USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 559 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: A2085 GLN : amide:sc= 0.729 K(o=1.6,f=-0.26) USER MOD Set 1.2: A2089 ASN : amide:sc= 0.849 K(o=1.6,f=-0.84) USER MOD Single : A2064 SER OG : rot 180:sc= 0 USER MOD Single : A2066 SER OG : rot 180:sc= 0.00498 USER MOD Single : A2069 GLN : amide:sc= 0.554 K(o=0.55,f=-0.03) USER MOD Single : A2074 THR OG1 : rot 80:sc= 0.342 USER MOD Single : A2076 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2077 SER OG : rot 87:sc= 0.416 USER MOD Single : A2079 SER OG : rot 180:sc= 0 USER MOD Single : A2080 SER OG : rot 180:sc= 0.452 USER MOD Single : A2082 GLN : amide:sc= -0.467 X(o=-0.47,f=-0.47) USER MOD Single : A2083 GLN : amide:sc= 0.96 K(o=0.96,f=-2.4!) USER MOD Single : A2084 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2086 GLN : amide:sc= 1.07 K(o=1.1,f=-6.1!) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 72:sc= 0.95 USER MOD Single : A2094 ASN : amide:sc= -0.0926 K(o=-0.093,f=-1) USER MOD Single : A2096 GLN : amide:sc= -3.5! C(o=-3.5!,f=-2!) USER MOD Single : A2098 MET CE :methyl 155:sc=-0.00197 (180deg=-0.0335) USER MOD Single : A2103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2104 GLN : amide:sc= 0.9 K(o=0.9,f=-0.031) USER MOD Single : A2106 THR OG1 : rot 180:sc= 0 USER MOD Single : A2108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 THR OG1 : rot -30:sc= 0.0759 USER MOD Single : B 20 SER OG : rot 59:sc= 0.11 USER MOD Single : B 24 LYS NZ :NH3+ -163:sc= 0.926 (180deg=0.749) USER MOD Single : B 44 MET CE :methyl 149:sc= 0 (180deg=-0.114) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 52 GLN : amide:sc= -0.0302 X(o=-0.03,f=-0.39) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 5.372 -4.767 -15.950 1.00 0.00 N ATOM 65 CA ILE A2063 6.187 -5.911 -16.403 1.00 0.00 C ATOM 66 C ILE A2063 5.515 -6.693 -17.545 1.00 0.00 C ATOM 67 O ILE A2063 4.301 -6.602 -17.746 1.00 0.00 O ATOM 68 CB ILE A2063 6.541 -6.840 -15.213 1.00 0.00 C ATOM 69 CG1 ILE A2063 5.297 -7.542 -14.617 1.00 0.00 C ATOM 70 CG2 ILE A2063 7.299 -6.052 -14.127 1.00 0.00 C ATOM 71 CD1 ILE A2063 5.626 -8.601 -13.558 1.00 0.00 C ATOM 0 HA ILE A2063 7.114 -5.506 -16.808 1.00 0.00 H new ATOM 0 HB ILE A2063 7.188 -7.627 -15.599 1.00 0.00 H new ATOM 0 HG12 ILE A2063 4.646 -6.789 -14.173 1.00 0.00 H new ATOM 0 HG13 ILE A2063 4.736 -8.013 -15.425 1.00 0.00 H new ATOM 0 HG21 ILE A2063 7.541 -6.716 -13.298 1.00 0.00 H new ATOM 0 HG22 ILE A2063 8.219 -5.646 -14.547 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.674 -5.235 -13.767 1.00 0.00 H new ATOM 0 HD11 ILE A2063 4.702 -9.046 -13.190 1.00 0.00 H new ATOM 0 HD12 ILE A2063 6.251 -9.376 -14.001 1.00 0.00 H new ATOM 0 HD13 ILE A2063 6.159 -8.134 -12.730 1.00 0.00 H new ATOM 83 N SER A2064 6.305 -7.488 -18.275 1.00 0.00 N ATOM 84 CA SER A2064 5.855 -8.351 -19.384 1.00 0.00 C ATOM 85 C SER A2064 6.608 -9.692 -19.360 1.00 0.00 C ATOM 86 O SER A2064 7.818 -9.690 -19.116 1.00 0.00 O ATOM 87 CB SER A2064 6.109 -7.677 -20.742 1.00 0.00 C ATOM 88 OG SER A2064 5.318 -6.509 -20.905 1.00 0.00 O ATOM 0 H SER A2064 7.309 -7.554 -18.108 1.00 0.00 H new ATOM 0 HA SER A2064 4.786 -8.520 -19.255 1.00 0.00 H new ATOM 0 HB2 SER A2064 7.164 -7.417 -20.827 1.00 0.00 H new ATOM 0 HB3 SER A2064 5.888 -8.381 -21.545 1.00 0.00 H new ATOM 0 HG SER A2064 5.506 -6.106 -21.778 1.00 0.00 H new ATOM 94 N PRO A2065 5.949 -10.841 -19.627 1.00 0.00 N ATOM 95 CA PRO A2065 6.595 -12.161 -19.603 1.00 0.00 C ATOM 96 C PRO A2065 7.686 -12.334 -20.671 1.00 0.00 C ATOM 97 O PRO A2065 8.618 -13.120 -20.488 1.00 0.00 O ATOM 98 CB PRO A2065 5.464 -13.181 -19.779 1.00 0.00 C ATOM 99 CG PRO A2065 4.372 -12.397 -20.505 1.00 0.00 C ATOM 100 CD PRO A2065 4.537 -10.979 -19.958 1.00 0.00 C ATOM 0 HA PRO A2065 7.127 -12.298 -18.662 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.790 -14.043 -20.360 1.00 0.00 H new ATOM 0 HB3 PRO A2065 5.113 -13.559 -18.818 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.505 -12.429 -21.586 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.381 -12.797 -20.293 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.235 -10.237 -20.697 1.00 0.00 H new ATOM 0 HD3 PRO A2065 3.913 -10.825 -19.078 1.00 0.00 H new ATOM 108 N SER A2066 7.592 -11.587 -21.774 1.00 0.00 N ATOM 109 CA SER A2066 8.555 -11.598 -22.880 1.00 0.00 C ATOM 110 C SER A2066 9.943 -11.086 -22.485 1.00 0.00 C ATOM 111 O SER A2066 10.947 -11.622 -22.953 1.00 0.00 O ATOM 112 CB SER A2066 8.003 -10.775 -24.049 1.00 0.00 C ATOM 113 OG SER A2066 7.606 -9.485 -23.605 1.00 0.00 O ATOM 0 H SER A2066 6.820 -10.938 -21.927 1.00 0.00 H new ATOM 0 HA SER A2066 8.686 -12.639 -23.175 1.00 0.00 H new ATOM 0 HB2 SER A2066 8.762 -10.681 -24.826 1.00 0.00 H new ATOM 0 HB3 SER A2066 7.152 -11.290 -24.495 1.00 0.00 H new ATOM 0 HG SER A2066 7.257 -8.971 -24.363 1.00 0.00 H new ATOM 119 N ALA A2067 10.028 -10.096 -21.589 1.00 0.00 N ATOM 120 CA ALA A2067 11.304 -9.565 -21.106 1.00 0.00 C ATOM 121 C ALA A2067 12.130 -10.626 -20.355 1.00 0.00 C ATOM 122 O ALA A2067 13.355 -10.641 -20.447 1.00 0.00 O ATOM 123 CB ALA A2067 11.030 -8.341 -20.232 1.00 0.00 C ATOM 0 H ALA A2067 9.212 -9.641 -21.179 1.00 0.00 H new ATOM 0 HA ALA A2067 11.909 -9.270 -21.963 1.00 0.00 H new ATOM 0 HB1 ALA A2067 11.974 -7.937 -19.866 1.00 0.00 H new ATOM 0 HB2 ALA A2067 10.514 -7.582 -20.820 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.407 -8.630 -19.386 1.00 0.00 H new ATOM 129 N LEU A2068 11.469 -11.556 -19.655 1.00 0.00 N ATOM 130 CA LEU A2068 12.139 -12.659 -18.963 1.00 0.00 C ATOM 131 C LEU A2068 12.717 -13.657 -19.981 1.00 0.00 C ATOM 132 O LEU A2068 13.813 -14.174 -19.778 1.00 0.00 O ATOM 133 CB LEU A2068 11.178 -13.339 -17.968 1.00 0.00 C ATOM 134 CG LEU A2068 10.719 -12.508 -16.750 1.00 0.00 C ATOM 135 CD1 LEU A2068 11.884 -11.858 -16.002 1.00 0.00 C ATOM 136 CD2 LEU A2068 9.706 -11.423 -17.113 1.00 0.00 C ATOM 0 H LEU A2068 10.454 -11.563 -19.554 1.00 0.00 H new ATOM 0 HA LEU A2068 12.973 -12.261 -18.385 1.00 0.00 H new ATOM 0 HB2 LEU A2068 10.290 -13.653 -18.517 1.00 0.00 H new ATOM 0 HB3 LEU A2068 11.660 -14.244 -17.597 1.00 0.00 H new ATOM 0 HG LEU A2068 10.237 -13.235 -16.096 1.00 0.00 H new ATOM 0 HD11 LEU A2068 11.500 -11.287 -15.156 1.00 0.00 H new ATOM 0 HD12 LEU A2068 12.561 -12.632 -15.640 1.00 0.00 H new ATOM 0 HD13 LEU A2068 12.422 -11.191 -16.676 1.00 0.00 H new ATOM 0 HD21 LEU A2068 9.423 -10.874 -16.215 1.00 0.00 H new ATOM 0 HD22 LEU A2068 10.151 -10.736 -17.833 1.00 0.00 H new ATOM 0 HD23 LEU A2068 8.821 -11.884 -17.551 1.00 0.00 H new ATOM 148 N GLN A2069 12.040 -13.874 -21.117 1.00 0.00 N ATOM 149 CA GLN A2069 12.576 -14.711 -22.202 1.00 0.00 C ATOM 150 C GLN A2069 13.796 -14.022 -22.849 1.00 0.00 C ATOM 151 O GLN A2069 14.764 -14.680 -23.233 1.00 0.00 O ATOM 152 CB GLN A2069 11.508 -15.031 -23.266 1.00 0.00 C ATOM 153 CG GLN A2069 10.114 -15.397 -22.726 1.00 0.00 C ATOM 154 CD GLN A2069 10.125 -16.352 -21.534 1.00 0.00 C ATOM 155 OE1 GLN A2069 10.646 -17.458 -21.584 1.00 0.00 O ATOM 156 NE2 GLN A2069 9.558 -15.953 -20.414 1.00 0.00 N ATOM 0 H GLN A2069 11.119 -13.481 -21.310 1.00 0.00 H new ATOM 0 HA GLN A2069 12.889 -15.659 -21.765 1.00 0.00 H new ATOM 0 HB2 GLN A2069 11.407 -14.168 -23.924 1.00 0.00 H new ATOM 0 HB3 GLN A2069 11.868 -15.858 -23.878 1.00 0.00 H new ATOM 0 HG2 GLN A2069 9.599 -14.481 -22.436 1.00 0.00 H new ATOM 0 HG3 GLN A2069 9.534 -15.848 -23.531 1.00 0.00 H new ATOM 0 HE21 GLN A2069 9.121 -15.033 -20.363 1.00 0.00 H new ATOM 0 HE22 GLN A2069 9.556 -16.564 -19.598 1.00 0.00 H new ATOM 165 N ASP A2070 13.781 -12.687 -22.922 1.00 0.00 N ATOM 166 CA ASP A2070 14.900 -11.876 -23.417 1.00 0.00 C ATOM 167 C ASP A2070 16.120 -11.969 -22.471 1.00 0.00 C ATOM 168 O ASP A2070 17.271 -11.956 -22.915 1.00 0.00 O ATOM 169 CB ASP A2070 14.423 -10.427 -23.618 1.00 0.00 C ATOM 170 CG ASP A2070 15.189 -9.722 -24.743 1.00 0.00 C ATOM 171 OD1 ASP A2070 15.101 -10.172 -25.908 1.00 0.00 O ATOM 172 OD2 ASP A2070 15.880 -8.711 -24.489 1.00 0.00 O ATOM 0 H ASP A2070 12.977 -12.129 -22.634 1.00 0.00 H new ATOM 0 HA ASP A2070 15.234 -12.263 -24.380 1.00 0.00 H new ATOM 0 HB2 ASP A2070 13.358 -10.425 -23.848 1.00 0.00 