USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1305 hydrogens (45 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 153 HIS : no HE2:sc= -3.4! C(o=-3.4!,f=-11!) USER MOD Set 1.2: A 155 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 101 GLN : amide:sc= -5.94! C(o=-5.9!,f=-7.8!) USER MOD Set 2.2: A 168 NDP O3B : rot 96:sc= 0.0712 USER MOD Set 3.1: A 58 THR OG1 : rot -100:sc= -1.21 USER MOD Set 3.2: A 92 GLN :FLIP amide:sc= -1.83 F(o=-4.5!,f=-3) USER MOD Set 4.1: A 85 TYR OH : rot -104:sc= 1.27 USER MOD Set 4.2: A 89 HIS : no HE2:sc= 0.673 K(o=1.9,f=-2) USER MOD Set 5.1: A 63 THR OG1 : rot 30:sc= -0.613 USER MOD Set 5.2: A 65 GLN :FLIP amide:sc= -1.36 F(o=-3!,f=-2) USER MOD Set 6.1: A 39 MET CE :methyl 155:sc= -8.23! (180deg=-10.9!) USER MOD Set 6.2: A 59 ASN : amide:sc= -5.96 K(o=-14,f=-25!) USER MOD Set 7.1: A 29 TYR OH : rot -121:sc= 1.04 USER MOD Set 7.2: A 33 GLN : amide:sc= -2.5 K(o=-1.5,f=-11!) USER MOD Single : A 1 THR N :NH3+ -125:sc= 0.105 (180deg=0.0243) USER MOD Single : A 1 THR OG1 : rot 100:sc= -0.36 USER MOD Single : A 7 GLN : amide:sc= -1.46 X(o=-1.5,f=-1.2) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -0.136 K(o=-0.14,f=-2.4!) USER MOD Single : A 22 HIS : no HD1:sc= -0.372 X(o=-0.37,f=-0.093) USER MOD Single : A 28 HIS : no HD1:sc= -0.242 X(o=-0.24,f=-0.1) USER MOD Single : A 34 THR OG1 : rot -80:sc= 1.29 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -6:sc= -0.211 USER MOD Single : A 46 TYR OH : rot 180:sc=-0.00778 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 144:sc= -0.905 (180deg=-2.83!) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 68 TYR OH : rot -178:sc= 0.0595 USER MOD Single : A 69 GLN : amide:sc= -0.0177 X(o=-0.018,f=-0.018) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HD1:sc= -3.48 K(o=-3.5,f=-5.1!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= -1.52 USER MOD Single : A 107 LYS NZ :NH3+ -148:sc= 0.207 (180deg=0.00723) USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0988 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot -154:sc= -1.53 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -137:sc= -0.0288 (180deg=-1.92!) USER MOD Single : A 128 MET CE :methyl -108:sc= -3.33 (180deg=-8.17!) USER MOD Single : A 132 ASN : amide:sc= -1.34 K(o=-1.3,f=-5.4!) USER MOD Single : A 137 THR OG1 : rot -159:sc= -1.34 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot -148:sc= -1.25 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.013 USER MOD Single : A 148 ASN : amide:sc= -0.0955 X(o=-0.096,f=-0.033) USER MOD Single : A 152 THR OG1 : rot 94:sc= 0.845 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.163 USER MOD Single : A 159 GLN :FLIP amide:sc= 0 F(o=-1.6!,f=0) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ -147:sc= -0.0826 (180deg=-0.324) USER MOD Single : A 168 NDP O2D : rot -100:sc= 1.3 USER MOD Single : A 168 NDP O3D : rot 87:sc= 0.111 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.858 9.787 3.847 1.00 0.00 N ATOM 2 CA THR A 1 -5.356 8.918 2.741 1.00 0.00 C ATOM 3 C THR A 1 -3.840 8.770 2.845 1.00 0.00 C ATOM 4 O THR A 1 -3.106 9.735 2.791 1.00 0.00 O ATOM 5 CB THR A 1 -5.719 9.536 1.390 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.985 10.171 1.491 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.779 8.437 0.328 1.00 0.00 C ATOM 0 H1 THR A 1 -6.595 9.281 4.379 1.00 0.00 H new ATOM 0 H2 THR A 1 -5.072 10.025 4.486 1.00 0.00 H new ATOM 0 H3 THR A 1 -6.257 10.661 3.448 1.00 0.00 H new ATOM 0 HA THR A 1 -5.820 7.935 2.824 1.00 0.00 H new ATOM 0 HB THR A 1 -4.965 10.270 1.107 1.00 0.00 H new ATOM 0 HG1 THR A 1 -6.859 11.136 1.607 1.00 0.00 H new ATOM 0 HG21 THR A 1 -6.038 8.876 -0.636 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.808 7.948 0.255 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.535 7.703 0.607 1.00 0.00 H new ATOM 17 N ALA A 2 -3.367 7.563 2.986 1.00 0.00 N ATOM 18 CA ALA A 2 -1.899 7.347 3.093 1.00 0.00 C ATOM 19 C ALA A 2 -1.473 6.246 2.124 1.00 0.00 C ATOM 20 O ALA A 2 -2.247 5.380 1.779 1.00 0.00 O ATOM 21 CB ALA A 2 -1.552 6.927 4.523 1.00 0.00 C ATOM 0 H ALA A 2 -3.935 6.717 3.032 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.376 8.271 2.845 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.477 6.768 4.605 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.857 7.711 5.216 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -2.075 6.003 4.768 1.00 0.00 H new ATOM 27 N PHE A 3 -0.242 6.264 1.697 1.00 0.00 N ATOM 28 CA PHE A 3 0.238 5.208 0.763 1.00 0.00 C ATOM 29 C PHE A 3 1.075 4.205 1.555 1.00 0.00 C ATOM 30 O PHE A 3 1.918 4.585 2.343 1.00 0.00 O ATOM 31 CB PHE A 3 1.106 5.842 -0.326 1.00 0.00 C ATOM 32 CG PHE A 3 0.242 6.358 -1.454 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.942 7.052 -1.183 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.636 6.143 -2.776 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.728 7.528 -2.237 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.150 6.618 -3.829 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.332 7.310 -3.559 1.00 0.00 C ATOM 0 H PHE A 3 0.453 6.965 1.954 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.612 4.708 0.298 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.691 6.659 0.096 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.815 5.108 -0.709 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.249 7.220 -0.161 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.551 5.608 -2.985 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.642 8.065 -2.029 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.157 6.450 -4.851 1.00 0.00 H new ATOM 0 HZ PHE A 3 -1.941 7.677 -4.372 1.00 0.00 H new ATOM 47 N LEU A 4 0.857 2.930 1.365 1.00 0.00 N ATOM 48 CA LEU A 4 1.655 1.928 2.125 1.00 0.00 C ATOM 49 C LEU A 4 2.159 0.847 1.166 1.00 0.00 C ATOM 50 O LEU A 4 1.493 -0.140 0.928 1.00 0.00 O ATOM 51 CB LEU A 4 0.769 1.294 3.203 1.00 0.00 C ATOM 52 CG LEU A 4 1.535 0.182 3.925 1.00 0.00 C ATOM 53 CD1 LEU A 4 2.787 0.764 4.585 1.00 0.00 C ATOM 54 CD2 LEU A 4 0.636 -0.438 4.998 1.00 0.00 C ATOM 0 H LEU A 4 0.166 2.543 0.722 1.00 0.00 H new ATOM 0 HA LEU A 4 2.509 2.415 2.597 1.00 0.00 H new ATOM 0 HB2 LEU A 4 0.454 2.053 3.919 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.135 0.888 2.750 1.00 0.00 H new ATOM 0 HG LEU A 4 1.828 -0.582 3.205 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.330 -0.030 5.098 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.427 1.208 3.823 1.00 0.00 H new ATOM 0 HD13 LEU A 4 2.497 1.529 5.305 1.00 0.00 H new ATOM 0 HD21 LEU A 4 1.179 -1.230 5.514 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.344 0.329 5.716 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.256 -0.855 4.529 1.00 0.00 H new ATOM 66 N TRP A 5 3.332 1.023 0.613 1.00 0.00 N ATOM 67 CA TRP A 5 3.868 -0.001 -0.327 1.00 0.00 C ATOM 68 C TRP A 5 5.333 -0.304 0.008 1.00 0.00 C ATOM 69 O TRP A 5 5.904 0.264 0.918 1.00 0.00 O ATOM 70 CB TRP A 5 3.743 0.509 -1.771 1.00 0.00 C ATOM 71 CG TRP A 5 4.803 1.525 -2.075 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.953 1.267 -2.742 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.830 2.948 -1.752 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.682 2.437 -2.850 1.00 0.00 N ATOM 75 CE2 TRP A 5 6.032 3.501 -2.257 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.939 3.804 -1.079 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.337 4.854 -2.102 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.246 5.168 -0.920 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.441 5.690 -1.432 1.00 0.00 C ATOM 0 H TRP A 5 3.938 1.828 0.772 1.00 0.00 H new ATOM 0 HA TRP A 5 3.292 -0.921 -0.226 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.826 -0.328 -2.465 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.758 0.950 -1.921 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.252 0.303 -3.127 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.589 2.506 -3.311 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.014 3.412 -0.682 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 7.260 5.252 -2.498 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.556 5.816 -0.400 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.669 6.738 -1.309 1.00 0.00 H new ATOM 90 N ALA A 6 5.937 -1.199 -0.725 1.00 0.00 N ATOM 91 CA ALA A 6 7.361 -1.552 -0.464 1.00 0.00 C ATOM 92 C ALA A 6 8.102 -1.643 -1.797 1.00 0.00 C ATOM 93 O ALA A 6 7.620 -2.232 -2.742 1.00 0.00 O ATOM 94 CB ALA A 6 7.432 -2.901 0.256 1.00 0.00 C ATOM 0 H ALA A 6 5.503 -1.704 -1.498 1.00 0.00 H new ATOM 0 HA ALA A 6 7.821 -0.788 0.163 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.474 -3.158 0.446 1.00 0.00 H new ATOM 0 HB2 ALA A 6 6.896 -2.837 1.203 1.00 0.00 H new ATOM 0 HB3 ALA A 6 6.977 -3.671 -0.367 1.00 0.00 H new ATOM 100 N GLN A 7 9.263 -1.051 -1.886 1.00 0.00 N ATOM 101 CA GLN A 7 10.019 -1.097 -3.170 1.00 0.00 C ATOM 102 C GLN A 7 11.508 -1.321 -2.901 1.00 0.00 C ATOM 103 O GLN A 7 12.003 -1.052 -1.824 1.00 0.00 O ATOM 104 CB GLN A 7 9.826 0.221 -3.921 1.00 0.00 C ATOM 105 CG GLN A 7 10.203 1.389 -3.009 1.00 0.00 C ATOM 106 CD GLN A 7 10.540 2.613 -3.862 1.00 0.00 C ATOM 107 OE1 GLN A 7 9.725 3.069 -4.639 1.00 0.00 O ATOM 108 NE2 GLN A 7 11.715 3.168 -3.749 1.00 0.00 N ATOM 0 H GLN A 7 9.718 -0.540 -1.129 1.00 0.00 H new ATOM 0 HA GLN A 7 9.643 -1.923 -3.774 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.443 0.233 -4.819 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.790 0.319 -4.245 