23.015 -8.616 0.608 1.00 0.00 C ATOM 1655 O LYS A 97 22.397 -9.189 1.485 1.00 0.00 O ATOM 1656 CB LYS A 97 24.815 -7.864 2.197 1.00 0.00 C ATOM 1657 CG LYS A 97 25.833 -6.755 2.475 1.00 0.00 C ATOM 1658 CD LYS A 97 26.960 -6.824 1.440 1.00 0.00 C ATOM 1659 CE LYS A 97 27.704 -5.485 1.401 1.00 0.00 C ATOM 1660 NZ LYS A 97 29.105 -5.827 1.024 1.00 0.00 N ATOM 0 H LYS A 97 22.800 -6.245 2.140 1.00 0.00 H new ATOM 0 HA LYS A 97 24.680 -7.419 0.071 1.00 0.00 H new ATOM 0 HB2 LYS A 97 24.139 -7.974 3.045 1.00 0.00 H new ATOM 0 HB3 LYS A 97 25.326 -8.819 2.070 1.00 0.00 H new ATOM 0 HG2 LYS A 97 25.346 -5.781 2.433 1.00 0.00 H new ATOM 0 HG3 LYS A 97 26.241 -6.865 3.480 1.00 0.00 H new ATOM 0 HD2 LYS A 97 27.651 -7.628 1.693 1.00 0.00 H new ATOM 0 HD3 LYS A 97 26.551 -7.053 0.456 1.00 0.00 H new ATOM 0 HE2 LYS A 97 27.256 -4.806 0.675 1.00 0.00 H new ATOM 0 HE3 LYS A 97 27.667 -4.986 2.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 29.674 -4.958 0.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 29.509 -6.468 1.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 29.110 -6.294 0.095 1.00 0.00 H new ATOM 1674 N ASP A 98 22.836 -8.906 -0.652 1.00 0.00 N ATOM 1675 CA ASP A 98 21.859 -9.958 -1.048 1.00 0.00 C ATOM 1676 C ASP A 98 20.519 -9.718 -0.345 1.00 0.00 C ATOM 1677 O ASP A 98 19.789 -10.643 -0.052 1.00 0.00 O ATOM 1678 CB ASP A 98 22.481 -11.276 -0.580 1.00 0.00 C ATOM 1679 CG ASP A 98 23.756 -11.558 -1.379 1.00 0.00 C ATOM 1680 OD1 ASP A 98 23.957 -10.905 -2.391 1.00 0.00 O ATOM 1681 OD2 ASP A 98 24.511 -12.422 -0.965 1.00 0.00 O ATOM 0 H ASP A 98 23.326 -8.458 -1.426 1.00 0.00 H new ATOM 0 HA ASP A 98 21.664 -9.960 -2.120 1.00 0.00 H new ATOM 0 HB2 ASP A 98 22.712 -11.223 0.484 1.00 0.00 H new ATOM 0 HB3 ASP A 98 21.770 -12.092 -0.712 1.00 0.00 H new ATOM 1686 N LYS A 99 20.193 -8.477 -0.075 1.00 0.00 N ATOM 1687 CA LYS A 99 18.898 -8.169 0.607 1.00 0.00 C ATOM 1688 C LYS A 99 18.720 -9.083 1.830 1.00 0.00 C ATOM 1689 O LYS A 99 18.216 -10.184 1.726 1.00 0.00 O ATOM 1690 CB LYS A 99 17.843 -8.452 -0.458 1.00 0.00 C ATOM 1691 CG LYS A 99 16.506 -7.824 -0.066 1.00 0.00 C ATOM 1692 CD LYS A 99 15.452 -8.210 -1.105 1.00 0.00 C ATOM 1693 CE LYS A 99 14.357 -7.144 -1.155 1.00 0.00 C ATOM 1694 NZ LYS A 99 14.228 -6.803 -2.600 1.00 0.00 N ATOM 0 H LYS A 99 20.768 -7.665 -0.298 1.00 0.00 H new ATOM 0 HA LYS A 99 18.837 -7.146 0.979 1.00 0.00 H new ATOM 0 HB2 LYS A 99 18.171 -8.054 -1.418 1.00 0.00 H new ATOM 0 HB3 LYS A 99 17.723 -9.528 -0.583 1.00 0.00 H new ATOM 0 HG2 LYS A 99 16.204 -8.168 0.923 1.00 0.00 H new ATOM 0 HG3 LYS A 99 16.601 -6.740 -0.011 1.00 0.00 H new ATOM 0 HD2 LYS A 99 15.916 -8.313 -2.086 1.00 0.00 H new ATOM 0 HD3 LYS A 99 15.018 -9.178 -0.854 1.00 0.00 H new ATOM 0 HE2 LYS A 99 13.418 -7.522 -0.752 1.00 0.00 H new ATOM 0 HE3 LYS A 99 14.628 -6.269 -0.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 13.911 -5.817 -2.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 15.150 -6.918 -3.