H new ATOM 0 HB3 ASP A2070 14.550 -9.871 -22.689 1.00 0.00 H new ATOM 177 N LEU A2071 15.891 -12.152 -21.163 1.00 0.00 N ATOM 178 CA LEU A2071 16.963 -12.421 -20.200 1.00 0.00 C ATOM 179 C LEU A2071 17.558 -13.814 -20.475 1.00 0.00 C ATOM 180 O LEU A2071 18.778 -13.973 -20.438 1.00 0.00 O ATOM 181 CB LEU A2071 16.436 -12.256 -18.761 1.00 0.00 C ATOM 182 CG LEU A2071 17.538 -12.292 -17.681 1.00 0.00 C ATOM 183 CD1 LEU A2071 17.108 -11.468 -16.467 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.838 -13.708 -17.174 1.00 0.00 C ATOM 0 H LEU A2071 14.961 -12.118 -20.746 1.00 0.00 H new ATOM 0 HA LEU A2071 17.771 -11.698 -20.315 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.900 -11.310 -18.687 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.715 -13.047 -18.556 1.00 0.00 H new ATOM 0 HG LEU A2071 18.432 -11.888 -18.156 1.00 0.00 H new ATOM 0 HD11 LEU A2071 17.892 -11.499 -15.710 1.00 0.00 H new ATOM 0 HD12 LEU A2071 16.937 -10.435 -16.770 1.00 0.00 H new ATOM 0 HD13 LEU A2071 16.188 -11.882 -16.054 1.00 0.00 H new ATOM 0 HD21 LEU A2071 18.621 -13.665 -16.417 1.00 0.00 H new ATOM 0 HD22 LEU A2071 16.936 -14.137 -16.739 1.00 0.00 H new ATOM 0 HD23 LEU A2071 18.171 -14.329 -18.005 1.00 0.00 H new ATOM 196 N LEU A2072 16.735 -14.817 -20.813 1.00 0.00 N ATOM 197 CA LEU A2072 17.237 -16.153 -21.157 1.00 0.00 C ATOM 198 C LEU A2072 18.128 -16.140 -22.410 1.00 0.00 C ATOM 199 O LEU A2072 19.177 -16.781 -22.376 1.00 0.00 O ATOM 200 CB LEU A2072 16.113 -17.197 -21.276 1.00 0.00 C ATOM 201 CG LEU A2072 15.325 -17.480 -19.981 1.00 0.00 C ATOM 202 CD1 LEU A2072 14.407 -18.680 -20.223 1.00 0.00 C ATOM 203 CD2 LEU A2072 16.211 -17.797 -18.773 1.00 0.00 C ATOM 0 H LEU A2072 15.720 -14.727 -20.855 1.00 0.00 H new ATOM 0 HA LEU A2072 17.864 -16.458 -20.320 1.00 0.00 H new ATOM 0 HB2 LEU A2072 15.412 -16.864 -22.041 1.00 0.00 H new ATOM 0 HB3 LEU A2072 16.547 -18.133 -21.628 1.00 0.00 H new ATOM 0 HG LEU A2072 14.773 -16.570 -19.745 1.00 0.00 H new ATOM 0 HD11 LEU A2072 13.842 -18.894 -19.316 1.00 0.00 H new ATOM 0 HD12 LEU A2072 13.717 -18.452 -21.036 1.00 0.00 H new ATOM 0 HD13 LEU A2072 15.008 -19.550 -20.490 1.00 0.00 H new ATOM 0 HD21 LEU A2072 15.584 -17.984 -17.901 1.00 0.00 H new ATOM 0 HD22 LEU A2072 16.812 -18.681 -18.985 1.00 0.00 H new ATOM 0 HD23 LEU A2072 16.868 -16.951 -18.572 1.00 0.00 H new ATOM 215 N ARG A2073 17.807 -15.394 -23.486 1.00 0.00 N ATOM 216 CA ARG A2073 18.725 -15.309 -24.653 1.00 0.00 C ATOM 217 C ARG A2073 20.100 -14.739 -24.257 1.00 0.00 C ATOM 218 O ARG A2073 21.124 -15.127 -24.821 1.00 0.00 O ATOM 219 CB ARG A2073 18.112 -14.573 -25.868 1.00 0.00 C ATOM 220 CG ARG A2073 17.965 -13.058 -25.700 1.00 0.00 C ATOM 221 CD ARG A2073 17.860 -12.268 -27.007 1.00 0.00 C ATOM 222 NE ARG A2073 17.693 -10.838 -26.694 1.00 0.00 N ATOM 223 CZ ARG A2073 18.629 -9.969 -26.354 1.00 0.00 C ATOM 224 NH1 ARG A2073 19.904 -10.184 -26.505 1.00 0.00 N ATOM 225 NH2 ARG A2073 18.308 -8.834 -25.819 1.00 0.00 N ATOM 0 H ARG A2073 16.946 -14.854 -23.577 1.00 0.00 H new ATOM 0 HA ARG A2073 18.882 -16.335 -24.987 1.00 0.00 H new ATOM 0 HB2 ARG A2073 18.732 -14.768 -26.743 1.00 0.00 H new ATOM 0 HB3 ARG A2073 17.129 -14.998 -26.073 1.00 0.00 H new ATOM 0 HG2 ARG A2073 17.077 -12.859 -25.101 1.00 0.00 H new ATOM 0 HG3 ARG A2073 18.820 -12.686 -25.136 1.00 0.00 H new ATOM 0 HD2 ARG A2073 18.755 -12.419 -27.610 1.00 0.00 H new ATOM 0 HD3 ARG A2073 17.015 -12.625 -27.595 1.00 0.00 H new ATOM 0 HE ARG A2073 16.741 -10.475 -26.746 1.00 0.00 H new ATOM 0 HH11 ARG A2073 20.229 -11.064 -26.906 1.00 0.00 H new ATOM 0 HH12 ARG A2073 20.578 -9.473 -26.223 1.00 0.00 H new ATOM 0 HH21 ARG A2073 17.327 -8.606 -25.657 1.00 0.00 H new ATOM 0 HH22 ARG A2073 19.036 -8.169 -25.559 1.00 0.00 H new ATOM 239 N THR A2074 20.119 -13.856 -23.254 1.00 0.00 N ATOM 240 CA THR A2074 21.330 -13.241 -22.686 1.00 0.00 C ATOM 241 C THR A2074 22.107 -14.271 -21.848 1.00 0.00 C ATOM 242 O THR A2074 23.324 -14.381 -21.991 1.00 0.00 O ATOM 243 CB THR A2074 20.963 -11.992 -21.862 1.00 0.00 C ATOM 244 OG1 THR A2074 20.191 -11.099 -22.642 1.00 0.00 O ATOM 245 CG2 THR A2074 22.180 -11.196 -21.406 1.00 0.00 C ATOM 0 H THR A2074 19.265 -13.537 -22.797 1.00 0.00 H new ATOM 0 HA THR A2074 21.981 -12.917 -23.498 1.00 0.00 H new ATOM 0 HB THR A2074 20.422 -12.370 -20.995 1.00 0.00 H new ATOM 0 HG1 THR A2074 19.261 -11.408 -22.669 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.853 -10.330 -20.831 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.815 -11.827 -20.783 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.744 -10.862 -22.277 1.00 0.00 H new ATOM 253 N LEU A2075 21.418 -15.083 -21.031 1.00 0.00 N ATOM 254 CA LEU A2075 22.005 -16.187 -20.248 1.00 0.00 C ATOM 255 C LEU A2075 22.618 -17.267 -21.162 1.00 0.00 C ATOM 256 O LEU A2075 23.699 -17.785 -20.880 1.00 0.00 O ATOM 257 CB LEU A2075 20.913 -16.787 -19.336 1.00 0.00 C ATOM 258 CG LEU A2075 21.311 -18.076 -18.584 1.00 0.00 C ATOM 259 CD1 LEU A2075 22.492 -17.869 -17.634 1.00 0.00 C ATOM 260 CD2 LEU A2075 20.117 -18.599 -17.785 1.00 0.00 C ATOM 0 H LEU A2075 20.412 -14.989 -20.892 1.00 0.00 H new ATOM 0 HA LEU A2075 22.818 -15.796 -19.636 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.622 -16.034 -18.603 1.00 0.00 H new ATOM 0 HB3 LEU A2075 20.033 -16.998 -19.943 1.00 0.00 H new ATOM 0 HG LEU A2075 21.618 -18.799 -19.340 1.00 0.00 H new ATOM 0 HD11 LEU A2075 22.726 -18.809 -17.134 1.00 0.00 H new ATOM 0 HD12 LEU A2075 23.360 -17.534 -18.201 1.00 0.00 H new ATOM 0 HD13 LEU A2075 22.232 -17.117 -16.889 1.00 0.00 H new ATOM 0 HD21 LEU A2075 20.403 -19.508 -17.256 1.00 0.00 H new ATOM 0 HD22 LEU A2075 19.803 -17.844 -17.064 1.00 0.00 H new ATOM 0 HD23 LEU A2075 19.293 -18.818 -18.464 1.00 0.00 H new ATOM 272 N LYS A2076 21.941 -17.596 -22.271 1.00 0.00 N ATOM 273 CA LYS A2076 22.380 -18.576 -23.287 1.00 0.00 C ATOM 274 C LYS A2076 23.564 -18.090 -24.155 1.00 0.00 C ATOM 275 O LYS A2076 23.953 -18.784 -25.097 1.00 0.00 O ATOM 276 CB LYS A2076 21.170 -18.987 -24.157 1.00 0.00 C ATOM 277 CG LYS A2076 20.073 -19.775 -23.409 1.00 0.00 C ATOM 278 CD LYS A2076 20.477 -21.165 -22.891 1.00 0.00 C ATOM 279 CE LYS A2076 20.842 -22.130 -24.027 1.00 0.00 C ATOM 280 NZ LYS A2076 21.127 -23.496 -23.512 1.00 0.00 N ATOM 0 H LYS A2076 21.040 -17.175 -22.498 1.00 0.00 H new ATOM 0 HA LYS A2076 22.764 -19.445 -22.753 1.00 0.00 H new ATOM 0 HB2 LYS A2076 20.725 -18.088 -24.584 1.00 0.00 H new ATOM 0 HB3 LYS A2076 21.528 -19.592 -24.990 1.00 0.00 H new ATOM 0 HG2 LYS A2076 19.737 -19.177 -22.562 1.00 0.00 H new ATOM 0 HG3 LYS A2076 19.219 -19.892 -24.076 1.00 0.00 H new ATOM 0 HD2 LYS A2076 21.327 -21.065 -22.216 1.00 0.00 H new ATOM 0 HD3 LYS A2076 19.656 -21.586 -22.310 1.00 0.00 H new ATOM 0 HE2 LYS A2076 20.023 -22.174 -24.745 1.00 0.00 H new ATOM 0 HE3 LYS A2076 21.714 -21.752 -24.561 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 21.370 -24.123 -24.306 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 21.924 -23.456 -22.845 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 20.286 -23.866 -23.024 1.00 0.00 H new ATOM 294 N SER A2077 24.158 -16.937 -23.833 1.00 0.00 N ATOM 295 CA SER A2077 25.311 -16.330 -24.518 1.00 0.00 C ATOM 296 C SER A2077 26.488 -16.124 -23.536 1.00 0.00 C ATOM 297 O SER A2077 26.256 -15.953 -22.334 1.00 0.00 O ATOM 298 CB SER A2077 24.888 -14.999 -25.153 1.00 0.00 C ATOM 299 OG SER A2077 23.860 -15.186 -26.113 1.00 0.00 O ATOM 0 H SER A2077 23.834 -16.371 -23.049 1.00 0.00 H new ATOM 0 HA SER A2077 25.652 -17.004 -25.304 1.00 0.00 H new ATOM 0 HB2 SER A2077 24.542 -14.317 -24.376 1.00 0.00 H new ATOM 0 HB3 SER A2077 25.750 -14.531 -25.628 1.00 0.00 H new ATOM 0 HG SER A2077 22.988 -15.164 -25.667 1.00 0.00 H new ATOM 305 N PRO A2078 27.757 -16.160 -23.996 1.00 0.00 N ATOM 306 CA PRO A2078 28.934 -16.063 -23.123 1.00 0.00 C ATOM 307 C PRO A2078 29.138 -14.681 -22.482 1.00 0.00 C ATOM 308 O PRO A2078 28.743 -13.648 -23.030 1.00 0.00 O ATOM 309 CB PRO A2078 30.126 -16.459 -24.002 1.00 0.00 C ATOM 310 CG PRO A2078 29.674 -16.063 -25.405 1.00 0.00 C ATOM 311 CD PRO A2078 28.175 -16.356 -25.378 1.00 0.00 C ATOM 0 HA PRO A2078 28.809 -16.721 -22.263 1.00 0.00 H new ATOM 0 