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.378 1.618 -2.334 1.00 0.00 H new ATOM 0 HG3 GLN A 7 11.057 1.119 -2.388 1.00 0.00 H new ATOM 0 HE21 GLN A 7 12.399 2.785 -3.097 1.00 0.00 H new ATOM 0 HE22 GLN A 7 11.950 3.985 -4.313 1.00 0.00 H new ATOM 117 N ASP A 8 12.222 -1.821 -3.877 1.00 0.00 N ATOM 118 CA ASP A 8 13.678 -2.075 -3.686 1.00 0.00 C ATOM 119 C ASP A 8 14.470 -0.793 -3.954 1.00 0.00 C ATOM 120 O ASP A 8 13.918 0.288 -4.010 1.00 0.00 O ATOM 121 CB ASP A 8 14.135 -3.183 -4.642 1.00 0.00 C ATOM 122 CG ASP A 8 13.836 -2.782 -6.089 1.00 0.00 C ATOM 123 OD1 ASP A 8 14.195 -1.679 -6.468 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.257 -3.589 -6.796 1.00 0.00 O ATOM 0 H ASP A 8 11.857 -2.064 -4.798 1.00 0.00 H new ATOM 0 HA ASP A 8 13.857 -2.391 -2.658 1.00 0.00 H new ATOM 0 HB2 ASP A 8 15.203 -3.363 -4.519 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.625 -4.116 -4.401 1.00 0.00 H new ATOM 129 N ARG A 9 15.764 -0.905 -4.105 1.00 0.00 N ATOM 130 CA ARG A 9 16.595 0.308 -4.353 1.00 0.00 C ATOM 131 C ARG A 9 16.149 1.001 -5.646 1.00 0.00 C ATOM 132 O ARG A 9 16.029 2.210 -5.692 1.00 0.00 O ATOM 133 CB ARG A 9 18.074 -0.084 -4.452 1.00 0.00 C ATOM 134 CG ARG A 9 18.256 -1.215 -5.471 1.00 0.00 C ATOM 135 CD ARG A 9 18.862 -0.657 -6.764 1.00 0.00 C ATOM 136 NE ARG A 9 20.159 -1.344 -7.044 1.00 0.00 N ATOM 137 CZ ARG A 9 21.270 -0.953 -6.462 1.00 0.00 C ATOM 138 NH1 ARG A 9 21.275 0.051 -5.623 1.00 0.00 N ATOM 139 NH2 ARG A 9 22.386 -1.577 -6.725 1.00 0.00 N ATOM 0 H ARG A 9 16.280 -1.784 -4.067 1.00 0.00 H new ATOM 0 HA ARG A 9 16.464 1.000 -3.521 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.668 0.781 -4.748 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.439 -0.402 -3.476 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.905 -1.988 -5.058 1.00 0.00 H new ATOM 0 HG3 ARG A 9 17.295 -1.685 -5.682 1.00 0.00 H new ATOM 0 HD2 ARG A 9 18.173 -0.806 -7.595 1.00 0.00 H new ATOM 0 HD3 ARG A 9 19.020 0.417 -6.670 1.00 0.00 H new ATOM 0 HE ARG A 9 20.182 -2.128 -7.696 1.00 0.00 H new ATOM 0 HH11 ARG A 9 20.407 0.543 -5.412 1.00 0.00 H new ATOM 0 HH12 ARG A 9 22.147 0.341 -5.180 1.00 0.00 H new ATOM 0 HH21 ARG A 9 22.390 -2.361 -7.378 1.00 0.00 H new ATOM 0 HH22 ARG A 9 23.254 -1.281 -6.278 1.00 0.00 H new ATOM 153 N ASP A 10 15.905 0.260 -6.697 1.00 0.00 N ATOM 154 CA ASP A 10 15.473 0.898 -7.976 1.00 0.00 C ATOM 155 C ASP A 10 14.053 1.449 -7.823 1.00 0.00 C ATOM 156 O ASP A 10 13.707 2.467 -8.391 1.00 0.00 O ATOM 157 CB ASP A 10 15.500 -0.144 -9.096 1.00 0.00 C ATOM 158 CG ASP A 10 16.905 -0.211 -9.697 1.00 0.00 C ATOM 159 OD1 ASP A 10 17.413 0.828 -10.084 1.00 0.00 O ATOM 160 OD2 ASP A 10 17.450 -1.301 -9.758 1.00 0.00 O ATOM 0 H ASP A 10 15.986 -0.756 -6.724 1.00 0.00 H new ATOM 0 HA ASP A 10 16.151 1.716 -8.221 1.00 0.00 H new ATOM 0 HB2 ASP A 10 15.213 -1.120 -8.706 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.775 0.117 -9.867 1.00 0.00 H new ATOM 165 N GLY A 11 13.235 0.793 -7.045 1.00 0.00 N ATOM 166 CA GLY A 11 11.843 1.290 -6.838 1.00 0.00 C ATOM 167 C GLY A 11 10.828 0.367 -7.523 1.00 0.00 C ATOM 168 O GLY A 11 9.842 0.822 -8.069 1.00 0.00 O ATOM 0 H GLY A 11 13.469 -0.064 -6.544 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.627 1.347 -5.771 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.750 2.300 -7.237 1.00 0.00 H new ATOM 172 N LEU A 12 11.043 -0.921 -7.482 1.00 0.00 N ATOM 173 CA LEU A 12 10.067 -1.859 -8.115 1.00 0.00 C ATOM 174 C LEU A 12 9.076 -2.316 -7.045 1.00 0.00 C ATOM 175 O LEU A 12 9.395 -2.344 -5.874 1.00 0.00 O ATOM 176 CB LEU A 12 10.813 -3.076 -8.678 1.00 0.00 C ATOM 177 CG LEU A 12 9.817 -4.101 -9.237 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.372 -3.680 -10.637 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.494 -5.471 -9.310 1.00 0.00 C ATOM 0 H LEU A 12 11.848 -1.364 -7.040 1.00 0.00 H new ATOM 0 HA LEU A 12 9.540 -1.360 -8.928 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.498 -2.759 -9.464 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.416 -3.535 -7.895 1.00 0.00 H new ATOM 0 HG LEU A 12 8.946 -4.153 -8.584 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.665 -4.411 -11.029 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.893 -2.702 -10.588 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.240 -3.626 -11.294 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.791 -6.204 -9.707 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.364 -5.412 -9.964 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.810 -5.774 -8.312 1.00 0.00 H new ATOM 191 N ILE A 13 7.881 -2.679 -7.427 1.00 0.00 N ATOM 192 CA ILE A 13 6.891 -3.142 -6.415 1.00 0.00 C ATOM 193 C ILE A 13 6.288 -4.477 -6.866 1.00 0.00 C ATOM 194 O ILE A 13 6.434 -5.486 -6.205 1.00 0.00 O ATOM 195 CB ILE A 13 5.778 -2.097 -6.231 1.00 0.00 C ATOM 196 CG1 ILE A 13 5.470 -1.387 -7.558 1.00 0.00 C ATOM 197 CG2 ILE A 13 6.229 -1.060 -5.201 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.952 -1.289 -7.741 1.00 0.00 C ATOM 0 H ILE A 13 7.550 -2.675 -8.392 1.00 0.00 H new ATOM 0 HA ILE A 13 7.398 -3.276 -5.459 1.00 0.00 H new ATOM 0 HB ILE A 13 4.876 -2.605 -5.889 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.913 -0.391 -7.562 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.913 -1.936 -8.389 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.444 -0.316 -5.066 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.428 -1.554 -4.250 1.00 0.00 H new ATOM 0 HG23 ILE A 13 7.137 -0.570 -5.552 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.731 -0.785 -8.682 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.522 -2.290 -7.755 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.522 -0.721 -6.916 1.00 0.00 H new ATOM 210 N GLY A 14 5.597 -4.489 -7.975 1.00 0.00 N ATOM 211 CA GLY A 14 4.973 -5.756 -8.455 1.00 0.00 C ATOM 212 C GLY A 14 5.955 -6.518 -9.347 1.00 0.00 C ATOM 213 O GLY A 14 6.733 -5.933 -10.075 1.00 0.00 O ATOM 0 H GLY A 14 5.438 -3.675 -8.569 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.686 -6.375 -7.605 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.061 -5.535 -9.010 1.00 0.00 H new ATOM 217 N LYS A 15 5.918 -7.823 -9.292 1.00 0.00 N ATOM 218 CA LYS A 15 6.838 -8.633 -10.138 1.00 0.00 C ATOM 219 C LYS A 15 6.098 -9.859 -10.667 1.00 0.00 C ATOM 220 O LYS A 15 6.116 -10.910 -10.056 1.00 0.00 O ATOM 221 CB LYS A 15 8.040 -9.088 -9.309 1.00 0.00 C ATOM 222 CG LYS A 15 9.199 -9.447 -10.245 1.00 0.00 C ATOM 223 CD LYS A 15 9.281 -10.969 -10.403 1.00 0.00 C ATOM 224 CE LYS A 15 10.468 -11.509 -9.599 1.00 0.00 C ATOM 225 NZ LYS A 15 11.153 -12.581 -10.377 1.00 0.00 N ATOM 0 H LYS A 15 5.289 -8.362 -8.697 1.00 0.00 H new ATOM 0 HA LYS A 15 7.184 -8.024 -10.973 1.00 0.00 H new ATOM 0 HB2 LYS A 15 8.343 -8.296 -8.624 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.770 -9.951 -8.700 1.00 0.00 H new ATOM 0 HG2 LYS A 15 9.052 -8.978 -11.218 1.00 0.00 H new ATOM 0 HG3 LYS A 15 10.136 -9.062 -9.843 1.00 0.00 H new ATOM 0 HD2 LYS A 15 8.356 -11.430 -10.058 1.00 0.00 H new ATOM 0 HD3 LYS A 15 9.394 -11.229 -11.455 1.00 0.00 H new ATOM 0 HE2 LYS A 15 11.167 -10.703 -9.378 1.00 0.00 H new ATOM 0 HE3 LYS A 15 10.123 -11.903 -8.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 11.958 -12.946 -9.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 10.484 -13.354 -10.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 11.495 -12.191 -11.278 1.00 0.00 H new ATOM 239 N ASP A 16 5.457 -9.749 -11.801 1.00 0.00 N ATOM 240 CA ASP A 16 4.732 -10.922 -12.364 1.00 0.00 C ATOM 241 C ASP A 16 3.727 -11.471 -11.345 1.00 0.00 C ATOM 242 O ASP A 16 3.718 -12.651 -11.053 1.00 0.00 O ATOM 243 CB ASP A 16 5.743 -12.016 -12.718 1.00 0.00 C ATOM 244 CG ASP A 16 6.588 -11.564 -13.911 1.00 0.00 C ATOM 245 OD1 ASP A 16 6.079 -11.599 -15.019 1.00 0.00 O ATOM 246 OD2 ASP A 16 7.730 -11.191 -13.696 1.00 0.00 O ATOM 0 H ASP A 16 5.405 -8.897 -12.360 1.00 0.00 H new ATOM 0 HA ASP A 16 4.191 -10.608 -13.257 1.00 0.00 H new ATOM 0 HB2 ASP A 16 6.385 -12.223 -11.862 1.00 0.00 H new ATOM 0 HB3 ASP A 16 5.222 -12.943 -12.958 1.00 0.00 H new ATOM 251 N GLY A 17 2.866 -10.641 -10.811 1.00 0.00 N ATOM 252 CA GLY A 17 1.861 -11.145 -9.833 1.00 0.00 C ATOM 253 C GLY A 17 2.423 -11.086 -8.410 1.00 0.00 C ATOM 254 O GLY A 17 2.234 -10.122 -7.694 1.00 0.00 O ATOM 0 H GLY A 17 2.817 -9.642 -11.010 1.00 0.00 H new ATOM 0 HA2 GLY A 17 0.951 -10.548 -9.896 1.00 0.00 H new ATOM 0 HA3 GLY A 17 1.587 -12.171 -10.080 1.00 0.00 H new ATOM 258 N HIS A 18 3.093 -12.124 -7.994 1.00 0.00 N ATOM 259 CA HIS A 18 3.653 -12.160 -6.612 1.00 0.00 C ATOM 260 C HIS A 18 4.836 -11.194 -6.481 1.00 0.00 C ATOM 261 O HIS A 18 5.514 -10.884 -7.444 1.00 0.00 O ATOM 262 CB HIS A 18 4.127 -13.582 -6.304 1.00 0.00 C ATOM 263 CG HIS A 18 5.158 -13.997 -7.319 1.00 0.00 C ATOM 264 ND1 HIS A 18 6.517 -13.829 -7.103 1.00 0.00 N ATOM 265 CD2 HIS A 18 5.045 -14.567 -8.564 1.00 0.00 C ATOM 266 CE1 HIS A 18 7.161 -14.288 -8.191 1.00 0.00 C ATOM 267 NE2 HIS A 18 6.311 -14.749 -9.112 1.00 0.00 N ATOM 0 H HIS A 18 3.279 -12.955 -8.555 1.00 0.00 H new ATOM 0 HA HIS A 18 2.877 -11.858 -5.909 1.00 0.00 H new ATOM 0 HB2 HIS A 18 4.550 -13.627 -5.301 1.00 0.00 H new ATOM 0 HB3 HIS A 18 3.283 -14.271 -6.325 1.00 0.00 H new ATOM 0 HD1 HIS A 18 6.950 -13.430 -6.270 1.00 0.00 H new ATOM 0 HD2 HIS A 18 4.115 -14.833 -9.044 1.00 0.00 H new ATOM 0 HE1 HIS A 18 8.235 -14.284 -8.306 1.00 0.00 H new ATOM 275 N LEU A 19 5.086 -10.718 -5.286 1.00 0.00 N ATOM 276 CA LEU A 19 6.226 -9.779 -5.070 1.00 0.00 C ATOM 