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 13.533 -7.435 -3.045 1.00 0.00 H new ATOM 1708 N LYS A 100 19.146 -8.641 2.982 1.00 0.00 N ATOM 1709 CA LYS A 100 19.018 -9.495 4.197 1.00 0.00 C ATOM 1710 C LYS A 100 17.567 -9.546 4.671 1.00 0.00 C ATOM 1711 O LYS A 100 16.977 -8.546 5.029 1.00 0.00 O ATOM 1712 CB LYS A 100 19.908 -8.832 5.250 1.00 0.00 C ATOM 1713 CG LYS A 100 21.374 -8.937 4.822 1.00 0.00 C ATOM 1714 CD LYS A 100 22.268 -8.374 5.930 1.00 0.00 C ATOM 1715 CE LYS A 100 23.733 -8.419 5.485 1.00 0.00 C ATOM 1716 NZ LYS A 100 24.517 -8.478 6.750 1.00 0.00 N ATOM 0 H LYS A 100 19.576 -7.729 3.134 1.00 0.00 H new ATOM 0 HA LYS A 100 19.317 -10.525 4.003 1.00 0.00 H new ATOM 0 HB2 LYS A 100 19.628 -7.786 5.371 1.00 0.00 H new ATOM 0 HB3 LYS A 100 19.765 -9.314 6.217 1.00 0.00 H new ATOM 0 HG2 LYS A 100 21.633 -9.977 4.624 1.00 0.00 H new ATOM 0 HG3 LYS A 100 21.534 -8.386 3.895 1.00 0.00 H new ATOM 0 HD2 LYS A 100 21.979 -7.348 6.158 1.00 0.00 H new ATOM 0 HD3 LYS A 100 22.138 -8.953 6.845 1.00 0.00 H new ATOM 0 HE2 LYS A 100 23.929 -9.289 4.858 1.00 0.00 H new ATOM 0 HE3 LYS A 100 23.995 -7.538 4.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 25.532 -8.511 6.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 24.315 -7.634 7.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 24.251 -9.330 7.284 1.00 0.00 H new ATOM 1730 N LYS A 101 16.997 -10.716 4.674 1.00 0.00 N ATOM 1731 CA LYS A 101 15.586 -10.872 5.118 1.00 0.00 C ATOM 1732 C LYS A 101 15.358 -12.295 5.633 1.00 0.00 C ATOM 1733 O LYS A 101 14.751 -12.503 6.664 1.00 0.00 O ATOM 1734 CB LYS A 101 14.752 -10.611 3.864 1.00 0.00 C ATOM 1735 CG LYS A 101 14.691 -9.109 3.588 1.00 0.00 C ATOM 1736 CD LYS A 101 13.720 -8.842 2.437 1.00 0.00 C ATOM 1737 CE LYS A 101 13.610 -7.336 2.202 1.00 0.00 C ATOM 1738 NZ LYS A 101 12.568 -6.880 3.164 1.00 0.00 N ATOM 0 H LYS A 101 17.454 -11.581 4.384 1.00 0.00 H new ATOM 0 HA LYS A 101 15.323 -10.194 5.929 1.00 0.00 H new ATOM 0 HB2 LYS A 101 15.189 -11.130 3.011 1.00 0.00 H new ATOM 0 HB3 LYS A 101 13.745 -11.007 3.996 1.00 0.00 H new ATOM 0 HG2 LYS A 101 14.367 -8.577 4.482 1.00 0.00 H new ATOM 0 HG3 LYS A 101 15.683 -8.734 3.336 1.00 0.00 H new ATOM 0 HD2 LYS A 101 14.068 -9.338 1.531 1.00 0.00 H new ATOM 0 HD3 LYS A 101 12.740 -9.257 2.671 1.00 0.00 H new ATOM 0 HE2 LYS A 101 14.562 -6.836 2.382 1.00 0.00 H new ATOM 0 HE3 LYS A 101 13.324 -7.115 1.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 12.800 -5.924 3.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 11.642 -6.865 2.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 12.533 -7.532 3.973 1.00 0.00 H new ATOM 1752 N LYS A 102 15.848 -13.274 4.922 1.00 0.00 N ATOM 1753 CA LYS A 102 15.669 -14.684 5.369 1.00 0.00 C ATOM 1754 C LYS A 102 16.667 -15.003 6.485 1.00 0.00 C ATOM 1755 O LYS A 102 17.849 -14.747 6.362 1.00 0.00 O ATOM 1756 CB LYS A 102 15.957 -15.530 4.127 1.00 0.00 C ATOM 1757 CG LYS A 102 15.557 -16.981 4.392 1.00 0.00 C ATOM 1758 CD LYS A 102 14.032 -17.096 4.389 1.00 0.00 C ATOM 1759 CE LYS A 102 13.628 -18.565 4.541 1.00 0.00 C ATOM 1760 NZ LYS A 102 12.164 -18.534 4.813 1.00 0.00 N ATOM 0 H LYS A 102 16.365 -13.158 4.050 1.00 0.00 H new ATOM 0 HA LYS A 102 14.672 -14.876 5.766 1.00 0.00 H new ATOM 0 HB2 LYS A 102 15.404 -15.140 3.272 1.00 0.00 H new ATOM 0 HB3 LYS A 102 17.016 -15.474 3.874 1.00 0.00 H new ATOM 0 HG2 LYS A 102 15.983 -17.632 3.629 1.00 0.00 H new ATOM 0 HG3 LYS A 102 15.956 -17.310 5.352 1.00 0.00 H new ATOM 0 HD2 LYS A 102 13.611 -16.506 5.203 1.00 0.00 H new ATOM 0 HD3 LYS A 102 13.628 -16.691 3.461 1.00 0.00 H new ATOM 0 HE2 LYS A 102 13.850 -19.131 3.636 1.00 0.00 H new ATOM 0 HE3 LYS A 102 14.171 -19.042 5.