HB2 PRO A2078 31.035 -15.933 -23.709 1.00 0.00 H new ATOM 0 HB3 PRO A2078 30.339 -17.526 -23.934 1.00 0.00 H new ATOM 0 HG2 PRO A2078 29.876 -15.012 -25.613 1.00 0.00 H new ATOM 0 HG3 PRO A2078 30.185 -16.644 -26.173 1.00 0.00 H new ATOM 0 HD2 PRO A2078 27.634 -15.688 -26.049 1.00 0.00 H new ATOM 0 HD3 PRO A2078 27.970 -17.374 -25.708 1.00 0.00 H new ATOM 319 N SER A2079 29.774 -14.671 -21.309 1.00 0.00 N ATOM 320 CA SER A2079 30.065 -13.477 -20.501 1.00 0.00 C ATOM 321 C SER A2079 30.960 -12.446 -21.208 1.00 0.00 C ATOM 322 O SER A2079 31.976 -12.791 -21.818 1.00 0.00 O ATOM 323 CB SER A2079 30.752 -13.892 -19.193 1.00 0.00 C ATOM 324 OG SER A2079 29.965 -14.841 -18.489 1.00 0.00 O ATOM 0 H SER A2079 30.116 -15.528 -20.875 1.00 0.00 H new ATOM 0 HA SER A2079 29.102 -13.000 -20.319 1.00 0.00 H new ATOM 0 HB2 SER A2079 31.732 -14.316 -19.411 1.00 0.00 H new ATOM 0 HB3 SER A2079 30.916 -13.014 -18.568 1.00 0.00 H new ATOM 0 HG SER A2079 30.422 -15.094 -17.659 1.00 0.00 H new ATOM 330 N SER A2080 30.598 -11.168 -21.076 1.00 0.00 N ATOM 331 CA SER A2080 31.313 -9.990 -21.595 1.00 0.00 C ATOM 332 C SER A2080 30.759 -8.715 -20.937 1.00 0.00 C ATOM 333 O SER A2080 29.650 -8.761 -20.385 1.00 0.00 O ATOM 334 CB SER A2080 31.152 -9.889 -23.125 1.00 0.00 C ATOM 335 OG SER A2080 29.827 -9.543 -23.486 1.00 0.00 O ATOM 0 H SER A2080 29.748 -10.908 -20.575 1.00 0.00 H new ATOM 0 HA SER A2080 32.372 -10.095 -21.359 1.00 0.00 H new ATOM 0 HB2 SER A2080 31.843 -9.143 -23.516 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.418 -10.841 -23.584 1.00 0.00 H new ATOM 0 HG SER A2080 29.758 -9.485 -24.462 1.00 0.00 H new ATOM 341 N PRO A2081 31.454 -7.559 -21.002 1.00 0.00 N ATOM 342 CA PRO A2081 30.916 -6.289 -20.498 1.00 0.00 C ATOM 343 C PRO A2081 29.562 -5.945 -21.149 1.00 0.00 C ATOM 344 O PRO A2081 28.670 -5.389 -20.508 1.00 0.00 O ATOM 345 CB PRO A2081 31.975 -5.227 -20.829 1.00 0.00 C ATOM 346 CG PRO A2081 33.261 -6.027 -21.025 1.00 0.00 C ATOM 347 CD PRO A2081 32.769 -7.355 -21.592 1.00 0.00 C ATOM 0 HA PRO A2081 30.722 -6.343 -19.427 1.00 0.00 H new ATOM 0 HB2 PRO A2081 31.712 -4.669 -21.728 1.00 0.00 H new ATOM 0 HB3 PRO A2081 32.077 -4.501 -20.022 1.00 0.00 H new ATOM 0 HG2 PRO A2081 33.945 -5.526 -21.710 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.796 -6.165 -20.085 1.00 0.00 H new ATOM 0 HD2 PRO A2081 32.711 -7.321 -22.680 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.447 -8.169 -21.334 1.00 0.00 H new ATOM 355 N GLN A2082 29.392 -6.338 -22.418 1.00 0.00 N ATOM 356 CA GLN A2082 28.155 -6.168 -23.188 1.00 0.00 C ATOM 357 C GLN A2082 27.040 -7.074 -22.637 1.00 0.00 C ATOM 358 O GLN A2082 25.914 -6.614 -22.444 1.00 0.00 O ATOM 359 CB GLN A2082 28.422 -6.478 -24.673 1.00 0.00 C ATOM 360 CG GLN A2082 29.154 -5.364 -25.442 1.00 0.00 C ATOM 361 CD GLN A2082 30.517 -4.974 -24.869 1.00 0.00 C ATOM 362 OE1 GLN A2082 30.690 -3.928 -24.258 1.00 0.00 O ATOM 363 NE2 GLN A2082 31.534 -5.794 -25.033 1.00 0.00 N ATOM 0 H GLN A2082 30.132 -6.795 -22.951 1.00 0.00 H new ATOM 0 HA GLN A2082 27.822 -5.134 -23.095 1.00 0.00 H new ATOM 0 HB2 GLN A2082 29.011 -7.393 -24.739 1.00 0.00 H new ATOM 0 HB3 GLN A2082 27.470 -6.675 -25.166 1.00 0.00 H new ATOM 0 HG2 GLN A2082 29.289 -5.684 -26.475 1.00 0.00 H new ATOM 0 HG3 GLN A2082 28.518 -4.479 -25.463 1.00 0.00 H new ATOM 0 HE21 GLN A2082 31.406 -6.670 -25.540 1.00 0.00 H new ATOM 0 HE22 GLN A2082 32.450 -5.553 -24.653 1.00 0.00 H new ATOM 372 N GLN A2083 27.346 -8.342 -22.332 1.00 0.00 N ATOM 373 CA GLN A2083 26.394 -9.294 -21.745 1.00 0.00 C ATOM 374 C GLN A2083 25.926 -8.823 -20.359 1.00 0.00 C ATOM 375 O GLN A2083 24.733 -8.844 -20.053 1.00 0.00 O ATOM 376 CB GLN A2083 27.039 -10.692 -21.658 1.00 0.00 C ATOM 377 CG GLN A2083 26.038 -11.803 -21.987 1.00 0.00 C ATOM 378 CD GLN A2083 25.712 -11.827 -23.482 1.00 0.00 C ATOM 379 OE1 GLN A2083 24.667 -11.383 -23.935 1.00 0.00 O ATOM 380 NE2 GLN A2083 26.604 -12.321 -24.311 1.00 0.00 N ATOM 0 H GLN A2083 28.272 -8.740 -22.488 1.00 0.00 H new ATOM 0 HA GLN A2083 25.516 -9.349 -22.389 1.00 0.00 H new ATOM 0 HB2 GLN A2083 27.882 -10.747 -22.347 1.00 0.00 H new ATOM 0 HB3 GLN A2083 27.437 -10.847 -20.655 1.00 0.00 H new ATOM 0 HG2 GLN A2083 26.448 -12.767 -21.686 1.00 0.00 H new ATOM 0 HG3 GLN A2083 25.123 -11.653 -21.415 1.00 0.00 H new ATOM 0 HE21 GLN A2083 27.482 -12.696 -23.951 1.00 0.00 H new ATOM 0 HE22 GLN A2083 26.419 -12.329 -25.314 1.00 0.00 H new ATOM 389 N GLN A2084 26.864 -8.343 -19.536 1.00 0.00 N ATOM 390 CA GLN A2084 26.593 -7.776 -18.212 1.00 0.00 C ATOM 391 C GLN A2084 25.625 -6.583 -18.323 1.00 0.00 C ATOM 392 O GLN A2084 24.629 -6.520 -17.599 1.00 0.00 O ATOM 393 CB GLN A2084 27.935 -7.382 -17.568 1.00 0.00 C ATOM 394 CG GLN A2084 27.801 -6.930 -16.106 1.00 0.00 C ATOM 395 CD GLN A2084 29.156 -6.516 -15.532 1.00 0.00 C ATOM 396 OE1 GLN A2084 29.566 -5.365 -15.598 1.00 0.00 O ATOM 397 NE2 GLN A2084 29.912 -7.431 -14.960 1.00 0.00 N ATOM 0 H GLN A2084 27.855 -8.338 -19.778 1.00 0.00 H new ATOM 0 HA GLN A2084 26.103 -8.512 -17.575 1.00 0.00 H new ATOM 0 HB2 GLN A2084 28.616 -8.232 -17.617 1.00 0.00 H new ATOM 0 HB3 GLN A2084 28.386 -6.578 -18.149 1.00 0.00 H new ATOM 0 HG2 GLN A2084 27.105 -6.094 -16.043 1.00 0.00 H new ATOM 0 HG3 GLN A2084 27.381 -7.740 -15.509 1.00 0.00 H new ATOM 0 HE21 GLN A2084 29.586 -8.395 -14.896 1.00 0.00 H new ATOM 0 HE22 GLN A2084 30.824 -7.175 -14.581 1.00 0.00 H new ATOM 406 N GLN A2085 25.877 -5.661 -19.263 1.00 0.00 N ATOM 407 CA GLN A2085 25.000 -4.512 -19.505 1.00 0.00 C ATOM 408 C GLN A2085 23.614 -4.942 -20.020 1.00 0.00 C ATOM 409 O GLN A2085 22.614 -4.374 -19.588 1.00 0.00 O ATOM 410 CB GLN A2085 25.692 -3.519 -20.457 1.00 0.00 C ATOM 411 CG GLN A2085 24.985 -2.155 -20.508 1.00 0.00 C ATOM 412 CD GLN A2085 24.972 -1.446 -19.150 1.00 0.00 C ATOM 413 OE1 GLN A2085 26.003 -1.126 -18.574 1.00 0.00 O ATOM 414 NE2 GLN A2085 23.819 -1.175 -18.578 1.00 0.00 N ATOM 0 H GLN A2085 26.693 -5.693 -19.874 1.00 0.00 H new ATOM 0 HA GLN A2085 24.822 -4.007 -18.555 1.00 0.00 H new ATOM 0 HB2 GLN A2085 26.725 -3.377 -20.139 1.00 0.00 H new ATOM 0 HB3 GLN A2085 25.723 -3.945 -21.460 1.00 0.00 H new ATOM 0 HG2 GLN A2085 25.482 -1.519 -21.241 1.00 0.00 H new ATOM 0 HG3 GLN A2085 23.960 -2.294 -20.851 1.00 0.00 H new ATOM 0 HE21 GLN A2085 22.947 -1.433 -19.040 1.00 0.00 H new ATOM 0 HE22 GLN A2085 23.797 -0.707 -17.672 1.00 0.00 H new ATOM 423 N GLN A2086 23.522 -5.957 -20.890 1.00 0.00 N ATOM 424 CA GLN A2086 22.244 -6.503 -21.372 1.00 0.00 C ATOM 425 C GLN A2086 21.372 -6.996 -20.208 1.00 0.00 C ATOM 426 O GLN A2086 20.205 -6.613 -20.131 1.00 0.00 O ATOM 427 CB GLN A2086 22.479 -7.642 -22.385 1.00 0.00 C ATOM 428 CG GLN A2086 22.731 -7.155 -23.819 1.00 0.00 C ATOM 429 CD GLN A2086 21.429 -6.825 -24.546 1.00 0.00 C ATOM 430 OE1 GLN A2086 20.806 -7.669 -25.178 1.00 0.00 O ATOM 431 NE2 GLN A2086 20.957 -5.597 -24.488 1.00 0.00 N ATOM 0 H GLN A2086 24.338 -6.426 -21.283 1.00 0.00 H new ATOM 0 HA GLN A2086 21.712 -5.695 -21.875 1.00 0.00 H new ATOM 0 HB2 GLN A2086 23.332 -8.236 -22.058 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.612 -8.302 -22.383 1.00 0.00 H new ATOM 0 HG2 GLN A2086 23.368 -6.271 -23.795 1.00 0.00 H new ATOM 0 HG3 GLN A2086 23.272 -7.922 -24.373 1.00 0.00 H new ATOM 0 HE21 GLN A2086 21.462 -4.881 -23.966 1.00 0.00 H new ATOM 0 HE22 GLN A2086 20.086 -5.362 -24.965 1.00 0.00 H new ATOM 440 N VAL A2087 21.929 -7.782 -19.273 1.00 0.00 N ATOM 441 CA VAL A2087 21.190 -8.250 -18.082 1.00 0.00 C ATOM 442 C VAL A2087 20.658 -7.056 -17.283 1.00 0.00 C ATOM 443 O VAL A2087 19.467 -7.008 -16.975 1.00 0.00 O ATOM 444 CB VAL A2087 22.052 -9.164 -17.185 1.00 0.00 C ATOM 445 CG1 VAL A2087 21.322 -9.564 -15.895 1.00 0.00 C ATOM 446 CG2 VAL A2087 22.427 -10.464 -17.906 1.00 0.00 C ATOM 0 H VAL A2087 22.894 -8.110 -19.317 1.00 0.00 H new ATOM 0 HA VAL A2087 20.348 -8.847 -18.433 1.00 0.00 H new ATOM 0 HB VAL A2087 22.942 -8.582 -16.947 1.00 0.00 H new ATOM 0 HG11 VAL A2087 21.967 -10.207 -15.296 1.00 0.00 H new ATOM 0 HG12 VAL A2087 21.072 -8.669 -15.326 1.00 0.00 H new ATOM 0 HG13 VAL A2087 20.407 -10.101 -16.146 1.00 0.00 H new ATOM 0 HG21 VAL A2087 23.034 -11.084 -17.246 1.00 0.00 H new ATOM 0 