277 C LEU A 19 7.519 -10.453 -5.542 1.00 0.00 C ATOM 278 O LEU A 19 7.563 -11.658 -5.688 1.00 0.00 O ATOM 279 CB LEU A 19 6.341 -9.448 -3.580 1.00 0.00 C ATOM 280 CG LEU A 19 5.398 -8.293 -3.237 1.00 0.00 C ATOM 281 CD1 LEU A 19 4.994 -8.387 -1.763 1.00 0.00 C ATOM 282 CD2 LEU A 19 6.108 -6.958 -3.489 1.00 0.00 C ATOM 0 H LEU A 19 4.547 -10.941 -4.449 1.00 0.00 H new ATOM 0 HA LEU A 19 6.059 -8.860 -5.631 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.091 -10.324 -2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.368 -9.177 -3.335 1.00 0.00 H new ATOM 0 HG LEU A 19 4.508 -8.353 -3.863 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.322 -7.565 -1.517 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.488 -9.336 -1.584 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.884 -8.328 -1.137 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.435 -6.136 -3.244 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.999 -6.896 -2.864 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.396 -6.891 -4.538 1.00 0.00 H new ATOM 294 N PRO A 20 8.534 -9.660 -5.776 1.00 0.00 N ATOM 295 CA PRO A 20 9.886 -10.102 -6.257 1.00 0.00 C ATOM 296 C PRO A 20 10.730 -10.630 -5.092 1.00 0.00 C ATOM 297 O PRO A 20 11.555 -11.506 -5.265 1.00 0.00 O ATOM 298 CB PRO A 20 10.548 -8.870 -6.871 1.00 0.00 C ATOM 299 CG PRO A 20 9.673 -7.675 -6.545 1.00 0.00 C ATOM 300 CD PRO A 20 8.568 -8.165 -5.616 1.00 0.00 C ATOM 0 HA PRO A 20 9.796 -10.911 -6.982 1.00 0.00 H new ATOM 0 HB2 PRO A 20 11.551 -8.732 -6.468 1.00 0.00 H new ATOM 0 HB3 PRO A 20 10.651 -8.987 -7.950 1.00 0.00 H new ATOM 0 HG2 PRO A 20 10.258 -6.889 -6.066 1.00 0.00 H new ATOM 0 HG3 PRO A 20 9.250 -7.248 -7.454 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.774 -7.887 -4.582 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.608 -7.721 -5.881 1.00 0.00 H new ATOM 308 N TRP A 21 10.550 -10.095 -3.913 1.00 0.00 N ATOM 309 CA TRP A 21 11.365 -10.559 -2.752 1.00 0.00 C ATOM 310 C TRP A 21 10.459 -11.121 -1.653 1.00 0.00 C ATOM 311 O TRP A 21 9.405 -10.588 -1.367 1.00 0.00 O ATOM 312 CB TRP A 21 12.147 -9.371 -2.188 1.00 0.00 C ATOM 313 CG TRP A 21 11.192 -8.261 -1.884 1.00 0.00 C ATOM 314 CD1 TRP A 21 10.412 -8.187 -0.780 1.00 0.00 C ATOM 315 CD2 TRP A 21 10.895 -7.076 -2.676 1.00 0.00 C ATOM 316 NE1 TRP A 21 9.651 -7.034 -0.847 1.00 0.00 N ATOM 317 CE2 TRP A 21 9.914 -6.315 -1.996 1.00 0.00 C ATOM 318 CE3 TRP A 21 11.375 -6.592 -3.905 1.00 0.00 C ATOM 319 CZ2 TRP A 21 9.425 -5.117 -2.519 1.00 0.00 C ATOM 320 CZ3 TRP A 21 10.885 -5.386 -4.434 1.00 0.00 C ATOM 321 CH2 TRP A 21 9.912 -4.652 -3.743 1.00 0.00 C ATOM 0 H TRP A 21 9.876 -9.359 -3.704 1.00 0.00 H new ATOM 0 HA TRP A 21 12.046 -11.342 -3.087 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.681 -9.666 -1.285 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.896 -9.038 -2.907 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.388 -8.910 0.022 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.978 -6.750 -0.135 1.00 0.00 H new ATOM 0 HE3 TRP A 21 12.125 -7.150 -4.446 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.676 -4.554 -1.982 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.261 -5.023 -5.379 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.539 -3.727 -4.157 1.00 0.00 H new ATOM 332 N HIS A 22 10.872 -12.191 -1.029 1.00 0.00 N ATOM 333 CA HIS A 22 10.051 -12.783 0.064 1.00 0.00 C ATOM 334 C HIS A 22 10.571 -12.263 1.408 1.00 0.00 C ATOM 335 O HIS A 22 11.558 -12.744 1.929 1.00 0.00 O ATOM 336 CB HIS A 22 10.165 -14.308 0.024 1.00 0.00 C ATOM 337 CG HIS A 22 8.968 -14.918 0.701 1.00 0.00 C ATOM 338 ND1 HIS A 22 9.051 -16.091 1.434 1.00 0.00 N ATOM 339 CD2 HIS A 22 7.653 -14.528 0.765 1.00 0.00 C ATOM 340 CE1 HIS A 22 7.820 -16.363 1.904 1.00 0.00 C ATOM 341 NE2 HIS A 22 6.930 -15.442 1.525 1.00 0.00 N ATOM 0 H HIS A 22 11.744 -12.681 -1.230 1.00 0.00 H new ATOM 0 HA HIS A 22 9.006 -12.501 -0.063 1.00 0.00 H new ATOM 0 HB2 HIS A 22 10.227 -14.652 -1.009 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.080 -14.628 0.522 1.00 0.00 H new ATOM 0 HD2 HIS A 22 7.242 -13.646 0.297 1.00 0.00 H new ATOM 0 HE1 HIS A 22 7.581 -17.222 2.514 1.00 0.00 H new ATOM 0 HE2 HIS A 22 5.934 -15.415 1.745 1.00 0.00 H new ATOM 349 N LEU A 23 9.916 -11.281 1.971 1.00 0.00 N ATOM 350 CA LEU A 23 10.375 -10.726 3.278 1.00 0.00 C ATOM 351 C LEU A 23 9.227 -10.795 4.293 1.00 0.00 C ATOM 352 O LEU A 23 8.275 -10.047 4.193 1.00 0.00 O ATOM 353 CB LEU A 23 10.801 -9.264 3.089 1.00 0.00 C ATOM 354 CG LEU A 23 11.531 -8.771 4.343 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.937 -9.374 4.386 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.634 -7.239 4.311 1.00 0.00 C ATOM 0 H LEU A 23 9.083 -10.840 1.582 1.00 0.00 H new ATOM 0 HA LEU A 23 11.221 -11.308 3.644 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.452 -9.175 2.219 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.926 -8.642 2.898 1.00 0.00 H new ATOM 0 HG LEU A 23 10.975 -9.079 5.228 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.456 -9.023 5.278 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.866 -10.461 4.411 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.492 -9.067 3.499 1.00 0.00 H new ATOM 0 HD21 LEU A 23 12.153 -6.891 5.204 1.00 0.00 H new ATOM 0 HD22 LEU A 23 12.188 -6.930 3.425 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.633 -6.808 4.282 1.00 0.00 H new ATOM 368 N PRO A 24 9.350 -11.690 5.244 1.00 0.00 N ATOM 369 CA PRO A 24 8.345 -11.925 6.339 1.00 0.00 C ATOM 370 C PRO A 24 8.260 -10.688 7.236 1.00 0.00 C ATOM 371 O PRO A 24 7.199 -10.318 7.700 1.00 0.00 O ATOM 372 CB PRO A 24 8.822 -13.129 7.146 1.00 0.00 C ATOM 373 CG PRO A 24 10.141 -13.587 6.563 1.00 0.00 C ATOM 374 CD PRO A 24 10.504 -12.643 5.423 1.00 0.00 C ATOM 0 HA PRO A 24 7.355 -12.113 5.924 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.941 -12.861 8.196 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.087 -13.932 7.103 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.919 -13.579 7.327 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.062 -14.611 6.199 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.420 -12.098 5.652 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.687 -13.202 4.505 1.00 0.00 H new ATOM 382 N ASP A 25 9.371 -10.044 7.480 1.00 0.00 N ATOM 383 CA ASP A 25 9.357 -8.829 8.343 1.00 0.00 C ATOM 384 C ASP A 25 8.578 -7.713 7.642 1.00 0.00 C ATOM 385 O ASP A 25 8.002 -6.852 8.279 1.00 0.00 O ATOM 386 CB ASP A 25 10.794 -8.368 8.596 1.00 0.00 C ATOM 387 CG ASP A 25 10.868 -7.647 9.944 1.00 0.00 C ATOM 388 OD1 ASP A 25 10.280 -6.584 10.058 1.00 0.00 O ATOM 389 OD2 ASP A 25 11.511 -8.171 10.838 1.00 0.00 O ATOM 0 H ASP A 25 10.287 -10.308 7.118 1.00 0.00 H new ATOM 0 HA ASP A 25 8.878 -9.063 9.293 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.468 -9.225 8.592 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.120 -7.702 7.797 1.00 0.00 H new ATOM 394 N ASP A 26 8.557 -7.720 6.336 1.00 0.00 N ATOM 395 CA ASP A 26 7.815 -6.659 5.597 1.00 0.00 C ATOM 396 C ASP A 26 6.311 -6.916 5.728 1.00 0.00 C ATOM 397 O ASP A 26 5.536 -6.003 5.937 1.00 0.00 O ATOM 398 CB ASP A 26 8.232 -6.680 4.121 1.00 0.00 C ATOM 399 CG ASP A 26 7.349 -5.729 3.307 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.253 -4.565 3.675 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.774 -6.187 2.337 1.00 0.00 O ATOM 0 H ASP A 26 9.021 -8.414 5.750 1.00 0.00 H new ATOM 0 HA ASP A 26 8.048 -5.680 6.015 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.278 -6.387 4.027 1.00 0.00 H new ATOM 0 HB3 ASP A 26 8.148 -7.693 3.726 1.00 0.00 H new ATOM 406 N LEU A 27 5.888 -8.151 5.615 1.00 0.00 N ATOM 407 CA LEU A 27 4.433 -8.456 5.742 1.00 0.00 C ATOM 408 C LEU A 27 3.919 -7.914 7.078 1.00 0.00 C ATOM 409 O LEU A 27 2.927 -7.213 7.133 1.00 0.00 O ATOM 410 CB LEU A 27 4.220 -9.971 5.691 1.00 0.00 C ATOM 411 CG LEU A 27 4.440 -10.470 4.261 1.00 0.00 C ATOM 412 CD1 LEU A 27 4.772 -11.963 4.289 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.168 -10.245 3.439 1.00 0.00 C ATOM 0 H LEU A 27 6.487 -8.958 5.441 1.00 0.00 H new ATOM 0 HA LEU A 27 3.889 -7.987 4.922 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.911 -10.469 6.371 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.212 -10.218 6.023 1.00 0.00 H new ATOM 0 HG LEU A 27 5.266 -9.922 3.808 1.00 0.00 H new ATOM 0 HD11 LEU A 27 4.929 -12.320 3.271 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.678 -12.123 4.874 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.946 -12.511 4.742 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.325 -10.601 2.421 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.341 -10.793 3.891 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.931 -9.181 3.419 1.00 0.00 H new ATOM 425 N HIS A 28 4.596 -8.223 8.155 1.00 0.00 N ATOM 426 CA HIS A 28 4.156 -7.715 9.487 1.00 0.00 C ATOM 427 C HIS A 28 4.040 -6.190 9.424 1.00 0.00 C ATOM 428 O HIS A 28 3.152 -5.598 10.005 1.00 0.00 O ATOM 429 CB HIS A 28 5.187 -8.105 10.549 1.00 0.00 C ATOM 430 CG HIS A 28 5.283 -9.604 10.630 1.00 0.00 C ATOM 431 ND1 HIS A 28 4.170 -10.407 10.824 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.353 -10.460 10.545 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.591 -11.685 10.850 1.00 0.00 C ATOM 434 NE2 HIS A 28 5.914 -11.774 10.684 1.00 0.00 N ATOM 0 H HIS A 28 5.434 -8.805 8.168 1.00 0.00 H new ATOM 0 HA HIS A 28 3.190 -8.149 9.747 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.160 -7.681 10.300 1.00 