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 11.812 -19.506 4.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 11.984 -17.994 5.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 11.672 -18.081 4.016 1.00 0.00 H new ATOM 1774 N LYS A 103 16.205 -15.553 7.573 1.00 0.00 N ATOM 1775 CA LYS A 103 17.137 -15.877 8.692 1.00 0.00 C ATOM 1776 C LYS A 103 18.051 -17.041 8.304 1.00 0.00 C ATOM 1777 O LYS A 103 17.618 -18.018 7.726 1.00 0.00 O ATOM 1778 CB LYS A 103 16.238 -16.270 9.865 1.00 0.00 C ATOM 1779 CG LYS A 103 17.093 -16.436 11.123 1.00 0.00 C ATOM 1780 CD LYS A 103 16.210 -16.872 12.295 1.00 0.00 C ATOM 1781 CE LYS A 103 17.030 -16.850 13.587 1.00 0.00 C ATOM 1782 NZ LYS A 103 16.237 -17.651 14.560 1.00 0.00 N ATOM 0 H LYS A 103 15.227 -15.792 7.737 1.00 0.00 H new ATOM 0 HA LYS A 103 17.784 -15.035 8.941 1.00 0.00 H new ATOM 0 HB2 LYS A 103 15.477 -15.507 10.027 1.00 0.00 H new ATOM 0 HB3 LYS A 103 15.715 -17.200 9.642 1.00 0.00 H new ATOM 0 HG2 LYS A 103 17.874 -17.177 10.948 1.00 0.00 H new ATOM 0 HG3 LYS A 103 17.592 -15.497 11.361 1.00 0.00 H new ATOM 0 HD2 LYS A 103 15.352 -16.206 12.385 1.00 0.00 H new ATOM 0 HD3 LYS A 103 15.819 -17.874 12.117 1.00 0.00 H new ATOM 0 HE2 LYS A 103 18.019 -17.281 13.434 1.00 0.00 H new ATOM 0 HE3 LYS A 103 17.178 -15.831 13.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 16.736 -17.682 15.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 15.303 -17.213 14.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 16.118 -18.619 14.198 1.00 0.00 H new ATOM 1796 N LYS A 104 19.312 -16.943 8.620 1.00 0.00 N ATOM 1797 CA LYS A 104 20.257 -18.043 8.271 1.00 0.00 C ATOM 1798 C LYS A 104 20.776 -18.723 9.543 1.00 0.00 C ATOM 1799 O LYS A 104 21.928 -19.124 9.549 1.00 0.00 O ATOM 1800 CB LYS A 104 21.399 -17.363 7.506 1.00 0.00 C ATOM 1801 CG LYS A 104 22.189 -16.445 8.447 1.00 0.00 C ATOM 1802 CD LYS A 104 23.247 -15.684 7.646 1.00 0.00 C ATOM 1803 CE LYS A 104 24.217 -14.994 8.608 1.00 0.00 C ATOM 1804 NZ LYS A 104 23.365 -14.082 9.422 1.00 0.00 N ATOM 1805 OXT LYS A 104 20.011 -18.832 10.487 1.00 0.00 O ATOM 0 H LYS A 104 19.730 -16.149 9.105 1.00 0.00 H new ATOM 0 HA LYS A 104 19.782 -18.822 7.674 1.00 0.00 H new ATOM 0 HB2 LYS A 104 22.061 -18.117 7.080 1.00 0.00 H new ATOM 0 HB3 LYS A 104 20.997 -16.785 6.674 1.00 0.00 H new ATOM 0 HG2 LYS A 104 21.515 -15.743 8.939 1.00 0.00 H new ATOM 0 HG3 LYS A 104 22.665 -17.033 9.232 1.00 0.00 H new ATOM 0 HD2 LYS A 104 23.790 -16.370 6.996 1.00 0.00 H new ATOM 0 HD3 LYS A 104 22.769 -14.945 7.002 1.00 0.00 H new ATOM 0 HE2 LYS A 104 24.733 -15.720 9.237 1.00 0.00 H new ATOM 0 HE3 LYS A 104 24.984 -14.440 8.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 23.947 -13.306 9.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 22.608 -13.690 8.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 22.944 -14.612 10.211 1.00 0.00 H new TER 1819 LYS A 104