HG22 VAL A2087 21.520 -11.004 -18.178 1.00 0.00 H new ATOM 0 HG23 VAL A2087 22.994 -10.230 -18.807 1.00 0.00 H new ATOM 456 N LEU A2088 21.513 -6.070 -16.984 1.00 0.00 N ATOM 457 CA LEU A2088 21.108 -4.867 -16.248 1.00 0.00 C ATOM 458 C LEU A2088 20.015 -4.071 -16.977 1.00 0.00 C ATOM 459 O LEU A2088 19.056 -3.651 -16.334 1.00 0.00 O ATOM 460 CB LEU A2088 22.336 -3.987 -15.947 1.00 0.00 C ATOM 461 CG LEU A2088 23.330 -4.595 -14.937 1.00 0.00 C ATOM 462 CD1 LEU A2088 24.520 -3.650 -14.763 1.00 0.00 C ATOM 463 CD2 LEU A2088 22.701 -4.829 -13.561 1.00 0.00 C ATOM 0 H LEU A2088 22.499 -6.083 -17.244 1.00 0.00 H new ATOM 0 HA LEU A2088 20.671 -5.193 -15.304 1.00 0.00 H new ATOM 0 HB2 LEU A2088 22.862 -3.789 -16.881 1.00 0.00 H new ATOM 0 HB3 LEU A2088 21.993 -3.026 -15.565 1.00 0.00 H new ATOM 0 HG LEU A2088 23.641 -5.559 -15.338 1.00 0.00 H new ATOM 0 HD11 LEU A2088 25.224 -4.079 -14.049 1.00 0.00 H new ATOM 0 HD12 LEU A2088 25.017 -3.510 -15.723 1.00 0.00 H new ATOM 0 HD13 LEU A2088 24.169 -2.687 -14.393 1.00 0.00 H new ATOM 0 HD21 LEU A2088 23.444 -5.258 -12.889 1.00 0.00 H new ATOM 0 HD22 LEU A2088 22.350 -3.880 -13.155 1.00 0.00 H new ATOM 0 HD23 LEU A2088 21.860 -5.516 -13.657 1.00 0.00 H new ATOM 475 N ASN A2089 20.111 -3.888 -18.297 1.00 0.00 N ATOM 476 CA ASN A2089 19.107 -3.169 -19.092 1.00 0.00 C ATOM 477 C ASN A2089 17.740 -3.876 -19.058 1.00 0.00 C ATOM 478 O ASN A2089 16.716 -3.235 -18.816 1.00 0.00 O ATOM 479 CB ASN A2089 19.604 -3.016 -20.543 1.00 0.00 C ATOM 480 CG ASN A2089 20.785 -2.071 -20.714 1.00 0.00 C ATOM 481 OD1 ASN A2089 21.256 -1.413 -19.796 1.00 0.00 O ATOM 482 ND2 ASN A2089 21.300 -1.957 -21.916 1.00 0.00 N ATOM 0 H ASN A2089 20.894 -4.237 -18.850 1.00 0.00 H new ATOM 0 HA ASN A2089 18.970 -2.181 -18.652 1.00 0.00 H new ATOM 0 HB2 ASN A2089 19.884 -3.999 -20.922 1.00 0.00 H new ATOM 0 HB3 ASN A2089 18.779 -2.660 -21.160 1.00 0.00 H new ATOM 0 HD21 ASN A2089 22.084 -1.325 -22.077 1.00 0.00 H new ATOM 0 HD22 ASN A2089 20.916 -2.500 -22.689 1.00 0.00 H new ATOM 489 N ILE A2090 17.717 -5.195 -19.280 1.00 0.00 N ATOM 490 CA ILE A2090 16.490 -6.011 -19.262 1.00 0.00 C ATOM 491 C ILE A2090 15.834 -5.983 -17.869 1.00 0.00 C ATOM 492 O ILE A2090 14.617 -5.800 -17.760 1.00 0.00 O ATOM 493 CB ILE A2090 16.811 -7.445 -19.751 1.00 0.00 C ATOM 494 CG1 ILE A2090 17.259 -7.420 -21.235 1.00 0.00 C ATOM 495 CG2 ILE A2090 15.591 -8.371 -19.602 1.00 0.00 C ATOM 496 CD1 ILE A2090 18.003 -8.687 -21.674 1.00 0.00 C ATOM 0 H ILE A2090 18.558 -5.736 -19.480 1.00 0.00 H new ATOM 0 HA ILE A2090 15.758 -5.589 -19.950 1.00 0.00 H new ATOM 0 HB ILE A2090 17.620 -7.832 -19.131 1.00 0.00 H new ATOM 0 HG12 ILE A2090 16.382 -7.286 -21.868 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.904 -6.556 -21.397 1.00 0.00 H new ATOM 0 HG21 ILE A2090 15.848 -9.370 -19.954 1.00 0.00 H new ATOM 0 HG22 ILE A2090 15.297 -8.420 -18.554 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.763 -7.980 -20.193 1.00 0.00 H new ATOM 0 HD11 ILE A2090 18.285 -8.598 -22.723 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.899 -8.812 -21.066 1.00 0.00 H new ATOM 0 HD13 ILE A2090 17.354 -9.553 -21.545 1.00 0.00 H new ATOM 508 N LEU A2091 16.625 -6.101 -16.795 1.00 0.00 N ATOM 509 CA LEU A2091 16.128 -6.013 -15.417 1.00 0.00 C ATOM 510 C LEU A2091 15.618 -4.596 -15.093 1.00 0.00 C ATOM 511 O LEU A2091 14.511 -4.454 -14.578 1.00 0.00 O ATOM 512 CB LEU A2091 17.224 -6.466 -14.433 1.00 0.00 C ATOM 513 CG LEU A2091 17.540 -7.977 -14.460 1.00 0.00 C ATOM 514 CD1 LEU A2091 18.692 -8.263 -13.497 1.00 0.00 C ATOM 515 CD2 LEU A2091 16.358 -8.855 -14.040 1.00 0.00 C ATOM 0 H LEU A2091 17.630 -6.261 -16.858 1.00 0.00 H new ATOM 0 HA LEU A2091 15.276 -6.684 -15.310 1.00 0.00 H new ATOM 0 HB2 LEU A2091 18.138 -5.915 -14.652 1.00 0.00 H new ATOM 0 HB3 LEU A2091 16.921 -6.191 -13.423 1.00 0.00 H new ATOM 0 HG LEU A2091 17.790 -8.221 -15.492 1.00 0.00 H new ATOM 0 HD11 LEU A2091 18.921 -9.329 -13.510 1.00 0.00 H new ATOM 0 HD12 LEU A2091 19.572 -7.699 -13.805 1.00 0.00 H new ATOM 0 HD13 LEU A2091 18.405 -7.966 -12.488 1.00 0.00 H new ATOM 0 HD21 LEU A2091 16.651 -9.904 -14.082 1.00 0.00 H new ATOM 0 HD22 LEU A2091 16.060 -8.602 -13.022 1.00 0.00 H new ATOM 0 HD23 LEU A2091 15.520 -8.685 -14.716 1.00 0.00 H new ATOM 527 N LYS A2092 16.366 -3.535 -15.434 1.00 0.00 N ATOM 528 CA LYS A2092 15.954 -2.128 -15.230 1.00 0.00 C ATOM 529 C LYS A2092 14.707 -1.738 -16.034 1.00 0.00 C ATOM 530 O LYS A2092 14.026 -0.784 -15.662 1.00 0.00 O ATOM 531 CB LYS A2092 17.118 -1.164 -15.532 1.00 0.00 C ATOM 532 CG LYS A2092 18.229 -1.161 -14.462 1.00 0.00 C ATOM 533 CD LYS A2092 18.027 -0.139 -13.327 1.00 0.00 C ATOM 534 CE LYS A2092 16.843 -0.453 -12.401 1.00 0.00 C ATOM 535 NZ LYS A2092 16.738 0.538 -11.296 1.00 0.00 N ATOM 0 H LYS A2092 17.286 -3.626 -15.865 1.00 0.00 H new ATOM 0 HA LYS A2092 15.683 -2.041 -14.178 1.00 0.00 H new ATOM 0 HB2 LYS A2092 17.556 -1.431 -16.494 1.00 0.00 H new ATOM 0 HB3 LYS A2092 16.722 -0.153 -15.631 1.00 0.00 H new ATOM 0 HG2 LYS A2092 18.298 -2.158 -14.027 1.00 0.00 H new ATOM 0 HG3 LYS A2092 19.183 -0.959 -14.949 1.00 0.00 H new ATOM 0 HD2 LYS A2092 18.938 -0.091 -12.730 1.00 0.00 H new ATOM 0 HD3 LYS A2092 17.880 0.849 -13.764 1.00 0.00 H new ATOM 0 HE2 LYS A2092 15.919 -0.455 -12.978 1.00 0.00 H new ATOM 0 HE3 LYS A2092 16.961 -1.453 -11.984 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 15.928 0.297 -10.689 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 17.611 0.522 -10.731 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 16.601 1.489 -11.694 1.00 0.00 H new ATOM 549 N SER A2093 14.365 -2.489 -17.084 1.00 0.00 N ATOM 550 CA SER A2093 13.120 -2.316 -17.853 1.00 0.00 C ATOM 551 C SER A2093 11.903 -2.923 -17.125 1.00 0.00 C ATOM 552 O SER A2093 10.764 -2.721 -17.547 1.00 0.00 O ATOM 553 CB SER A2093 13.253 -2.939 -19.249 1.00 0.00 C ATOM 554 OG SER A2093 14.296 -2.317 -19.982 1.00 0.00 O ATOM 0 H SER A2093 14.951 -3.247 -17.433 1.00 0.00 H new ATOM 0 HA SER A2093 12.953 -1.243 -17.951 1.00 0.00 H new ATOM 0 HB2 SER A2093 13.453 -4.007 -19.158 1.00 0.00 H new ATOM 0 HB3 SER A2093 12.312 -2.836 -19.789 1.00 0.00 H new ATOM 0 HG SER A2093 15.162 -2.585 -19.610 1.00 0.00 H new ATOM 560 N ASN A2094 12.131 -3.649 -16.018 1.00 0.00 N ATOM 561 CA ASN A2094 11.135 -4.306 -15.164 1.00 0.00 C ATOM 562 C ASN A2094 11.475 -4.102 -13.657 1.00 0.00 C ATOM 563 O ASN A2094 11.666 -5.092 -12.940 1.00 0.00 O ATOM 564 CB ASN A2094 11.089 -5.802 -15.553 1.00 0.00 C ATOM 565 CG ASN A2094 10.707 -6.057 -17.001 1.00 0.00 C ATOM 566 OD1 ASN A2094 9.544 -6.221 -17.343 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.667 -6.126 -17.896 1.00 0.00 N ATOM 0 H ASN A2094 13.080 -3.801 -15.676 1.00 0.00 H new ATOM 0 HA ASN A2094 10.150 -3.865 -15.316 1.00 0.00 H new ATOM 0 HB2 ASN A2094 12.066 -6.245 -15.363 1.00 0.00 H new ATOM 0 HB3 ASN A2094 10.376 -6.313 -14.905 1.00 0.00 H new ATOM 0 HD21 ASN A2094 11.441 -6.316 -18.872 1.00 0.00 H new ATOM 0 HD22 ASN A2094 12.638 -5.990 -17.614 1.00 0.00 H new ATOM 574 N PRO A2095 11.585 -2.851 -13.144 1.00 0.00 N ATOM 575 CA PRO A2095 11.986 -2.570 -11.755 1.00 0.00 C ATOM 576 C PRO A2095 11.226 -3.338 -10.669 1.00 0.00 C ATOM 577 O PRO A2095 11.805 -3.717 -9.653 1.00 0.00 O ATOM 578 CB PRO A2095 11.819 -1.060 -11.557 1.00 0.00 C ATOM 579 CG PRO A2095 12.025 -0.516 -12.962 1.00 0.00 C ATOM 580 CD PRO A2095 11.357 -1.580 -13.827 1.00 0.00 C ATOM 0 HA PRO A2095 13.013 -2.914 -11.632 1.00 0.00 H new ATOM 0 HB2 PRO A2095 10.833 -0.809 -11.166 1.00 0.00 H new ATOM 0 HB3 PRO A2095 12.551 -0.660 -10.856 1.00 0.00 H new ATOM 0 HG2 PRO A2095 11.561 0.462 -13.091 1.00 0.00 H new ATOM 0 HG3 PRO A2095 13.082 -0.402 -13.202 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.291 -1.381 -13.937 1.00 0.00 H new ATOM 0 HD3 PRO A2095 11.784 -1.593 -14.830 1.00 0.00 H new ATOM 588 N GLN A2096 9.931 -3.576 -10.892 1.00 0.00 N ATOM 589 CA GLN A2096 9.025 -4.256 -9.963 1.00 0.00 C ATOM 590 C GLN A2096 9.567 -5.614 -9.483 1.00 0.00 C ATOM 591 O GLN A2096 9.580 -5.884 -8.280 1.00 0.00 O ATOM 592 CB GLN A2096 7.647 -4.445 -10.627 1.00 0.00 C ATOM 593 CG GLN A2096 6.867 -3.156 -10.963 1.00 0.00 C ATOM 594 CD GLN A2096 7.519 -2.260 -12.015 1.00 0.00 C ATOM 595 OE1 GLN A2096 7.929 -1.137 -11.762 1.00 0.00 O ATOM 596 NE2 GLN A2096 7.700 -2.740 -13.228 1.00 0.00 N ATOM 0 H GLN A2096 9.468 -3.290 -11.755 1.00 0.00 H new ATOM 0 HA GLN A2096 8.935 -3.622 -9.081 1.00 0.00 H new ATOM 0 HB2 GLN A2096 7.786 -5.011 -11.548 1.00 0.00 H new ATOM 0 HB3 GLN A2096 7.030 -5.056 -9.968 1.00 0.00 H new ATOM 0 HG2 GLN A2096 5.871 -3.432 -11.310 1.00 0.00 H new ATOM 0 HG3 GLN A2096 6.737 -2.579 -10.047 1.00 0.00 H new ATOM 0 HE21 GLN A2096 7.366 -3.675 -13.462 1.00 0.00 H new ATOM 0 HE22 GLN A2096 8.174 -2.177 -13.934 1.00 0.00 H new ATOM 605 N LEU A2097 10.027 -6.461 -10.415 1.00 0.00 N ATOM 606 CA LEU A2097 10.576 -7.785 -10.101 1.00 0.00 C ATOM 607 C LEU A2097 12.062 -7.776 -9.701 1.00 0.00 C ATOM 608 O LEU A2097 12.448 -8.540 -8.813 1.00 0.00 O ATOM 609 CB LEU A2097 10.194 -8.811 -11.192 1.00 0.00 C ATOM 610 CG LEU A2097 10.507 -8.505 -12.672 1.00 0.00 C ATOM 611 CD1 LEU A2097 11.978 -8.675 -13.055 1.00 0.00 C ATOM 612 CD2 LEU A2097 9.703 -9.461 -13.556 1.00 0.00 C ATOM 0 H LEU A2097 10.028 -6.245 -11.412 1.00 0.00 H new ATOM 0 HA LEU A2097 10.097 -8.125 -9.183 1.00 0.00 H new ATOM 0 HB2 LEU A2097 10.687 -9.751 -10.942 1.00 0.00 H new ATOM 0 HB3 LEU A2097 9.121 -8.984 -11.115 1.00 0.00 H new ATOM 0 HG LEU A2097 10.245 -7.457 -12.819 1.00 0.00 H new ATOM 0 HD11 LEU A2097 12.108 -8.440 -14.111 1.00 0.00 H new ATOM 0 HD12 LEU A2097 12.590 -8.002 -12.455 1.00 0.00 H new ATOM 0 HD13 LEU A2097 12.285 -9.705 -12.872 1.00 0.00 H new ATOM 0 HD21 LEU A2097 9.917 -9.254 -14.605 1.00 0.00 H new ATOM 0 HD22 LEU A2097 9.980 -10.490 -13.326 1.00 0.00 H new ATOM 0 HD23 LEU A2097 8.638 -9.322 -13.368 1.00 0.00 H new ATOM 624 N MET A2098 12.899 -6.907 -10.289 1.00 0.00 N ATOM 625 CA MET A2098 14.328 -6.870 -9.937 1.00 0.00 C ATOM 626 C MET A2098 14.601 -6.255 -8.562 1.00 0.00 C ATOM 627 O MET A2098 15.493 -6.734 -7.862 1.00 0.00 O ATOM 628 CB MET A2098 15.202 -6.254 -11.045 1.00 0.00 C ATOM 629 CG MET A2098 14.991 -4.785 -11.443 1.00 0.00 C ATOM 630 SD MET A2098 15.298 -3.443 -10.252 1.00 0.00 S ATOM 631 CE MET A2098 16.956 -3.831 -9.634 1.00 0.00 C ATOM 0 H MET A2098 12.618 -6.231 -10.999 1.00 0.00 H new ATOM 0 HA MET A2098 14.630 -7.914 -9.856 1.00 0.00 H new ATOM 0 HB2 MET A2098 16.243 -6.364 -10.740 1.00 0.00 H new ATOM 0 HB3 MET A2098 15.067 -6.859 -11.942 1.00 0.00 H new ATOM 0 HG2 MET A2098 15.623 -4.594 -12.310 1.00 0.00 H new ATOM 0 HG3 MET A2098 13.957 -4.688 -11.775 1.00 0.00 H new ATOM 0 HE1 MET A2098 17.432 -2.919 -9.273 1.00 0.00 H new ATOM 0 HE2 MET A2098 16.881 -4.549 -8.817 1.00 0.00 H new ATOM 0 HE3 MET A2098 17.554 -4.259 -10.439 1.00 0.00 H new ATOM 641 N ALA A2099 13.845 -5.232 -8.148 1.00 0.00 N ATOM 642 CA ALA A2099 14.043 -4.579 -6.856 1.00 0.00 C ATOM 643 C ALA A2099 13.717 -5.520 -5.685 1.00 0.00 C ATOM 644 O ALA A2099 14.426 -5.522 -4.679 1.00 0.00 O ATOM 645 CB ALA A2099 13.236 -3.284 -6.807 1.00 0.00 C ATOM 0 H ALA A2099 13.083 -4.837 -8.699 1.00 0.00 H new ATOM 0 HA ALA A2099 15.097 -4.325 -6.747 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.385 -2.799 -5.842 1.00 0.00 H new ATOM 0 HB2 ALA A2099 13.568 -2.618 -7.604 1.00 0.00 H new ATOM 0 HB3 ALA A2099 12.178 -3.509 -6.940 1.00 0.00 H new ATOM 651 N ALA A2100 12.692 -6.366 -5.832 1.00 0.00 N ATOM 652 CA ALA A2100 12.352 -7.366 -4.826 1.00 0.00 C ATOM 653 C ALA A2100 13.500 -8.382 -4.672 1.00 0.00 C ATOM 654 O ALA A2100 13.988 -8.588 -3.560 1.00 0.00 O ATOM 655 CB ALA A2100 11.028 -8.035 -5.213 1.00 0.00 C ATOM 0 H ALA A2100 12.081 -6.374 -6.648 1.00 0.00 H new ATOM 0 HA ALA A2100 12.220 -6.892 -3.853 1.00 0.00 H new ATOM 0 HB1 ALA A2100 10.767 -8.784 -4.466 1.00 0.00 H new ATOM 0 HB2 ALA A2100 10.241 -7.282 -5.263 1.00 0.00 H new ATOM 0 HB3 ALA A2100 11.134 -8.515 -6.186 1.00 0.00 H new ATOM 661 N PHE A2101 13.964 -8.974 -5.781 1.00 0.00 N ATOM 662 CA PHE A2101 15.061 -9.949 -5.797 1.00 0.00 C ATOM 663 C PHE A2101 16.390 -9.385 -5.271 1.00 0.00 C ATOM 664 O PHE A2101 16.972 -9.974 -4.356 1.00 0.00 O ATOM 665 CB PHE A2101 15.237 -10.487 -7.225 1.00 0.00 C ATOM 666 CG PHE A2101 16.502 -11.305 -7.435 1.00 0.00 C ATOM 667 CD1 PHE A2101 16.630 -12.579 -6.848 1.00 0.00 C ATOM 668 CD2 PHE A2101 17.574 -10.772 -8.180 1.00 0.00 C ATOM 669 CE1 PHE A2101 17.820 -13.314 -7.004 1.00 0.00 C ATOM 670 CE2 PHE A2101 18.763 -11.508 -8.337 1.00 0.00 C ATOM 671 CZ PHE A2101 18.887 -12.778 -7.748 1.00 0.00 C ATOM 0 H PHE A2101 13.581 -8.785 -6.707 1.00 0.00 H new ATOM 0 HA PHE A2101 14.787 -10.754 -5.116 1.00 0.00 H new ATOM 0 HB2 PHE A2101 14.374 -11.103 -7.477 1.00 0.00 H new ATOM 0 HB3 PHE A2101 15.243 -9.647 -7.919 1.00 0.00 H new ATOM 0 HD1 PHE A2101 15.812 -12.993 -6.276 1.00 0.00 H new ATOM 0 HD2 PHE A2101 17.482 -9.795 -8.632 1.00 0.00 H new ATOM 0 HE1 PHE A2101 17.914 -14.290 -6.552 1.00 0.00 H new ATOM 0 HE2 PHE A2101 19.581 -11.097 -8.910 1.00 0.00 H new ATOM 0 HZ PHE A2101 19.800 -13.342 -7.866 1.00 0.00 H new ATOM 681 N ILE A2102 16.868 -8.250 -5.801 1.00 0.00 N ATOM 682 CA ILE A2102 18.143 -7.653 -5.366 1.00 0.00 C ATOM 683 C ILE A2102 18.115 -7.348 -3.868 1.00 0.00 C ATOM 684 O ILE A2102 19.076 -7.657 -3.171 1.00 0.00 O ATOM 685 CB ILE A2102 18.532 -6.432 -6.235 1.00 0.00 C ATOM 686 CG1 ILE A2102 20.040 -6.098 -6.248 1.00 0.00 C ATOM 687 CG2 ILE A2102 17.753 -5.150 -5.911 1.00 0.00 C ATOM 688 CD1 ILE A2102 20.751 -5.864 -4.909 1.00 0.00 C ATOM 0 H ILE A2102 16.391 -7.724 -6.533 1.00 0.00 H new ATOM 0 HA ILE A2102 18.936 -8.384 -5.521 1.00 0.00 H new ATOM 0 HB ILE A2102 18.249 -6.775 -7.230 1.00 0.00 H new ATOM 0 HG12 ILE A2102 20.555 -6.912 -6.759 1.00 0.00 H new ATOM 0 HG13 ILE A2102 20.176 -5.204 -6.856 1.00 0.00 H new ATOM 0 HG21 ILE A2102 18.088 -4.345 -6.566 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.688 -5.323 -6.065 1.00 0.00 H new ATOM 0 HG23 ILE A2102 17.929 -4.870 -4.872 1.00 0.00 H new ATOM 0 HD11 ILE A2102 21.803 -5.641 -5.090 1.00 0.00 H new ATOM 0 HD12 ILE A2102 20.286 -5.025 -4.392 1.00 0.00 H new ATOM 0 HD13 ILE A2102 20.671 -6.760 -4.293 1.00 0.00 H new ATOM 700 N LYS A2103 17.015 -6.809 -3.327 1.00 0.00 N ATOM 701 CA LYS A2103 16.941 -6.522 -1.889 1.00 0.00 C ATOM 702 C LYS A2103 16.965 -7.789 -1.014 1.00 0.00 C ATOM 703 O LYS A2103 17.482 -7.721 0.100 1.00 0.00 O ATOM 704 CB LYS A2103 15.788 -5.556 -1.583 1.00 0.00 C ATOM 705 CG LYS A2103 16.116 -4.156 -2.143 1.00 0.00 C ATOM 706 CD LYS A2103 15.107 -3.073 -1.738 1.00 0.00 C ATOM 707 CE LYS A2103 15.270 -2.709 -0.256 1.00 0.00 C ATOM 708 NZ LYS A2103 14.370 -1.600 0.153 1.00 0.00 N ATOM 0 H LYS A2103 16.176 -6.566 -3.854 1.00 0.00 H new ATOM 0 HA LYS A2103 17.856 -6.002 -1.606 1.00 0.00 H new ATOM 0 HB2 LYS A2103 14.863 -5.927 -2.025 1.00 0.00 H new ATOM 0 HB3 LYS A2103 15.626 -5.498 -0.507 1.00 0.00 H new ATOM 0 HG2 LYS A2103 17.108 -3.861 -1.800 1.00 0.00 H new ATOM 0 HG3 LYS A2103 16.158 -4.211 -3.231 1.00 0.00 H new ATOM 0 HD2 LYS A2103 15.251 -2.185 -2.354 1.00 0.00 H new ATOM 0 HD3 LYS A2103 14.092 -3.427 -1.922 1.00 0.00 H new ATOM 0 HE2 LYS A2103 15.063 -3.587 0.357 1.00 0.00 H new ATOM 0 HE3 LYS A2103 16.305 -2.424 -0.066 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 14.515 -1.389 1.161 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 14.583 -0.753 -0.412 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 13.381 -1.880 -0.003 1.00 0.00 H new ATOM 722 N GLN A2104 16.530 -8.955 -1.513 1.00 0.00 N ATOM 723 CA GLN A2104 16.714 -10.221 -0.775 1.00 0.00 C ATOM 724 C GLN A2104 18.198 -10.637 -0.825 1.00 0.00 C ATOM 725 O GLN A2104 18.778 -11.045 0.184 1.00 0.00 O ATOM 726 CB GLN A2104 15.866 -11.386 -1.335 1.00 0.00 C ATOM 727 CG GLN A2104 14.355 -11.173 -1.512 1.00 0.00 C ATOM 728 CD GLN A2104 13.711 -10.280 -0.455 1.00 0.00 C ATOM 729 OE1 GLN A2104 13.525 -10.658 0.694 1.00 0.00 O ATOM 730 NE2 GLN A2104 13.344 -9.069 -0.811 1.00 0.00 N ATOM 0 H GLN A2104 16.055 -9.052 -2.410 1.00 0.00 H new ATOM 0 HA GLN A2104 16.384 -10.031 0.246 1.00 0.00 H new ATOM 0 HB2 GLN A2104 16.278 -11.659 -2.306 1.00 0.00 H new ATOM 0 HB3 GLN A2104 16.005 -12.244 -0.677 1.00 0.00 H new ATOM 0 HG2 GLN A2104 14.175 -10.738 -2.495 1.00 0.00 H new ATOM 0 HG3 GLN A2104 13.860 -12.144 -1.498 1.00 0.00 H new ATOM 0 HE21 