0.00 H new ATOM 0 HB3 HIS A 28 4.900 -7.696 11.517 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.379 -10.160 10.393 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.939 -12.535 10.988 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.480 -12.622 10.664 1.00 0.00 H new ATOM 442 N TYR A 29 4.927 -5.556 8.704 1.00 0.00 N ATOM 443 CA TYR A 29 4.872 -4.072 8.577 1.00 0.00 C ATOM 444 C TYR A 29 3.567 -3.679 7.879 1.00 0.00 C ATOM 445 O TYR A 29 2.949 -2.685 8.206 1.00 0.00 O ATOM 446 CB TYR A 29 6.064 -3.594 7.745 1.00 0.00 C ATOM 447 CG TYR A 29 6.100 -2.085 7.724 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.537 -1.379 8.852 1.00 0.00 C ATOM 449 CD2 TYR A 29 5.702 -1.391 6.575 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.577 0.020 8.830 1.00 0.00 C ATOM 451 CE2 TYR A 29 5.740 0.008 6.554 1.00 0.00 C ATOM 452 CZ TYR A 29 6.178 0.714 7.681 1.00 0.00 C ATOM 453 OH TYR A 29 6.219 2.093 7.659 1.00 0.00 O ATOM 0 H TYR A 29 5.690 -6.005 8.197 1.00 0.00 H new ATOM 0 HA TYR A 29 4.911 -3.611 9.564 1.00 0.00 H new ATOM 0 HB2 TYR A 29 6.992 -3.983 8.165 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.988 -3.979 6.728 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.843 -1.914 9.739 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.366 -1.935 5.705 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.916 0.564 9.699 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.431 0.543 5.668 1.00 0.00 H new ATOM 0 HH TYR A 29 5.321 2.444 7.485 1.00 0.00 H new ATOM 463 N PHE A 30 3.149 -4.458 6.917 1.00 0.00 N ATOM 464 CA PHE A 30 1.887 -4.145 6.185 1.00 0.00 C ATOM 465 C PHE A 30 0.693 -4.312 7.129 1.00 0.00 C ATOM 466 O PHE A 30 -0.163 -3.454 7.219 1.00 0.00 O ATOM 467 CB PHE A 30 1.736 -5.104 5.002 1.00 0.00 C ATOM 468 CG PHE A 30 0.544 -4.699 4.166 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.454 -3.399 3.654 1.00 0.00 C ATOM 470 CD2 PHE A 30 -0.469 -5.628 3.898 1.00 0.00 C ATOM 471 CE1 PHE A 30 -0.649 -3.029 2.875 1.00 0.00 C ATOM 472 CE2 PHE A 30 -1.572 -5.258 3.119 1.00 0.00 C ATOM 473 CZ PHE A 30 -1.662 -3.958 2.608 1.00 0.00 C ATOM 0 H PHE A 30 3.630 -5.302 6.605 1.00 0.00 H new ATOM 0 HA PHE A 30 1.922 -3.118 5.822 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.640 -5.091 4.393 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.609 -6.125 5.363 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.235 -2.682 3.860 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.399 -6.631 4.293 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.719 -2.026 2.480 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.353 -5.975 2.913 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.513 -3.671 2.008 1.00 0.00 H new ATOM 483 N ARG A 31 0.630 -5.411 7.831 1.00 0.00 N ATOM 484 CA ARG A 31 -0.508 -5.641 8.767 1.00 0.00 C ATOM 485 C ARG A 31 -0.492 -4.580 9.870 1.00 0.00 C ATOM 486 O ARG A 31 -1.402 -3.782 9.988 1.00 0.00 O ATOM 487 CB ARG A 31 -0.365 -7.029 9.397 1.00 0.00 C ATOM 488 CG ARG A 31 -1.709 -7.478 9.972 1.00 0.00 C ATOM 489 CD ARG A 31 -1.596 -8.925 10.457 1.00 0.00 C ATOM 490 NE ARG A 31 -0.644 -8.992 11.605 1.00 0.00 N ATOM 491 CZ ARG A 31 -0.157 -10.143 12.007 1.00 0.00 C ATOM 492 NH1 ARG A 31 -0.499 -11.258 11.413 1.00 0.00 N ATOM 493 NH2 ARG A 31 0.675 -10.176 13.011 1.00 0.00 N ATOM 0 H ARG A 31 1.320 -6.162 7.797 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.448 -5.577 8.220 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.022 -7.744 8.649 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.388 -7.005 10.185 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.000 -6.828 10.797 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.487 -7.397 9.213 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.575 -9.296 10.761 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -1.250 -9.566 9.646 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.369 -8.134 12.082 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -1.151 -11.239 10.629 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -0.114 -12.146 11.735 1.00 0.00 H new ATOM 0 HH21 ARG A 31 0.944 -9.311 13.479 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.057 -11.067 13.328 1.00 0.00 H new ATOM 507 N ALA A 32 0.533 -4.576 10.682 1.00 0.00 N ATOM 508 CA ALA A 32 0.624 -3.582 11.796 1.00 0.00 C ATOM 509 C ALA A 32 0.294 -2.170 11.292 1.00 0.00 C ATOM 510 O ALA A 32 -0.337 -1.391 11.980 1.00 0.00 O ATOM 511 CB ALA A 32 2.043 -3.593 12.366 1.00 0.00 C ATOM 0 H ALA A 32 1.318 -5.224 10.621 1.00 0.00 H new ATOM 0 HA ALA A 32 -0.095 -3.856 12.568 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.114 -2.870 13.178 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.275 -4.588 12.745 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.752 -3.329 11.582 1.00 0.00 H new ATOM 517 N GLN A 33 0.731 -1.825 10.110 1.00 0.00 N ATOM 518 CA GLN A 33 0.459 -0.456 9.579 1.00 0.00 C ATOM 519 C GLN A 33 -1.015 -0.306 9.179 1.00 0.00 C ATOM 520 O GLN A 33 -1.503 0.795 9.008 1.00 0.00 O ATOM 521 CB GLN A 33 1.338 -0.211 8.352 1.00 0.00 C ATOM 522 CG GLN A 33 2.733 0.234 8.800 1.00 0.00 C ATOM 523 CD GLN A 33 2.914 1.723 8.499 1.00 0.00 C ATOM 524 OE1 GLN A 33 3.769 2.097 7.723 1.00 0.00 O ATOM 525 NE2 GLN A 33 2.138 2.593 9.086 1.00 0.00 N ATOM 0 H GLN A 33 1.265 -2.432 9.488 1.00 0.00 H new ATOM 0 HA GLN A 33 0.684 0.271 10.360 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.409 -1.121 7.756 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.888 0.552 7.717 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.860 0.050 9.867 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.496 -0.348 8.283 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.420 2.278 9.738 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.250 3.588 8.893 1.00 0.00 H new ATOM 534 N THR A 34 -1.726 -1.390 9.014 1.00 0.00 N ATOM 535 CA THR A 34 -3.161 -1.277 8.613 1.00 0.00 C ATOM 536 C THR A 34 -4.058 -1.893 9.688 1.00 0.00 C ATOM 537 O THR A 34 -5.148 -2.353 9.407 1.00 0.00 O ATOM 538 CB THR A 34 -3.386 -2.002 7.281 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.849 -3.320 7.345 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.701 -1.226 6.153 1.00 0.00 C ATOM 0 H THR A 34 -1.380 -2.341 9.138 1.00 0.00 H new ATOM 0 HA THR A 34 -3.413 -0.223 8.500 1.00 0.00 H new ATOM 0 HB THR A 34 -4.457 -2.062 7.086 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.879 -3.285 7.212 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.862 -1.742 5.207 1.00 0.00 H new ATOM 0 HG22 THR A 34 -3.121 -0.222 6.095 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.632 -1.160 6.354 1.00 0.00 H new ATOM 548 N VAL A 35 -3.617 -1.898 10.917 1.00 0.00 N ATOM 549 CA VAL A 35 -4.456 -2.478 12.004 1.00 0.00 C ATOM 550 C VAL A 35 -5.535 -1.471 12.405 1.00 0.00 C ATOM 551 O VAL A 35 -5.247 -0.416 12.935 1.00 0.00 O ATOM 552 CB VAL A 35 -3.580 -2.796 13.218 1.00 0.00 C ATOM 553 CG1 VAL A 35 -2.550 -3.857 12.834 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.858 -1.526 13.681 1.00 0.00 C ATOM 0 H VAL A 35 -2.715 -1.527 11.214 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.925 -3.395 11.648 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.206 -3.169 14.029 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -1.924 -4.086 13.697 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.064 -4.762 12.508 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.926 -3.482 12.023 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.235 -1.756 14.545 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.232 -1.148 12.873 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.593 -0.769 13.955 1.00 0.00 H new ATOM 564 N GLY A 36 -6.777 -1.791 12.161 1.00 0.00 N ATOM 565 CA GLY A 36 -7.877 -0.858 12.534 1.00 0.00 C ATOM 566 C GLY A 36 -7.940 0.315 11.551 1.00 0.00 C ATOM 567 O GLY A 36 -8.582 1.310 11.818 1.00 0.00 O ATOM 0 H GLY A 36 -7.077 -2.660 11.719 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.828 -1.390 12.536 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.718 -0.485 13.546 1.00 0.00 H new ATOM 571 N LYS A 37 -7.274 0.218 10.426 1.00 0.00 N ATOM 572 CA LYS A 37 -7.300 1.342 9.440 1.00 0.00 C ATOM 573 C LYS A 37 -7.968 0.877 8.140 1.00 0.00 C ATOM 574 O LYS A 37 -8.163 -0.303 7.922 1.00 0.00 O ATOM 575 CB LYS A 37 -5.867 1.787 9.141 1.00 0.00 C ATOM 576 CG LYS A 37 -5.280 2.479 10.373 1.00 0.00 C ATOM 577 CD LYS A 37 -3.822 2.853 10.103 1.00 0.00 C ATOM 578 CE LYS A 37 -3.071 2.972 11.430 1.00 0.00 C ATOM 579 NZ LYS A 37 -3.310 4.320 12.018 1.00 0.00 N ATOM 0 H LYS A 37 -6.715 -0.589 10.149 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.865 2.175 9.858 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.257 0.926 8.869 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.856 2.467 8.289 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.857 3.372 10.611 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.343 1.819 11.238 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.352 2.097 9.474 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.772 3.796 9.559 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.406 2.198 12.120 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -2.004 2.817 11.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.799 4.401 12.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -2.970 5.051 11.