GLN A2104 13.497 -8.750 -1.768 1.00 0.00 H new ATOM 0 HE22 GLN A2104 12.906 -8.448 -0.131 1.00 0.00 H new ATOM 739 N ARG A2105 18.820 -10.518 -2.009 1.00 0.00 N ATOM 740 CA ARG A2105 20.225 -10.866 -2.293 1.00 0.00 C ATOM 741 C ARG A2105 21.221 -9.991 -1.518 1.00 0.00 C ATOM 742 O ARG A2105 22.164 -10.530 -0.946 1.00 0.00 O ATOM 743 CB ARG A2105 20.437 -10.797 -3.825 1.00 0.00 C ATOM 744 CG ARG A2105 21.309 -11.907 -4.445 1.00 0.00 C ATOM 745 CD ARG A2105 22.821 -11.758 -4.235 1.00 0.00 C ATOM 746 NE ARG A2105 23.299 -12.403 -2.995 1.00 0.00 N ATOM 747 CZ ARG A2105 24.033 -13.502 -2.904 1.00 0.00 C ATOM 748 NH1 ARG A2105 24.302 -14.275 -3.921 1.00 0.00 N ATOM 749 NH2 ARG A2105 24.536 -13.869 -1.758 1.00 0.00 N ATOM 0 H ARG A2105 18.337 -10.160 -2.833 1.00 0.00 H new ATOM 0 HA ARG A2105 20.424 -11.879 -1.945 1.00 0.00 H new ATOM 0 HB2 ARG A2105 19.460 -10.821 -4.307 1.00 0.00 H new ATOM 0 HB3 ARG A2105 20.888 -9.834 -4.065 1.00 0.00 H new ATOM 0 HG2 ARG A2105 20.995 -12.865 -4.030 1.00 0.00 H new ATOM 0 HG3 ARG A2105 21.111 -11.944 -5.516 1.00 0.00 H new ATOM 0 HD2 ARG A2105 23.345 -12.190 -5.088 1.00 0.00 H new ATOM 0 HD3 ARG A2105 23.076 -10.698 -4.208 1.00 0.00 H new ATOM 0 HE ARG A2105 23.036 -11.955 -2.117 1.00 0.00 H new ATOM 0 HH11 ARG A2105 23.941 -14.044 -4.847 1.00 0.00 H new ATOM 0 HH12 ARG A2105 24.874 -15.110 -3.790 1.00 0.00 H new ATOM 0 HH21 ARG A2105 24.365 -13.308 -0.923 1.00 0.00 H new ATOM 0 HH22 ARG A2105 25.100 -14.717 -1.697 1.00 0.00 H new ATOM 763 N THR A2106 21.018 -8.669 -1.470 1.00 0.00 N ATOM 764 CA THR A2106 21.893 -7.693 -0.781 1.00 0.00 C ATOM 765 C THR A2106 21.987 -7.933 0.727 1.00 0.00 C ATOM 766 O THR A2106 23.074 -7.868 1.301 1.00 0.00 O ATOM 767 CB THR A2106 21.512 -6.236 -1.111 1.00 0.00 C ATOM 768 OG1 THR A2106 22.632 -5.412 -0.905 1.00 0.00 O ATOM 769 CG2 THR A2106 20.379 -5.633 -0.282 1.00 0.00 C ATOM 0 H THR A2106 20.217 -8.228 -1.922 1.00 0.00 H new ATOM 0 HA THR A2106 22.895 -7.860 -1.176 1.00 0.00 H new ATOM 0 HB THR A2106 21.166 -6.277 -2.144 1.00 0.00 H new ATOM 0 HG1 THR A2106 22.398 -4.484 -1.114 1.00 0.00 H new ATOM 0 HG21 THR A2106 20.200 -4.607 -0.603 1.00 0.00 H new ATOM 0 HG22 THR A2106 19.472 -6.221 -0.423 1.00 0.00 H new ATOM 0 HG23 THR A2106 20.656 -5.641 0.772 1.00 0.00 H new ATOM 777 N ALA A2107 20.873 -8.317 1.368 1.00 0.00 N ATOM 778 CA ALA A2107 20.817 -8.674 2.792 1.00 0.00 C ATOM 779 C ALA A2107 21.690 -9.905 3.148 1.00 0.00 C ATOM 780 O ALA A2107 21.930 -10.184 4.325 1.00 0.00 O ATOM 781 CB ALA A2107 19.346 -8.894 3.170 1.00 0.00 C ATOM 0 H ALA A2107 19.969 -8.389 0.901 1.00 0.00 H new ATOM 0 HA ALA A2107 21.239 -7.855 3.374 1.00 0.00 H new ATOM 0 HB1 ALA A2107 19.277 -9.161 4.225 1.00 0.00 H new ATOM 0 HB2 ALA A2107 18.783 -7.978 2.990 1.00 0.00 H new ATOM 0 HB3 ALA A2107 18.931 -9.700 2.564 1.00 0.00 H new ATOM 787 N LYS A2108 22.172 -10.626 2.125 1.00 0.00 N ATOM 788 CA LYS A2108 23.023 -11.828 2.177 1.00 0.00 C ATOM 789 C LYS A2108 24.283 -11.685 1.297 1.00 0.00 C ATOM 790 O LYS A2108 24.892 -12.676 0.895 1.00 0.00 O ATOM 791 CB LYS A2108 22.166 -13.033 1.755 1.00 0.00 C ATOM 792 CG LYS A2108 20.916 -13.290 2.622 1.00 0.00 C ATOM 793 CD LYS A2108 21.241 -13.657 4.079 1.00 0.00 C ATOM 794 CE LYS A2108 19.949 -13.791 4.896 1.00 0.00 C ATOM 795 NZ LYS A2108 20.230 -14.172 6.306 1.00 0.00 N ATOM 0 H LYS A2108 21.961 -10.364 1.162 1.00 0.00 H new ATOM 0 HA LYS A2108 23.391 -11.972 3.193 1.00 0.00 H new ATOM 0 HB2 LYS A2108 21.848 -12.888 0.723 1.00 0.00 H new ATOM 0 HB3 LYS A2108 22.791 -13.926 1.774 1.00 0.00 H new ATOM 0 HG2 LYS A2108 20.288 -12.399 2.612 1.00 0.00 H new ATOM 0 HG3 LYS A2108 20.333 -14.095 2.175 1.00 0.00 H new ATOM 0 HD2 LYS A2108 21.797 -14.594 4.110 1.00 0.00 H new ATOM 0 HD3 LYS A2108 21.880 -12.892 4.520 1.00 0.00 H new ATOM 0 HE2 LYS A2108 19.405 -12.847 4.875 1.00 0.00 H new ATOM 0 HE3 LYS A2108 19.304 -14.541 4.438 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 19.335 -14.254 6.829 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 20.727 -15.085 6.326 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 20.825 -13.444 6.750 1.00 0.00 H new ATOM 1019 N THR B 18 9.606 -22.752 -12.483 1.00 0.00 N ATOM 1020 CA THR B 18 10.841 -22.184 -13.055 1.00 0.00 C ATOM 1021 C THR B 18 11.119 -20.768 -12.524 1.00 0.00 C ATOM 1022 O THR B 18 10.384 -20.255 -11.678 1.00 0.00 O ATOM 1023 CB THR B 18 10.733 -22.146 -14.593 1.00 0.00 C ATOM 1024 OG1 THR B 18 9.632 -21.358 -14.994 1.00 0.00 O ATOM 1025 CG2 THR B 18 10.588 -23.534 -15.215 1.00 0.00 C ATOM 0 HA THR B 18 11.670 -22.824 -12.754 1.00 0.00 H new ATOM 0 HB THR B 18 11.667 -21.711 -14.948 1.00 0.00 H new ATOM 0 HG1 THR B 18 8.931 -21.404 -14.311 1.00 0.00 H new ATOM 0 HG21 THR B 18 10.517 -23.441 -16.299 1.00 0.00 H new ATOM 0 HG22 THR B 18 11.457 -24.140 -14.959 1.00 0.00 H new ATOM 0 HG23 THR B 18 9.687 -24.012 -14.832 1.00 0.00 H new ATOM 1033 N PHE B 19 12.173 -20.105 -13.020 1.00 0.00 N ATOM 1034 CA PHE B 19 12.548 -18.731 -12.644 1.00 0.00 C ATOM 1035 C PHE B 19 11.376 -17.729 -12.654 1.00 0.00 C ATOM 1036 O PHE B 19 11.295 -16.872 -11.774 1.00 0.00 O ATOM 1037 CB PHE B 19 13.723 -18.243 -13.508 1.00 0.00 C ATOM 1038 CG PHE B 19 13.410 -17.720 -14.899 1.00 0.00 C ATOM 1039 CD1 PHE B 19 12.711 -18.506 -15.838 1.00 0.00 C ATOM 1040 CD2 PHE B 19 13.860 -16.436 -15.266 1.00 0.00 C ATOM 1041 CE1 PHE B 19 12.428 -17.994 -17.115 1.00 0.00 C ATOM 1042 CE2 PHE B 19 13.601 -15.935 -16.553 1.00 0.00 C ATOM 1043 CZ PHE B 19 12.874 -16.710 -17.473 1.00 0.00 C ATOM 0 H PHE B 19 12.803 -20.516 -13.709 1.00 0.00 H new ATOM 0 HA PHE B 19 12.865 -18.774 -11.602 1.00 0.00 H new ATOM 0 HB2 PHE B 19 14.236 -17.452 -12.960 1.00 0.00 H new ATOM 0 HB3 PHE B 19 14.428 -19.068 -13.611 1.00 0.00 H new ATOM 0 HD1 PHE B 19 12.393 -19.504 -15.575 1.00 0.00 H new ATOM 0 HD2 PHE B 19 14.406 -15.834 -14.555 1.00 0.00 H new ATOM 0 HE1 PHE B 19 11.867 -18.587 -17.822 1.00 0.00 H new ATOM 0 HE2 PHE B 19 13.960 -14.956 -16.835 1.00 0.00 H new ATOM 0 HZ PHE B 19 12.658 -16.319 -18.456 1.00 0.00 H new ATOM 1053 N SER B 20 10.437 -17.868 -13.599 1.00 0.00 N ATOM 1054 CA SER B 20 9.235 -17.029 -13.706 1.00 0.00 C ATOM 1055 C SER B 20 8.278 -17.161 -12.517 1.00 0.00 C ATOM 1056 O SER B 20 7.517 -16.233 -12.240 1.00 0.00 O ATOM 1057 CB SER B 20 8.473 -17.347 -14.998 1.00 0.00 C ATOM 1058 OG SER B 20 9.275 -17.063 -16.130 1.00 0.00 O ATOM 0 H SER B 20 10.492 -18.582 -14.326 1.00 0.00 H new ATOM 0 HA SER B 20 9.596 -16.001 -13.713 1.00 0.00 H new ATOM 0 HB2 SER B 20 8.181 -18.397 -15.006 1.00 0.00 H new ATOM 0 HB3 SER B 20 7.555 -16.761 -15.039 1.00 0.00 H new ATOM 0 HG SER B 20 10.095 -17.598 -16.092 1.00 0.00 H new ATOM 1064 N ASP B 21 8.316 -18.277 -11.786 1.00 0.00 N ATOM 1065 CA ASP B 21 7.518 -18.497 -10.577 1.00 0.00 C ATOM 1066 C ASP B 21 8.274 -18.043 -9.320 1.00 0.00 C ATOM 1067 O ASP B 21 7.650 -17.584 -8.365 1.00 0.00 O ATOM 1068 CB ASP B 21 7.104 -19.969 -10.494 1.00 0.00 C ATOM 1069 CG ASP B 21 6.178 -20.234 -9.294 1.00 0.00 C ATOM 1070 OD1 ASP B 21 5.031 -19.726 -9.302 1.00 0.00 O ATOM 1071 OD2 ASP B 21 6.597 -20.954 -8.359 1.00 0.00 O ATOM 0 H ASP B 21 8.914 -19.069 -12.022 1.00 0.00 H new ATOM 0 HA ASP B 21 6.615 -17.890 -10.633 1.00 0.00 H new ATOM 0 HB2 ASP B 21 6.597 -20.257 -11.415 1.00 0.00 H new ATOM 0 HB3 ASP B 21 7.994 -20.593 -10.412 1.00 0.00 H new ATOM 1076 N LEU B 22 9.614 -18.077 -9.328 1.00 0.00 N ATOM 1077 CA LEU B 22 10.430 -17.586 -8.206 1.00 0.00 C ATOM 1078 C LEU B 22 10.147 -16.100 -7.906 1.00 0.00 C ATOM 1079 O LEU B 22 10.157 -15.707 -6.737 1.00 0.00 O ATOM 1080 CB LEU B 22 11.937 -17.828 -8.427 1.00 0.00 C ATOM 1081 CG LEU B 22 12.387 -19.282 -8.685 1.00 0.00 C ATOM 1082 CD1 LEU B 22 13.916 -19.360 -8.618 1.00 0.00 C ATOM 1083 CD2 LEU B 22 11.829 -20.297 -7.688 1.00 0.00 C ATOM 0 H LEU B 22 10.161 -18.443 -10.107 1.00 0.00 H new ATOM 0 HA LEU B 22 10.136 -18.167 -7.332 1.00 0.00 H new ATOM 0 HB2 LEU B 22 12.256 -17.220 -9.274 1.00 0.00 H new ATOM 0 HB3 LEU B 22 12.471 -17.460 -7.551 1.00 0.00 H new ATOM 0 HG LEU B 22 11.998 -19.541 -9.670 1.00 0.00 H new ATOM 0 HD11 LEU B 22 14.236 -20.386 -8.800 1.00 0.00 H new ATOM 0 HD12 LEU B 22 14.347 -18.706 -9.375 1.00 0.00 H new ATOM 0 HD13 LEU B 22 14.254 -19.044 -7.631 1.00 0.00 H new ATOM 0 HD21 LEU B 22 12.193 -21.293 -7.940 1.00 0.00 H new ATOM 0 HD22 LEU B 22 12.155 -20.036 -6.681 1.00 0.00 H new ATOM 0 HD23 LEU B 22 10.740 -20.288 -7.730 1.00 0.00 H new ATOM 1095 N TRP B 23 9.828 -15.282 -8.924 1.00 0.00 N ATOM 1096 CA TRP B 23 9.435 -13.876 -8.717 1.00 0.00 C ATOM 1097 C TRP B 23 8.115 -13.747 -7.929 1.00 0.00 C ATOM 1098 O TRP B 23 7.925 -12.786 -7.180 1.00 0.00 O ATOM 1099 CB TRP B 23 9.241 -13.157 -10.064 1.00 0.00 C ATOM 1100 CG TRP B 23 10.338 -13.208 -11.084 1.00 0.00 C ATOM 1101 CD1 TRP B 23 10.200 -13.774 -12.301 1.00 0.00 C ATOM 1102 CD2 TRP B 23 11.672 -12.599 -11.083 1.00 0.00 C ATOM 1103 NE1 TRP B 23 11.363 -13.628 -13.030 1.00 0.00 N ATOM 1104 CE2 TRP B 23 12.294 -12.882 -12.341 1.00 0.00 C ATOM 1105 CE3 TRP B 23 12.406 -11.800 -10.178 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 13.571 -12.412 -12.678 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 13.681 -11.304 -10.518 1.00 0.00 C ATOM 1108 CH2 TRP B 23 14.265 -11.610 -11.759 1.00 0.00 C ATOM 0 H TRP B 23 9.835 -15.571 -9.902 1.00 0.00 H new ATOM 0 HA TRP B 23 10.244 -13.420 -8.146 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.343 -13.565 -10.527 1.00 0.00 H new ATOM 0 HB3 TRP B 23 9.041 -12.107 -9.850 1.00 0.00 H new ATOM 0 HD1 TRP B 23 9.308 -14.270 -12.654 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.514 -14.022 -13.959 1.00 0.00 H new ATOM 0 HE3 TRP B 23 11.984 -11.566 -9.212 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 14.014 -12.663 -13.630 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 14.216 -10.681 -9.816 1.00 0.00 H new ATOM 0 HH2 TRP B 23 15.245 -11.229 -12.005 1.00 0.00 H new ATOM 1119 N LYS B 24 7.200 -14.714 -8.102 1.00 0.00 N ATOM 1120 CA LYS B 24 5.866 -14.762 -7.479 1.00 0.00 C ATOM 1121 C LYS B 24 5.869 -15.362 -6.069 1.00 0.00 C ATOM 1122 O LYS B 24 5.022 -14.992 -5.254 1.00 0.00 O ATOM 1123 CB LYS B 24 4.908 -15.591 -8.360 1.00 0.00 C ATOM 1124 CG LYS B 24 4.840 -15.138 -9.829 1.00 0.00 C ATOM 1125 CD LYS B 24 3.802 -15.969 -10.599 1.00 0.00 C ATOM 1126 CE LYS B 24 3.677 -15.521 -12.061 1.00 0.00 C ATOM 1127 NZ LYS B 24 4.758 -16.075 -12.917 1.00 0.00 N ATOM 0 H LYS B 24 7.376 -15.518 -8.705 1.00 0.00 H new ATOM 0 HA LYS B 24 5.535 -13.727 -7.394 1.00 0.00 H new ATOM 0 HB2 LYS B 24 5.218 -16.635 -8.329 1.00 0.00 H new ATOM 0 HB3 LYS B 24 3.907 -15.543 -7.931 1.00 0.00 H new ATOM 0 HG2 LYS B 24 4.578 -14.081 -9.878 1.00 0.00 H new ATOM 0 HG3 LYS B 24 5.819 -15.246 -10.295 1.00 0.00 H new ATOM 0 HD2 LYS B 24 4.083 -17.022 -10.565 1.00 0.00 H new ATOM 0 HD3 LYS B 24 2.832 -15.882 -10.109 1.00 0.00 H new ATOM 0 HE2 LYS B 24 2.710 -15.835 -12.453 1.00 0.00 H new ATOM 0 HE3 LYS B 24 3.702 -14.432 -12.108 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 4.809 -15.535 -13.804 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 5.667 -16.006 -12.416 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 4.555 -17.073 -13.130 1.00 0.00 H new ATOM 1141 N LEU B 25 6.789 -16.289 -5.780 1.00 0.00 N ATOM 1142 CA LEU B 25 6.881 -16.995 -4.494 1.00 0.00 C ATOM 1143 C LEU B 25 7.130 -16.105 -3.265 1.00 0.00 C ATOM 1144 O LEU B 25 6.733 -16.508 -2.172 1.00 0.00 O ATOM 1145 CB LEU B 25 7.963 -18.093 -4.560 1.00 0.00 C ATOM 1146 CG LEU B 25 7.575 -19.366 -5.336 1.00 0.00 C ATOM 1147 CD1 LEU B 25 8.761 -20.332 -5.325 1.00 0.00 C ATOM 1148 CD2 LEU B 25 6.375 -20.099 -4.726 1.00 0.00 C ATOM 0 H LEU B 25 7.506 -16.576 -6.446 1.00 0.00 H new ATOM 0 HA LEU B 25 5.890 -17.425 -4.347 1.00 0.00 H new ATOM 0 HB2 LEU B 25 8.857 -17.669 -5.017 1.00 0.00 H new ATOM 0 HB3 LEU B 25 8.229 -18.377 -3.542 1.00 0.00 H new ATOM 0 HG LEU B 25 7.304 -19.052 -6.344 1.00 0.00 H new ATOM 0 HD11 LEU B 25 8.498 -21.237 -5.872 1.00 0.00 H new ATOM 0 HD12 LEU B 25 9.620 -19.858 -5.800 1.00 0.00 H new ATOM 0 HD13 LEU B 25 9.011 -20.589 -4.296 1.00 0.00 H new ATOM 0 HD21 LEU B 25 6.151 -20.987 -5.318 1.00 0.00 H new ATOM 0 HD22 LEU B 25 6.611 -20.395 -3.704 1.00 0.00 H new ATOM 0 HD23 LEU B 25 5.508 -19.438 -4.722 1.00 0.00 H new ATOM 1408 N LEU B 43 28.308 -3.677 -4.370 1.00 0.00 N ATOM 1409 CA LEU B 43 28.052 -5.047 -4.838 1.00 0.00 C ATOM 1410 C LEU B 43 27.427 -5.103 -6.246 1.00 0.00 C ATOM 1411 O LEU B 43 26.791 -4.147 -6.694 1.00 0.00 O ATOM 1412 CB LEU B 43 27.134 -5.768 -3.827 1.00 0.00 C ATOM 1413 CG LEU B 43 25.799 -5.045 -3.535 1.00 0.00 C ATOM 1414 CD1 LEU B 43 24.610 -6.002 -3.624 1.00 0.00 C ATOM 1415 CD2 LEU B 43 25.805 -4.409 -2.145 1.00 0.00 C ATOM 0 HA LEU B 43 29.017 -5.548 -4.908 1.00 0.00 H new ATOM 0 HB2 LEU B 43 26.915 -6.767 -4.204 1.00 0.00 H new ATOM 0 HB3 LEU B 43 27.676 -5.893 -2.890 1.00 0.00 H new ATOM 0 HG LEU B 43 25.696 -4.269 -4.294 1.00 0.00 H new ATOM 0 HD11 LEU B 43 23.689 -5.459 -3.413 1.00 0.00 H new ATOM 0 HD12 LEU B 43 24.559 -6.427 -4.627 1.00 0.00 H new ATOM 0 HD13 LEU B 43 24.733 -6.804 -2.896 1.00 0.00 H new ATOM 0 HD21 LEU B 43 24.853 -3.908 -1.970 1.00 0.00 H new ATOM 0 HD22 LEU B 43 25.952 -5.183 -1.391 1.00 0.00 H new ATOM 0 HD23 LEU B 43 26.614 -3.682 -2.081 1.00 0.00 H new ATOM 1427 N MET B 44 27.582 -6.246 -6.923 1.00 0.00 N ATOM 1428 CA MET B 44 27.030 -6.524 -8.257 1.00 0.00 C ATOM 1429 C MET B 44 26.848 -8.035 -8.485 1.00 0.00 C ATOM 1430 O MET B 44 27.628 -8.839 -7.971 1.00 0.00 O ATOM 1431 CB MET B 44 27.962 -5.916 -9.322 1.00 0.00 C ATOM 1432 CG MET B 44 27.434 -6.030 -10.759 1.00 0.00 C ATOM 1433 SD MET B 44 25.706 -5.538 -11.037 1.00 0.00 S ATOM 1434 CE MET B 44 25.691 -3.898 -10.262 1.00 0.00 C ATOM 0 H MET B 44 28.113 -7.031 -6.546 1.00 0.00 H new ATOM 0 HA MET B 44 26.043 -6.068 -8.335 1.00 0.00 H new ATOM 0 HB2 MET B 44 28.124 -4.864 -9.089 1.00 0.00 H new ATOM 0 HB3 MET B 44 28.933 -6.409 -9.263 1.00 0.00 H new ATOM 0 HG2 MET B 44 28.069 -5.422 -11.404 1.00 0.00 H new ATOM 0 HG3 MET B 44 27.549 -7.064 -11.083 1.00 0.00 H new ATOM 0 HE1 MET B 44 24.974 -3.259 -10.777 1.00 0.00 H new ATOM 0 HE2 MET B 44 25.405 -3.993 -9.214 1.00 0.00 H new ATOM 0 HE3 MET B 44 26.685 -3.455 -10.328 1.00 0.00 H new ATOM 1444 N LEU B 45 25.823 -8.425 -9.248 1.00 0.00 N ATOM 1445 CA LEU B 45 25.510 -9.826 -9.564 1.00 0.00 C ATOM 1446 C LEU B 45 26.586 -10.498 -10.446 1.00 0.00 C ATOM 1447 O LEU B 45 27.387 -9.836 -11.115 1.00 0.00 O ATOM 1448 CB LEU B 45 24.121 -9.908 -10.245 1.00 0.00 C ATOM 1449 CG LEU B 45 22.879 -9.909 -9.330 1.00 0.00 C ATOM 1450 CD1 LEU B 45 22.847 -11.112 -8.386 1.00 0.00 C ATOM 1451 CD2 LEU B 45 22.735 -8.638 -8.497 1.00 0.00 C ATOM 0 H LEU B 45 25.173 -7.764 -9.673 1.00 0.00 H new ATOM 0 HA LEU B 45 25.495 -10.376 -8.623 1.00 0.00 H new ATOM 0 HB2 LEU B 45 24.033 -9.066 -10.931 1.00 0.00 H new ATOM 0 HB3 LEU B 45 24.095 -10.815 -10.848 1.00 0.00 H new ATOM 0 HG LEU B 45 22.040 -9.966 -10.023 1.00 0.00 H new ATOM 0 HD11 LEU B 45 21.953 -11.063 -7.765 1.00 0.00 H new ATOM 0 HD12 LEU B 45 22.834 -12.032 -8.970 1.00 0.00 H new ATOM 0 HD13 LEU B 45 23.732 -11.099 -7.750 1.00 0.00 H new ATOM 0 HD21 LEU B 45 21.841 -8.708 -7.878 1.00 0.00 H new ATOM 0 HD22 LEU B 45 23.610 -8.521 -7.858 1.00 0.00 H new ATOM 0 HD23 LEU B 45 22.651 -7.776 -9.159 1.00 0.00 H new ATOM 1463 N SER B 46 26.544 -11.831 -10.478 1.00 0.00 N ATOM 1464 CA SER B 46 27.422 -12.718 -11.258 1.00 0.00 C ATOM 1465 C SER B 46 26.582 -13.750 -12.029 1.00 0.00 C ATOM 1466 O SER B 46 25.462 -14.054 -11.606 1.00 0.00 O ATOM 1467 CB SER B 46 28.393 -13.441 -10.309 1.00 0.00 C ATOM 1468 OG SER B 46 29.314 -12.527 -9.733 1.00 0.00 O ATOM 0 H SER B 46 25.860 -12.354 -9.931 1.00 0.00 H new ATOM 0 HA SER B 46 27.989 -12.122 -11.973 1.00 0.00 H new ATOM 0 HB2 SER B 46 27.831 -13.943 -9.521 1.00 0.00 H new ATOM 0 HB3 SER B 46 28.935 -14.213 -10.856 1.00 0.00 H new ATOM 0 HG SER B 46 29.920 -13.008 -9.132 1.00 0.00 H new ATOM 1474 N PRO B 47 27.081 -14.325 -13.144 1.00 0.00 N ATOM 1475 CA PRO B 47 26.327 -15.304 -13.938 1.00 0.00 C ATOM 1476 C PRO B 47 25.937 -16.569 -13.156 1.00 0.00 C ATOM 1477 O PRO B 47 24.928 -17.194 -13.477 1.00 0.00 O ATOM 1478 CB PRO B 47 27.191 -15.604 -15.168 1.00 0.00 C ATOM 1479 CG PRO B 47 28.605 -15.236 -14.721 1.00 0.00 C ATOM 1480 CD PRO B 47 28.380 -14.075 -13.755 1.00 0.00 C ATOM 0 HA PRO B 47 25.361 -14.891 -14.228 1.00 0.00 H new ATOM 0 HB2 PRO B 47 27.124 -16.653 -15.458 1.00 0.00 H new ATOM 0 HB3 PRO B 47 26.878 -15.014 -16.030 1.00 0.00 H new ATOM 0 HG2 PRO B 47 29.103 -16.074 -14.233 1.00 0.00 H new ATOM 0 HG3 PRO B 47 29.229 -14.942 -15.565 1.00 0.00 H new ATOM 0 HD2 PRO B 47 29.167 -14.033 -13.002 1.00 0.00 H new ATOM 0 HD3 PRO B 47 28.390 -13.120 -14.280 1.00 0.00 H new ATOM 1488 N ASP B 48 26.682 -16.924 -12.102 1.00 0.00 N ATOM 1489 CA ASP B 48 26.376 -18.063 -11.224 1.00 0.00 C ATOM 1490 C ASP B 48 24.998 -17.928 -10.536 1.00 0.00 C ATOM 1491 O ASP B 48 24.282 -18.915 -10.366 1.00 0.00 O ATOM 1492 CB ASP B 48 27.493 -18.201 -10.183 1.00 0.00 C ATOM 1493 CG ASP B 48 27.337 -19.481 -9.343 1.00 0.00 C ATOM 1494 OD1 ASP B 48 27.576 -20.589 -9.880 1.00 0.00 O ATOM 1495 OD2 ASP B 48 27.009 -19.381 -8.136 1.00 0.00 O ATOM 0 H ASP B 48 27.527 -16.421 -11.830 1.00 0.00 H new ATOM 0 HA ASP B 48 26.323 -18.962 -11.838 1.00 0.00 H new ATOM 0 HB2 ASP B 48 28.460 -18.212 -10.687 1.00 0.00 H new ATOM 0 HB3 ASP B 48 27.486 -17.332 -9.525 1.00 0.00 H new ATOM 1500 N ASP B 49 24.594 -16.700 -10.185 1.00 0.00 N ATOM 1501 CA ASP B 49 23.280 -16.401 -9.602 1.00 0.00 C ATOM 1502 C ASP B 49 22.151 -16.535 -10.645 1.00 0.00 C ATOM 1503 O ASP B 49 21.013 -16.848 -10.288 1.00 0.00 O ATOM 1504 CB ASP B 49 23.243 -14.971 -9.030 1.00 0.00 C ATOM 1505 CG ASP B 49 24.165 -14.736 -7.819 1.00 0.00 C ATOM 1506 OD1 ASP B 49 25.396 -14.602 -8.010 1.00 0.00 O ATOM 1507 OD2 ASP B 49 23.654 -14.634 -6.675 1.00 0.00 O ATOM 0 H ASP B 49 25.181 -15.874 -10.300 1.00 0.00 H new ATOM 0 HA ASP B 49 23.122 -17.126 -8.804 1.00 0.00 H new ATOM 0 HB2 ASP B 49 23.518 -14.272 -9.820 1.00 0.00 H new ATOM 0 HB3 ASP B 49 22.219 -14.737 -8.740 1.00 0.00 H new ATOM 1512 N ILE B 50 22.455 -16.301 -11.929 1.00 0.00 N ATOM 1513 CA ILE B 50 21.502 -16.354 -13.050 1.00 0.00 C ATOM 1514 C ILE B 50 21.294 -17.797 -13.541 1.00 0.00 C ATOM 1515 O ILE B 50 20.164 -18.214 -13.781 1.00 0.00 O ATOM 1516 CB ILE B 50 21.958 -15.436 -14.213 1.00 0.00 C ATOM 1517 CG1 ILE B 50 22.373 -14.025 -13.723 1.00 0.00 C ATOM 1518 CG2 ILE B 50 20.822 -15.314 -15.245 1.00 0.00 C ATOM 1519 CD1 ILE B 50 22.868 -13.086 -14.831 1.00 0.00 C ATOM 0 H ILE B 50 23.401 -16.062 -12.227 1.00 0.00 H new ATOM 0 HA ILE B 50 20.544 -15.986 -12.684 1.00 0.00 H new ATOM 0 HB ILE B 50 22.837 -15.893 -14.668 1.00 0.00 H new ATOM 0 HG12 ILE B 50 21.521 -13.562 -13.226 1.00 0.00 H new ATOM 0 HG13 ILE B 50 23.159 -14.131 -12.976 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.142 -14.669 -16.063 1.00 0.00 H new ATOM 0 HG22 ILE B 50 20.578 -16.302 -15.636 1.00 0.00 H new ATOM 0 HG23 ILE B 50 19.941 -14.885 -14.767 1.00 0.00 H new ATOM 0 HD11 ILE B 50 23.136 -12.122 -14.398 1.00 0.00 H new ATOM 0 HD12 ILE B 50 23.742 -13.523 -15.315 1.00 0.00 H new ATOM 0 HD13 ILE B 50 22.078 -12.945 -15.568 1.00 0.00 H new ATOM 1531 N GLU B 51 22.350 -18.608 -13.657 1.00 0.00 N ATOM 1532 CA GLU B 51 22.224 -20.019 -14.069 1.00 0.00 C ATOM 1533 C GLU B 51 21.555 -20.919 -13.001 1.00 0.00 C ATOM 1534 O GLU B 51 21.336 -22.110 -13.222 1.00 0.00 O ATOM 1535 CB GLU B 51 23.583 -20.570 -14.539 1.00 0.00 C ATOM 1536 CG GLU B 51 24.587 -20.835 -13.415 1.00 0.00 C ATOM 1537 CD GLU B 51 25.901 -21.410 -13.981 1.00 0.00 C ATOM 1538 OE1 GLU B 51 26.783 -20.627 -14.410 1.00 0.00 O ATOM 1539 OE2 GLU B 51 26.061 -22.655 -14.005 1.00 0.00 O ATOM 0 H GLU B 51 23.309 -18.314 -13.471 1.00 0.00 H new ATOM 0 HA GLU B 51 21.539 -20.041 -14.917 1.00 0.00 H new ATOM 0 HB2 GLU B 51 23.415 -21.499 -15.084 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.023 -19.863 -15.242 1.00 0.00 H new ATOM 0 HG2 GLU B 51 24.791 -19.909 -12.878 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.159 -21.533 -12.696 1.00 0.00 H new ATOM 1546 N GLN B 52 21.224 -20.364 -11.832 1.00 0.00 N ATOM 1547 CA GLN B 52 20.579 -21.068 -10.722 1.00 0.00 C ATOM 1548 C GLN B 52 19.061 -21.244 -10.894 1.00 0.00 C ATOM 1549 O GLN B 52 18.540 -22.321 -10.605 1.00 0.00 O ATOM 1550 CB GLN B 52 20.935 -20.304 -9.426 1.00 0.00 C ATOM 1551 CG GLN B 52 19.946 -20.351 -8.239 1.00 0.00 C ATOM 1552 CD GLN B 52 18.765 -19.374 -8.310 1.00 0.00 C ATOM 1553 OE1 GLN B 52 17.652 -19.699 -7.922 1.00 0.00 O ATOM 1554 NE2 GLN B 52 18.925 -18.157 -8.793 1.00 0.00 N ATOM 0 H GLN B 52 21.404 -19.381 -11.626 1.00 0.00 H new ATOM 0 HA GLN B 52 20.955 -22.090 -10.684 1.00 0.00 H new ATOM 0 HB2 GLN B 52 21.894 -20.683 -9.072 1.00 0.00 H new ATOM 0 HB3 GLN B 52 21.084 -19.257 -9.690 1.00 0.00 H new ATOM 0 HG2 GLN B 52 19.550 -21.364 -8.161 1.00 0.00 H new ATOM 0 HG3 GLN B 52 20.500 -20.154 -7.321 1.00 0.00 H new ATOM 0 HE21 GLN B 52 19.842 -17.856 -9.125 1.00 0.00 H new ATOM 0 HE22 GLN B 52 18.132 -17.517 -8.835 1.00 0.00 H new ATOM 1563 N TRP B 53 18.332 -20.208 -11.322 1.00 0.00 N ATOM 1564 CA TRP B 53 16.860 -20.242 -11.359 1.00 0.00 C ATOM 1565 C TRP B 53 16.209 -21.002 -12.528 1.00 0.00 C ATOM 1566 O TRP B 53 15.042 -21.382 -12.432 1.00 0.00 O ATOM 1567 CB TRP B 53 16.308 -18.818 -11.183 1.00 0.00 C ATOM 1568 CG TRP B 53 16.798 -17.695 -12.053 1.00 0.00 C ATOM 1569 CD1 TRP B 53 17.262 -17.788 -13.319 1.00 0.00 C ATOM 1570 CD2 TRP B 53 16.859 -16.269 -11.723 1.00 0.00 C ATOM 1571 NE1 TRP B 53 17.596 -16.535 -13.793 1.00 0.00 N ATOM 1572 CE2 TRP B 53 17.385 -15.561 -12.846 1.00 0.00 C ATOM 1573 CE3 TRP B 53 16.532 -15.501 -10.582 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 17.591 -14.173 -12.839 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 16.737 -14.107 -10.562 1.00 0.00 C ATOM 1576 CH2 TRP B 53 17.271 -13.444 -11.681 1.00 0.00 C ATOM 0 H TRP B 53 18.736 -19.331 -11.650 1.00 0.00 H new ATOM 0 HA TRP B 53 16.564 -20.863 -10.514 1.00 0.00 H new ATOM 0 HB2 TRP B 53 15.227 -18.875 -11.310 1.00 0.00 H new ATOM 0 HB3 TRP B 53 16.493 -18.527 -10.149 1.00 0.00 H new ATOM 0 HD1 TRP B 53 17.357 -18.707 -13.878 1.00 0.00 H new ATOM 0 HE1 TRP B 53 17.955 -16.354 -14.730 1.00 0.00 H new ATOM 0 HE3 TRP B 53 16.119 -15.990 -9.712 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 17.989 -13.673 -13.710 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 16.481 -13.542 -9.678 1.00 0.00 H new ATOM 0 HH2 TRP B 53 17.435 -12.377 -11.651 1.00 0.00 H new ATOM 1587 N PHE B 54 16.941 -21.261 -13.615 1.00 0.00 N ATOM 1588 CA PHE B 54 16.427 -21.985 -14.794 1.00 0.00 C ATOM 1589 C PHE B 54 16.607 -23.519 -14.729 1.00 0.00 C ATOM 1590 O PHE B 54 16.071 -24.242 -15.570 1.00 0.00 O ATOM 1591 CB PHE B 54 16.955 -21.350 -16.096 1.00 0.00 C ATOM 1592 CG PHE B 54 18.301 -21.810 -16.642 1.00 0.00 C ATOM 1593 CD1 PHE B 54 19.373 -22.144 -15.790 1.00 0.00 C ATOM 1594 CD2 PHE B 54 18.486 -21.883 -18.037 1.00 0.00 C ATOM 1595 CE1 PHE B 54 20.603 -22.566 -16.325 1.00 0.00 C ATOM 1596 CE2 PHE B 54 19.719 -22.294 -18.574 1.00 0.00 C ATOM 1597 CZ PHE B 54 20.779 -22.639 -17.717 1.00 0.00 C ATOM 0 H PHE B 54 17.915 -20.974 -13.708 1.00 0.00 H new ATOM 0 HA PHE B 54 15.344 -21.864 -14.789 1.00 0.00 H new ATOM 0 HB2 PHE B 54 16.209 -21.519 -16.872 1.00 0.00 H new ATOM 0 HB3 PHE B 54 17.013 -20.273 -15.938 1.00 0.00 H new ATOM 0 HD1 PHE B 54 19.249 -22.075 -14.719 1.00 0.00 H new ATOM 0 HD2 PHE B 54 17.674 -21.621 -18.699 1.00 0.00 H new ATOM 0 HE1 PHE B 54 21.414 -22.835 -15.664 1.00 0.00 H new ATOM 0 HE2 PHE B 54 19.852 -22.345 -19.645 1.00 0.00 H new ATOM 0 HZ PHE B 54 21.725 -22.959 -18.127 1.00 0.00 H new ATOM 1607 N THR B 55 17.358 -24.026 -13.739 1.00 0.00 N ATOM 1608 CA THR B 55 17.654 -25.464 -13.543 1.00 0.00 C ATOM 1609 C THR B 55 16.411 -26.361 -13.379 1.00 0.00 C ATOM 1610 O THR B 55 16.453 -27.555 -13.675 1.00 0.00 O ATOM 1611 CB THR B 55 18.624 -25.636 -12.357 1.00 0.00 C ATOM 1612 OG1 THR B 55 19.295 -26.874 -12.444 1.00 0.00 O ATOM 1613 CG2 THR B 55 17.957 -25.554 -10.981 1.00 0.00 C ATOM 0 H THR B 55 17.791 -23.435 -13.030 1.00 0.00 H new ATOM 0 HA THR B 55 18.122 -25.808 -14.465 1.00 0.00 H new ATOM 0 HB THR B 55 19.317 -24.798 -12.437 1.00 0.00 H new ATOM 0 HG1 THR B 55 19.908 -26.968 -11.685 1.00 0.00 H new ATOM 0 HG21 THR B 55 18.710 -25.685 -10.203 1.00 0.00 H new ATOM 0 HG22 THR B 55 17.481 -24.580 -10.865 1.00 0.00 H new ATOM 0 HG23 THR B 55 17.205 -26.338 -10.894 1.00 0.00 H new