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -4.328 4.451 12.184 1.00 0.00 H new ATOM 593 N ILE A 38 -8.322 1.796 7.274 1.00 0.00 N ATOM 594 CA ILE A 38 -8.972 1.404 5.988 1.00 0.00 C ATOM 595 C ILE A 38 -7.895 0.996 4.981 1.00 0.00 C ATOM 596 O ILE A 38 -7.038 1.783 4.633 1.00 0.00 O ATOM 597 CB ILE A 38 -9.754 2.591 5.415 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.763 3.098 6.449 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.496 2.152 4.149 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.512 4.306 5.878 1.00 0.00 C ATOM 0 H ILE A 38 -8.188 2.799 7.404 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.651 0.572 6.173 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.058 3.393 5.170 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.468 2.307 6.704 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.249 3.376 7.369 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.052 2.996 3.742 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.777 1.800 3.409 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.188 1.346 4.394 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -12.231 4.669 6.613 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.801 5.098 5.645 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.038 4.012 4.970 1.00 0.00 H new ATOM 612 N MET A 39 -7.930 -0.220 4.505 1.00 0.00 N ATOM 613 CA MET A 39 -6.905 -0.660 3.515 1.00 0.00 C ATOM 614 C MET A 39 -7.508 -0.612 2.110 1.00 0.00 C ATOM 615 O MET A 39 -8.328 -1.434 1.749 1.00 0.00 O ATOM 616 CB MET A 39 -6.462 -2.089 3.832 1.00 0.00 C ATOM 617 CG MET A 39 -5.194 -2.415 3.041 1.00 0.00 C ATOM 618 SD MET A 39 -5.060 -4.206 2.818 1.00 0.00 S ATOM 619 CE MET A 39 -6.569 -4.424 1.845 1.00 0.00 C ATOM 0 H MET A 39 -8.622 -0.926 4.758 1.00 0.00 H new ATOM 0 HA MET A 39 -6.041 0.003 3.567 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.275 -2.195 4.901 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.254 -2.792 3.576 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.221 -1.919 2.071 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.318 -2.038 3.568 1.00 0.00 H new ATOM 0 HE1 MET A 39 -6.480 -5.320 1.231 1.00 0.00 H new ATOM 0 HE2 MET A 39 -7.422 -4.527 2.515 1.00 0.00 H new ATOM 0 HE3 MET A 39 -6.716 -3.556 1.202 1.00 0.00 H new ATOM 629 N VAL A 40 -7.123 0.355 1.320 1.00 0.00 N ATOM 630 CA VAL A 40 -7.689 0.471 -0.054 1.00 0.00 C ATOM 631 C VAL A 40 -6.826 -0.314 -1.047 1.00 0.00 C ATOM 632 O VAL A 40 -5.657 -0.026 -1.247 1.00 0.00 O ATOM 633 CB VAL A 40 -7.720 1.946 -0.460 1.00 0.00 C ATOM 634 CG1 VAL A 40 -8.438 2.088 -1.800 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.467 2.753 0.605 1.00 0.00 C ATOM 0 H VAL A 40 -6.440 1.070 1.568 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.699 0.062 -0.063 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.700 2.320 -0.551 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.461 3.138 -2.091 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.908 1.513 -2.559 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.458 1.715 -1.708 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.489 3.804 0.316 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.487 2.380 0.695 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.957 2.651 1.563 1.00 0.00 H new ATOM 645 N VAL A 41 -7.406 -1.303 -1.676 1.00 0.00 N ATOM 646 CA VAL A 41 -6.646 -2.118 -2.664 1.00 0.00 C ATOM 647 C VAL A 41 -7.330 -2.042 -4.030 1.00 0.00 C ATOM 648 O VAL A 41 -8.347 -1.394 -4.199 1.00 0.00 O ATOM 649 CB VAL A 41 -6.609 -3.583 -2.213 1.00 0.00 C ATOM 650 CG1 VAL A 41 -5.647 -3.738 -1.037 1.00 0.00 C ATOM 651 CG2 VAL A 41 -8.011 -4.025 -1.785 1.00 0.00 C ATOM 0 H VAL A 41 -8.379 -1.581 -1.546 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.631 -1.728 -2.734 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.269 -4.203 -3.042 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.624 -4.781 -0.720 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.647 -3.430 -1.342 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.982 -3.114 -0.208 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.982 -5.067 -1.465 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -8.353 -3.401 -0.959 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.697 -3.923 -2.626 1.00 0.00 H new ATOM 661 N GLY A 42 -6.791 -2.729 -4.995 1.00 0.00 N ATOM 662 CA GLY A 42 -7.406 -2.735 -6.352 1.00 0.00 C ATOM 663 C GLY A 42 -7.892 -4.150 -6.678 1.00 0.00 C ATOM 664 O GLY A 42 -7.312 -5.126 -6.243 1.00 0.00 O ATOM 0 H GLY A 42 -5.945 -3.291 -4.903 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.239 -2.034 -6.390 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.679 -2.407 -7.095 1.00 0.00 H new ATOM 668 N ARG A 43 -8.962 -4.269 -7.425 1.00 0.00 N ATOM 669 CA ARG A 43 -9.508 -5.620 -7.771 1.00 0.00 C ATOM 670 C ARG A 43 -8.387 -6.575 -8.199 1.00 0.00 C ATOM 671 O ARG A 43 -8.512 -7.777 -8.070 1.00 0.00 O ATOM 672 CB ARG A 43 -10.516 -5.487 -8.916 1.00 0.00 C ATOM 673 CG ARG A 43 -11.363 -6.762 -9.004 1.00 0.00 C ATOM 674 CD ARG A 43 -11.081 -7.480 -10.326 1.00 0.00 C ATOM 675 NE ARG A 43 -11.611 -6.664 -11.456 1.00 0.00 N ATOM 676 CZ ARG A 43 -11.624 -7.138 -12.678 1.00 0.00 C ATOM 677 NH1 ARG A 43 -11.197 -8.348 -12.932 1.00 0.00 N ATOM 678 NH2 ARG A 43 -12.081 -6.398 -13.652 1.00 0.00 N ATOM 0 H ARG A 43 -9.485 -3.484 -7.813 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.995 -6.028 -6.885 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -11.158 -4.622 -8.750 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.993 -5.320 -9.857 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -11.134 -7.420 -8.166 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.422 -6.512 -8.934 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -10.009 -7.635 -10.447 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -11.548 -8.465 -10.324 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.968 -5.726 -11.276 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.848 -8.935 -12.174 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -11.213 -8.704 -13.888 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.425 -5.457 -13.460 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -12.094 -6.761 -14.605 1.00 0.00 H new ATOM 692 N ARG A 44 -7.294 -6.062 -8.698 1.00 0.00 N ATOM 693 CA ARG A 44 -6.181 -6.960 -9.116 1.00 0.00 C ATOM 694 C ARG A 44 -5.433 -7.440 -7.870 1.00 0.00 C ATOM 695 O ARG A 44 -5.100 -8.603 -7.743 1.00 0.00 O ATOM 696 CB ARG A 44 -5.223 -6.199 -10.034 1.00 0.00 C ATOM 697 CG ARG A 44 -5.887 -5.972 -11.394 1.00 0.00 C ATOM 698 CD ARG A 44 -5.462 -7.075 -12.364 1.00 0.00 C ATOM 699 NE ARG A 44 -6.374 -7.075 -13.545 1.00 0.00 N ATOM 700 CZ ARG A 44 -7.596 -7.539 -13.444 1.00 0.00 C ATOM 701 NH1 ARG A 44 -8.039 -8.015 -12.309 1.00 0.00 N ATOM 702 NH2 ARG A 44 -8.381 -7.523 -14.487 1.00 0.00 N ATOM 0 H ARG A 44 -7.125 -5.065 -8.833 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.582 -7.818 -9.655 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.955 -5.243 -9.585 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.298 -6.763 -10.159 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.971 -5.969 -11.284 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.604 -4.997 -11.790 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.433 -6.915 -12.685 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -5.494 -8.044 -11.866 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.044 -6.711 -14.439 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.432 -8.028 -11.490 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -8.992 -8.373 -12.243 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -8.043 -7.151 -15.374 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -9.333 -7.883 -14.415 1.00 0.00 H new ATOM 716 N THR A 45 -5.174 -6.554 -6.943 1.00 0.00 N ATOM 717 CA THR A 45 -4.457 -6.964 -5.702 1.00 0.00 C ATOM 718 C THR A 45 -5.386 -7.824 -4.843 1.00 0.00 C ATOM 719 O THR A 45 -5.018 -8.896 -4.404 1.00 0.00 O ATOM 720 CB THR A 45 -4.033 -5.723 -4.912 1.00 0.00 C ATOM 721 OG1 THR A 45 -3.602 -4.714 -5.815 1.00 0.00 O ATOM 722 CG2 THR A 45 -2.888 -6.088 -3.965 1.00 0.00 C ATOM 0 H THR A 45 -5.428 -5.567 -6.993 1.00 0.00 H new ATOM 0 HA THR A 45 -3.569 -7.537 -5.970 1.00 0.00 H new ATOM 0 HB THR A 45 -4.878 -5.353 -4.331 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.589 -5.074 -6.726 1.00 0.00 H new ATOM 0 HG21 THR A 45 -2.586 -5.205 -3.402 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.220 -6.862 -3.274 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.041 -6.457 -4.543 1.00 0.00 H new ATOM 730 N TYR A 46 -6.592 -7.372 -4.603 1.00 0.00 N ATOM 731 CA TYR A 46 -7.548 -8.171 -3.778 1.00 0.00 C ATOM 732 C TYR A 46 -7.674 -9.579 -4.362 1.00 0.00 C ATOM 733 O TYR A 46 -7.776 -10.554 -3.643 1.00 0.00 O ATOM 734 CB TYR A 46 -8.915 -7.484 -3.796 1.00 0.00 C ATOM 735 CG TYR A 46 -9.810 -8.097 -2.746 1.00 0.00 C ATOM 736 CD1 TYR A 46 -9.733 -7.660 -1.418 1.00 0.00 C ATOM 737 CD2 TYR A 46 -10.719 -9.100 -3.101 1.00 0.00 C ATOM 738 CE1 TYR A 46 -10.566 -8.227 -0.445 1.00 0.00 C ATOM 739 CE2 TYR A 46 -11.551 -9.667 -2.129 1.00 0.00 C ATOM 740 CZ TYR A 46 -11.475 -9.231 -0.802 1.00 0.00 C ATOM 741 OH TYR A 46 -12.296 -9.790 0.156 1.00 0.00 O ATOM 0 H TYR A 46 -6.956 -6.482 -4.944 1.00 0.00 H new ATOM 0 HA TYR A 46 -7.184 -8.239 -2.753 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.798 -6.417 -3.609 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.371 -7.587 -4.781 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -9.032 -6.886 -1.144 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.778 -9.437 -4.125 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -10.507 -7.890 0.580 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -12.252 -10.441 -2.403 1.00 0.00 H new ATOM 0 HH TYR A 46 -12.867 -10.470 -0.259 1.00 0.00 H new ATOM 751 N GLU A 47 -7.658 -9.691 -5.663 1.00 0.00 N ATOM 752 CA GLU A 47 -7.767 -11.033 -6.301 1.00 0.00 C ATOM 753 C GLU A 47 -6.434 -11.777 -6.157 1.00 0.00 C ATOM 754 O GLU A 47 -6.369 -12.982 -6.303 1.00 0.00 O ATOM 755 CB GLU A 47 -8.099 -10.864 -7.785 1.00 0.00 C ATOM 756 CG GLU A 47 -9.616 -10.751 -7.962 1.00 0.00 C ATOM 757 CD GLU A 47 -10.037 -11.473 -9.244 1.00 0.00 C ATOM 758 OE1 GLU A 47 -9.647 -11.024 -10.309 1.00 0.00 O ATOM 759 OE2 GLU A 47 -10.742 -12.463 -9.138 1.00 0.00 O ATOM 0 H GLU A 47 -7.574 -8.909 -6.312 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.556 -11.605 -5.814 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.609 -9.973 -8.178 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.719 -11.714 -8.352 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -10.126 -11.186 -7.103 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.910 -9.702 -8.010 1.00 0.00 H new ATOM 766 N SER A 48 -5.371 -11.067 -5.874 1.00 0.00 N ATOM 767 CA SER A 48 -4.045 -11.732 -5.724 1.00 0.00 C ATOM 768 C SER A 48 -3.723 -11.938 -4.238 1.00 0.00 C ATOM 769 O SER A 48 -2.878 -12.740 -3.890 1.00 0.00 O ATOM 770 CB SER A 48 -2.964 -10.861 -6.363 1.00 0.00 C ATOM 771 OG SER A 48 -1.805 -11.651 -6.599 1.00 0.00 O ATOM 0 H SER A 48 -5.366 -10.056 -5.741 1.00 0.00 H new ATOM 0 HA SER A 48 -4.076 -12.703 -6.219 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.327 -10.438 -7.300 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.721 -10.024 -5.709 1.00 0.00 H new ATOM 0 HG SER A 48 -1.109 -11.097 -7.010 1.00 0.00 H new ATOM 777 N PHE A 49 -4.383 -11.225 -3.356 1.00 0.00 N ATOM 778 CA PHE A 49 -4.103 -11.392 -1.895 1.00 0.00 C ATOM 779 C PHE A 49 -4.211 -12.881 -1.524 1.00 0.00 C ATOM 780 O PHE A 49 -4.849 -13.641 -2.225 1.00 0.00 O ATOM 781 CB PHE A 49 -5.124 -10.589 -1.080 1.00 0.00 C ATOM 782 CG PHE A 49 -4.534 -9.256 -0.666 1.00 0.00 C ATOM 783 CD1 PHE A 49 -3.674 -9.176 0.438 1.00 0.00 C ATOM 784 CD2 PHE A 49 -4.860 -8.096 -1.379 1.00 0.00 C ATOM 785 CE1 PHE A 49 -3.143 -7.939 0.826 1.00 0.00 C ATOM 786 CE2 PHE A 49 -4.328 -6.860 -0.991 1.00 0.00 C ATOM 787 CZ PHE A 49 -3.469 -6.782 0.111 1.00 0.00 C ATOM 0 H PHE A 49 -5.101 -10.537 -3.584 1.00 0.00 H new ATOM 0 HA PHE A 49 -3.099 -11.030 -1.674 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -6.025 -10.428 -1.671 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.419 -11.154 -0.196 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.420 -10.069 0.990 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.523 -8.154 -2.230 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.482 -7.879 1.678 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -4.581 -5.967 -1.543 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.058 -5.829 0.409 1.00 0.00 H new ATOM 797 N PRO A 50 -3.581 -13.254 -0.437 1.00 0.00 N ATOM 798 CA PRO A 50 -3.537 -14.650 0.114 1.00 0.00 C ATOM 799 C PRO A 50 -4.788 -14.934 0.953 1.00 0.00 C ATOM 800 O PRO A 50 -5.491 -15.899 0.726 1.00 0.00 O ATOM 801 CB PRO A 50 -2.290 -14.722 0.991 1.00 0.00 C ATOM 802 CG PRO A 50 -1.812 -13.300 1.214 1.00 0.00 C ATOM 803 CD PRO A 50 -2.778 -12.376 0.478 1.00 0.00 C ATOM 0 HA PRO A 50 -3.507 -15.389 -0.686 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -2.516 -15.205 1.942 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -1.515 -15.317 0.508 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.790 -13.064 2.278 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -0.797 -13.172 0.838 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -3.425 -11.850 1.180 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -2.237 -11.617 -0.087 1.00 0.00 H new ATOM 811 N LYS A 51 -5.067 -14.104 1.924 1.00 0.00 N ATOM 812 CA LYS A 51 -6.268 -14.332 2.779 1.00 0.00 C ATOM 813 C LYS A 51 -7.125 -13.066 2.811 1.00 0.00 C ATOM 814 O LYS A 51 -6.843 -12.133 3.537 1.00 0.00 O ATOM 815 CB LYS A 51 -5.820 -14.680 4.201 1.00 0.00 C ATOM 816 CG LYS A 51 -6.712 -15.788 4.764 1.00 0.00 C ATOM 817 CD LYS A 51 -6.390 -16.001 6.244 1.00 0.00 C ATOM 818 CE LYS A 51 -5.267 -17.032 6.380 1.00 0.00 C ATOM 819 NZ LYS A 51 -3.968 -16.411 5.990 1.00 0.00 N ATOM 0 H LYS A 51 -4.516 -13.279 2.161 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.854 -15.154 2.368 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -4.779 -15.004 4.196 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.875 -13.796 4.837 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -7.762 -15.520 4.644 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -6.554 -16.713 4.210 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -6.089 -15.058 6.701 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.278 -16.343 6.775 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.215 -17.394 7.407 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -5.473 -17.895 5.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -3.209 -16.786 6.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -3.762 -16.633 4.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.027 -15.380 6.109 1.00 0.00 H new ATOM 833 N ARG A 52 -8.174 -13.028 2.034 1.00 0.00 N ATOM 834 CA ARG A 52 -9.049 -11.822 2.023 1.00 0.00 C ATOM 835 C ARG A 52 -10.349 -12.127 2.779 1.00 0.00 C ATOM 836 O ARG A 52 -10.956 -13.157 2.563 1.00 0.00 O ATOM 837 CB ARG A 52 -9.384 -11.446 0.577 1.00 0.00 C ATOM 838 CG ARG A 52 -8.094 -11.345 -0.244 1.00 0.00 C ATOM 839 CD ARG A 52 -8.013 -12.521 -1.221 1.00 0.00 C ATOM 840 NE ARG A 52 -9.131 -12.429 -2.206 1.00 0.00 N ATOM 841 CZ ARG A 52 -9.237 -13.302 -3.180 1.00 0.00 C ATOM 842 NH1 ARG A 52 -8.366 -14.270 -3.308 1.00 0.00 N ATOM 843 NH2 ARG A 52 -10.222 -13.204 -4.030 1.00 0.00 N ATOM 0 H ARG A 52 -8.462 -13.779 1.407 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.529 -10.994 2.505 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -10.046 -12.194 0.141 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.917 -10.496 0.553 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.072 -10.403 -0.791 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.228 -11.349 0.418 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -7.055 -12.510 -1.741 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -8.070 -13.464 -0.677 1.00 0.00 H new ATOM 0 HE ARG A 52 -9.819 -11.681 -2.121 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -7.594 -14.352 -2.646 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -8.459 -14.942 -4.069 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -10.904 -12.452 -3.935 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -10.310 -13.880 -4.789 1.00 0.00 H new ATOM 857 N PRO A 53 -10.749 -11.217 3.637 1.00 0.00 N ATOM 858 CA PRO A 53 -10.064 -9.920 3.966 1.00 0.00 C ATOM 859 C PRO A 53 -9.049 -10.132 5.096 1.00 0.00 C ATOM 860 O PRO A 53 -8.907 -11.219 5.620 1.00 0.00 O ATOM 861 CB PRO A 53 -11.170 -8.978 4.431 1.00 0.00 C ATOM 862 CG PRO A 53 -12.368 -9.839 4.788 1.00 0.00 C ATOM 863 CD PRO A 53 -11.998 -11.286 4.465 1.00 0.00 C ATOM 0 HA PRO A 53 -9.523 -9.520 3.108 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.843 -8.396 5.293 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.427 -8.267 3.645 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.617 -9.732 5.844 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.246 -9.531 4.220 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.831 -11.859 5.377 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.801 -11.782 3.920 1.00 0.00 H new ATOM 871 N LEU A 54 -8.348 -9.096 5.475 1.00 0.00 N ATOM 872 CA LEU A 54 -7.346 -9.235 6.573 1.00 0.00 C ATOM 873 C LEU A 54 -8.080 -9.463 7.901 1.00 0.00 C ATOM 874 O LEU A 54 -9.195 -9.013 8.074 1.00 0.00 O ATOM 875 CB LEU A 54 -6.495 -7.965 6.667 1.00 0.00 C ATOM 876 CG LEU A 54 -5.442 -7.970 5.556 1.00 0.00 C ATOM 877 CD1 LEU A 54 -4.856 -6.565 5.395 1.00 0.00 C ATOM 878 CD2 LEU A 54 -4.322 -8.946 5.922 1.00 0.00 C ATOM 0 H LEU A 54 -8.425 -8.162 5.073 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.695 -10.083 6.363 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.129 -7.083 6.577 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.010 -7.911 7.642 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.907 -8.278 4.620 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.107 -6.572 4.603 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.652 -5.866 5.136 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.392 -6.255 6.331 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.571 -8.951 5.132 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.860 -8.635 6.859 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.735 -9.948 6.036 1.00 0.00 H new ATOM 890 N PRO A 55 -7.431 -10.163 8.800 1.00 0.00 N ATOM 891 CA PRO A 55 -7.954 -10.519 10.167 1.00 0.00 C ATOM 892 C PRO A 55 -8.081 -9.266 11.042 1.00 0.00 C ATOM 893 O PRO A 55 -7.147 -8.508 11.199 1.00 0.00 O ATOM 894 CB PRO A 55 -6.957 -11.492 10.792 1.00 0.00 C ATOM 895 CG PRO A 55 -5.768 -11.602 9.863 1.00 0.00 C ATOM 896 CD PRO A 55 -6.049 -10.740 8.637 1.00 0.00 C ATOM 0 HA PRO A 55 -8.944 -10.968 10.089 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -6.642 -11.138 11.774 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.418 -12.469 10.939 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -4.860 -11.267 10.364 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -5.607 -12.640 9.571 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.309 -9.945 8.549 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.987 -11.336 7.726 1.00 0.00 H new ATOM 904 N GLU A 56 -9.234 -9.061 11.628 1.00 0.00 N ATOM 905 CA GLU A 56 -9.444 -7.875 12.517 1.00 0.00 C ATOM 906 C GLU A 56 -8.944 -6.593 11.840 1.00 0.00 C ATOM 907 O GLU A 56 -8.345 -5.742 12.469 1.00 0.00 O ATOM 908 CB GLU A 56 -8.686 -8.089 13.829 1.00 0.00 C ATOM 909 CG GLU A 56 -9.616 -8.743 14.854 1.00 0.00 C ATOM 910 CD GLU A 56 -8.802 -9.195 16.068 1.00 0.00 C ATOM 911 OE1 GLU A 56 -8.143 -10.217 15.967 1.00 0.00 O ATOM 912 OE2 GLU A 56 -8.853 -8.513 17.078 1.00 0.00 O ATOM 0 H GLU A 56 -10.046 -9.670 11.528 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.511 -7.768 12.714 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.814 -8.720 13.659 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.320 -7.135 14.210 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -10.388 -8.038 15.163 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.125 -9.596 14.406 1.00 0.00 H new ATOM 919 N ARG A 57 -9.188 -6.447 10.566 1.00 0.00 N ATOM 920 CA ARG A 57 -8.731 -5.219 9.854 1.00 0.00 C ATOM 921 C ARG A 57 -9.773 -4.802 8.812 1.00 0.00 C ATOM 922 O ARG A 57 -10.396 -5.629 8.176 1.00 0.00 O ATOM 923 CB ARG A 57 -7.397 -5.502 9.165 1.00 0.00 C ATOM 924 CG ARG A 57 -6.295 -5.597 10.222 1.00 0.00 C ATOM 925 CD ARG A 57 -5.079 -6.314 9.635 1.00 0.00 C ATOM 926 NE ARG A 57 -4.908 -7.638 10.306 1.00 0.00 N ATOM 927 CZ ARG A 57 -4.572 -7.711 11.572 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.392 -6.627 12.281 1.00 0.00 N ATOM 929 NH2 ARG A 57 -4.427 -8.880 12.135 1.00 0.00 N ATOM 0 H ARG A 57 -9.684 -7.125 9.987 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.606 -4.409 10.573 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.456 -6.432 8.600 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.167 -4.710 8.453 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.014 -4.599 10.559 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.661 -6.137 11.095 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.209 -6.453 8.562 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.184 -5.707 9.772 1.00 0.00 H new ATOM 0 HE ARG A 57 -5.054 -8.495 9.773 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.513 -5.710 11.851 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.131 -6.698 13.264 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.575 -9.730 11.591 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.166 -8.943 13.119 1.00 0.00 H new ATOM 943 N THR A 58 -9.964 -3.519 8.636 1.00 0.00 N ATOM 944 CA THR A 58 -10.963 -3.038 7.638 1.00 0.00 C ATOM 945 C THR A 58 -10.297 -2.916 6.267 1.00 0.00 C ATOM 946 O THR A 58 -9.322 -2.210 6.099 1.00 0.00 O ATOM 947 CB THR A 58 -11.500 -1.671 8.069 1.00 0.00 C ATOM 948 OG1 THR A 58 -11.789 -1.694 9.460 1.00 0.00 O ATOM 949 CG2 THR A 58 -12.775 -1.353 7.285 1.00 0.00 C ATOM 0 H THR A 58 -9.470 -2.784 9.142 1.00 0.00 H new ATOM 0 HA THR A 58 -11.787 -3.749 7.579 1.00 0.00 H new ATOM 0 HB THR A 58 -10.751 -0.905 7.867 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.752 -1.821 9.592 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.158 -0.380 7.592 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.551 -1.335 6.218 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.526 -2.117 7.486 1.00 0.00 H new ATOM 957 N ASN A 59 -10.813 -3.608 5.288 1.00 0.00 N ATOM 958 CA ASN A 59 -10.210 -3.550 3.926 1.00 0.00 C ATOM 959 C ASN A 59 -11.248 -3.054 2.919 1.00 0.00 C ATOM 960 O ASN A 59 -12.390 -3.469 2.944 1.00 0.00 O ATOM 961 CB ASN A 59 -9.763 -4.955 3.519 1.00 0.00 C ATOM 962 CG ASN A 59 -8.834 -5.533 4.588 1.00 0.00 C ATOM 963 OD1 ASN A 59 -7.659 -5.719 4.348 1.00 0.00 O ATOM 964 ND2 ASN A 59 -9.318 -5.834 5.763 1.00 0.00 N ATOM 0 H ASN A 59 -11.629 -4.213 5.373 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.359 -2.869 3.938 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.632 -5.600 3.392 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.249 -4.919 2.558 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.708 -6.226 6.481 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -10.306 -5.677 5.963 1.00 0.00 H new ATOM 971 N VAL A 60 -10.863 -2.184 2.020 1.00 0.00 N ATOM 972 CA VAL A 60 -11.823 -1.684 0.998 1.00 0.00 C ATOM 973 C VAL A 60 -11.268 -2.048 -0.381 1.00 0.00 C ATOM 974 O VAL A 60 -10.109 -1.817 -0.665 1.00 0.00 O ATOM 975 CB VAL A 60 -11.947 -0.162 1.107 1.00 0.00 C ATOM 976 CG1 VAL A 60 -13.057 0.330 0.177 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.283 0.229 2.548 1.00 0.00 C ATOM 0 H VAL A 60 -9.921 -1.799 1.952 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.806 -2.130 1.150 1.00 0.00 H new ATOM 0 HB VAL A 60 -11.000 0.295 0.820 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -13.144 1.414 0.256 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.817 0.059 -0.851 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -14.002 -0.132 0.463 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.370 1.313 2.620 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.227 -0.231 2.839 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.491 -0.116 3.213 1.00 0.00 H new ATOM 987 N VAL A 61 -12.065 -2.632 -1.233 1.00 0.00 N ATOM 988 CA VAL A 61 -11.549 -3.019 -2.578 1.00 0.00 C ATOM 989 C VAL A 61 -12.041 -2.023 -3.631 1.00 0.00 C ATOM 990 O VAL A 61 -13.079 -1.410 -3.483 1.00 0.00 O ATOM 991 CB VAL A 61 -12.053 -4.422 -2.933 1.00 0.00 C ATOM 992 CG1 VAL A 61 -11.256 -4.964 -4.120 1.00 0.00 C ATOM 993 CG2 VAL A 61 -11.873 -5.357 -1.731 1.00 0.00 C ATOM 0 H VAL A 61 -13.044 -2.857 -1.059 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.459 -3.013 -2.558 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.110 -4.369 -3.194 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -11.614 -5.962 -4.373 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.386 -4.304 -4.977 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.199 -5.013 -3.857 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.233 -6.353 -1.988 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.817 -5.410 -1.466 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.441 -4.974 -0.883 1.00 0.00 H new ATOM 1003 N LEU A 62 -11.304 -1.865 -4.699 1.00 0.00 N ATOM 1004 CA LEU A 62 -11.730 -0.921 -5.771 1.00 0.00 C ATOM 1005 C LEU A 62 -11.936 -1.704 -7.067 1.00 0.00 C ATOM 1006 O LEU A 62 -11.059 -2.416 -7.516 1.00 0.00 O ATOM 1007 CB LEU A 62 -10.649 0.141 -5.984 1.00 0.00 C ATOM 1008 CG LEU A 62 -11.118 1.468 -5.388 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -10.861 1.460 -3.883 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -10.345 2.624 -6.034 1.00 0.00 C ATOM 0 H LEU A 62 -10.424 -2.350 -4.874 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.659 -0.431 -5.480 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.717 -0.173 -5.513 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.444 0.259 -7.048 1.00 0.00 H new ATOM 0 HG LEU A 62 -12.183 1.598 -5.578 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.194 2.404 -3.452 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -11.411 0.638 -3.424 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -9.795 1.332 -3.697 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.681 3.569 -5.608 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.279 2.499 -5.845 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.525 2.626 -7.109 1.00 0.00 H new ATOM 1022 N THR A 63 -13.090 -1.590 -7.667 1.00 0.00 N ATOM 1023 CA THR A 63 -13.341 -2.346 -8.928 1.00 0.00 C ATOM 1024 C THR A 63 -14.268 -1.548 -9.848 1.00 0.00 C ATOM 1025 O THR A 63 -15.002 -0.683 -9.413 1.00 0.00 O ATOM 1026 CB THR A 63 -13.995 -3.688 -8.589 1.00 0.00 C ATOM 1027 OG1 THR A 63 -14.160 -4.444 -9.779 1.00 0.00 O ATOM 1028 CG2 THR A 63 -15.362 -3.446 -7.942 1.00 0.00 C ATOM 0 H THR A 63 -13.864 -1.011 -7.342 1.00 0.00 H new ATOM 0 HA THR A 63 -12.393 -2.512 -9.439 1.00 0.00 H new ATOM 0 HB THR A 63 -13.360 -4.236 -7.893 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.451 -4.212 -10.415 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.825 -4.403 -7.702 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.234 -2.865 -7.029 1.00 0.00 H new ATOM 0 HG23 THR A 63 -16.000 -2.898 -8.635 1.00 0.00 H new ATOM 1036 N HIS A 64 -14.237 -1.843 -11.120 1.00 0.00 N ATOM 1037 CA HIS A 64 -15.114 -1.118 -12.083 1.00 0.00 C ATOM 1038 C HIS A 64 -16.399 -1.922 -12.318 1.00 0.00 C ATOM 1039 O HIS A 64 -17.233 -1.546 -13.119 1.00 0.00 O ATOM 1040 CB HIS A 64 -14.372 -0.947 -13.412 1.00 0.00 C ATOM 1041 CG HIS A 64 -13.851 0.460 -13.523 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -14.692 1.548 -13.691 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -12.577 0.971 -13.496 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -13.921 2.649 -13.758 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -12.623 2.353 -13.645 1.00 0.00 N ATOM 0 H HIS A 64 -13.639 -2.558 -11.535 1.00 0.00 H new ATOM 0 HA HIS A 64 -15.370 -0.140 -11.675 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.547 -1.657 -13.473 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -15.042 -1.164 -14.244 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.676 0.388 -13.377 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -14.305 3.650 -13.887 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -11.836 3.001 -13.664 1.00 0.00 H new ATOM 1053 N GLN A 65 -16.567 -3.026 -11.634 1.00 0.00 N ATOM 1054 CA GLN A 65 -17.796 -3.847 -11.828 1.00 0.00 C ATOM 1055 C GLN A 65 -18.971 -3.183 -11.108 1.00 0.00 C ATOM 1056 O GLN A 65 -18.817 -2.169 -10.454 1.00 0.00 O ATOM 1057 CB GLN A 65 -17.570 -5.248 -11.255 1.00 0.00 C ATOM 1058 CG GLN A 65 -16.983 -6.157 -12.338 1.00 0.00 C ATOM 1059 CD GLN A 65 -15.610 -5.631 -12.760 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -14.627 -5.652 -11.903 1.00 0.00 O flip ATOM 1061 NE2 GLN A 65 -15.429 -5.198 -13.881 1.00 0.00 N flip ATOM 0 H GLN A 65 -15.905 -3.392 -10.950 1.00 0.00 H new ATOM 0 HA GLN A 65 -18.019 -3.923 -12.892 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.893 -5.198 -10.402 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.512 -5.660 -10.892 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.893 -7.176 -11.962 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -17.651 -6.192 -13.199 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -16.197 -5.181 -14.552 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -14.509 -4.851 -14.151 1.00 0.00 H new ATOM 1070 N GLU A 66 -20.145 -3.744 -11.224 1.00 0.00 N ATOM 1071 CA GLU A 66 -21.330 -3.142 -10.550 1.00 0.00 C ATOM 1072 C GLU A 66 -21.893 -4.115 -9.510 1.00 0.00 C ATOM 1073 O GLU A 66 -22.513 -3.711 -8.546 1.00 0.00 O ATOM 1074 CB GLU A 66 -22.407 -2.839 -11.594 1.00 0.00 C ATOM 1075 CG GLU A 66 -22.087 -1.515 -12.291 1.00 0.00 C ATOM 1076 CD GLU A 66 -22.847 -0.379 -11.604 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -22.359 0.108 -10.597 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -23.903 -0.017 -12.095 1.00 0.00 O ATOM 0 H GLU A 66 -20.334 -4.593 -11.757 1.00 0.00 H new ATOM 0 HA GLU A 66 -21.028 -2.221 -10.051 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -22.455 -3.645 -12.326 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -23.385 -2.783 -11.117 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -21.015 -1.323 -12.255 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.366 -1.569 -13.343 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.697 -5.393 -9.702 1.00 0.00 N ATOM 1086 CA ASP A 67 -22.239 -6.382 -8.726 1.00 0.00 C ATOM 1087 C ASP A 67 -21.099 -7.026 -7.931 1.00 0.00 C ATOM 1088 O ASP A 67 -21.145 -8.198 -7.611 1.00 0.00 O ATOM 1089 CB ASP A 67 -23.009 -7.469 -9.478 1.00 0.00 C ATOM 1090 CG ASP A 67 -24.405 -6.952 -9.832 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -25.184 -6.733 -8.919 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -24.672 -6.784 -11.011 1.00 0.00 O ATOM 0 H ASP A 67 -21.187 -5.793 -10.490 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.905 -5.866 -8.035 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -22.472 -7.749 -10.385 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -23.087 -8.366 -8.864 1.00 0.00 H new ATOM 1097 N TYR A 68 -20.084 -6.273 -7.596 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.957 -6.853 -6.807 1.00 0.00 C ATOM 1099 C TYR A 68 -19.501 -7.360 -5.468 1.00 0.00 C ATOM 1100 O TYR A 68 -19.998 -6.596 -4.663 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.896 -5.777 -6.561 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.559 -6.431 -6.298 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.800 -6.923 -7.366 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -16.080 -6.545 -4.988 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -14.562 -7.529 -7.126 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -14.841 -7.152 -4.747 1.00 0.00 C ATOM 1107 CZ TYR A 68 -14.083 -7.644 -5.816 1.00 0.00 C ATOM 1108 OH TYR A 68 -12.861 -8.240 -5.579 1.00 0.00 O ATOM 0 H TYR A 68 -19.987 -5.286 -7.833 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.504 -7.678 -7.357 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.825 -5.118 -7.426 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -18.182 -5.158 -5.711 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -16.170 -6.835 -8.377 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.665 -6.165 -4.164 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.977 -7.908 -7.951 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.470 -7.240 -3.736 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.692 -8.267 -4.614 1.00 0.00 H new ATOM 1118 N GLN A 69 -19.416 -8.641 -5.224 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.936 -9.192 -3.940 1.00 0.00 C ATOM 1120 C GLN A 69 -18.777 -9.453 -2.977 1.00 0.00 C ATOM 1121 O GLN A 69 -18.006 -10.376 -3.154 1.00 0.00 O ATOM 1122 CB GLN A 69 -20.679 -10.502 -4.211 1.00 0.00 C ATOM 1123 CG GLN A 69 -21.889 -10.225 -5.105 1.00 0.00 C ATOM 1124 CD GLN A 69 -23.033 -9.663 -4.260 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -23.656 -10.382 -3.503 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.339 -8.398 -4.356 1.00 0.00 N ATOM 0 H GLN A 69 -19.009 -9.328 -5.858 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.618 -8.470 -3.491 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -20.013 -11.217 -4.693 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -21.002 -10.951 -3.272 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.620 -9.517 -5.889 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.206 -11.143 -5.600 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -22.817 -7.794 -4.991 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -24.100 -8.014 -3.796 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.656 -8.653 -1.952 1.00 0.00 N ATOM 1136 CA ALA A 70 -17.555 -8.857 -0.968 1.00 0.00 C ATOM 1137 C ALA A 70 -18.123 -8.768 0.450 1.00 0.00 C ATOM 1138 O ALA A 70 -18.048 -7.740 1.095 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.488 -7.778 -1.161 1.00 0.00 C ATOM 0 H ALA A 70 -19.273 -7.866 -1.754 1.00 0.00 H new ATOM 0 HA ALA A 70 -17.106 -9.838 -1.121 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.684 -7.929 -0.441 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -16.086 -7.841 -2.172 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.933 -6.795 -1.008 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.694 -9.837 0.937 1.00 0.00 N ATOM 1146 CA GLN A 71 -19.270 -9.816 2.311 1.00 0.00 C ATOM 1147 C GLN A 71 -18.137 -9.794 3.336 1.00 0.00 C ATOM 1148 O GLN A 71 -17.253 -10.628 3.317 1.00 0.00 O ATOM 1149 CB GLN A 71 -20.128 -11.065 2.527 1.00 0.00 C ATOM 1150 CG GLN A 71 -21.532 -10.831 1.958 1.00 0.00 C ATOM 1151 CD GLN A 71 -22.563 -10.897 3.087 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -23.060 -9.882 3.532 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -22.906 -12.059 3.573 1.00 0.00 N ATOM 0 H GLN A 71 -18.786 -10.724 0.442 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.889 -8.927 2.431 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -19.666 -11.924 2.040 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -20.190 -11.296 3.590 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -21.578 -9.859 1.466 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -21.758 -11.582 1.201 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -22.489 -12.911 3.199 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -23.591 -12.115 4.326 1.00 0.00 H new ATOM 1162 N GLY A 72 -18.158 -8.847 4.233 1.00 0.00 N ATOM 1163 CA GLY A 72 -17.085 -8.771 5.262 1.00 0.00 C ATOM 1164 C GLY A 72 -16.111 -7.648 4.906 1.00 0.00 C ATOM 1165 O GLY A 72 -15.609 -6.956 5.770 1.00 0.00 O ATOM 0 H GLY A 72 -18.873 -8.122 4.297 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -17.521 -8.590 6.244 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.554 -9.721 5.320 1.00 0.00 H new ATOM 1169 N ALA A 73 -15.830 -7.460 3.641 1.00 0.00 N ATOM 1170 CA ALA A 73 -14.881 -6.385 3.243 1.00 0.00 C ATOM 1171 C ALA A 73 -15.640 -5.251 2.550 1.00 0.00 C ATOM 1172 O ALA A 73 -16.546 -5.475 1.771 1.00 0.00 O ATOM 1173 CB ALA A 73 -13.837 -6.962 2.282 1.00 0.00 C ATOM 0 H ALA A 73 -16.218 -8.005 2.871 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.387 -5.993 4.132 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.140 -6.177 1.988 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.291 -7.765 2.777 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.336 -7.355 1.396 1.00 0.00 H new ATOM 1179 N VAL A 74 -15.254 -4.035 2.819 1.00 0.00 N ATOM 1180 CA VAL A 74 -15.928 -2.868 2.176 1.00 0.00 C ATOM 1181 C VAL A 74 -15.762 -2.972 0.658 1.00 0.00 C ATOM 1182 O VAL A 74 -14.893 -3.670 0.173 1.00 0.00 O ATOM 1183 CB VAL A 74 -15.285 -1.574 2.671 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -16.108 -0.375 2.196 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -15.233 -1.584 4.201 1.00 0.00 C ATOM 0 H VAL A 74 -14.497 -3.796 3.460 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.987 -2.866 2.432 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.274 -1.497 2.272 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -15.647 0.547 2.551 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.144 -0.367 1.107 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.121 -0.449 2.592 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -14.774 -0.661 4.556 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.245 -1.663 4.599 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.643 -2.436 4.539 1.00 0.00 H new ATOM 1195 N VAL A 75 -16.579 -2.286 -0.100 1.00 0.00 N ATOM 1196 CA VAL A 75 -16.455 -2.353 -1.585 1.00 0.00 C ATOM 1197 C VAL A 75 -16.769 -0.972 -2.170 1.00 0.00 C ATOM 1198 O VAL A 75 -17.790 -0.385 -1.871 1.00 0.00 O ATOM 1199 CB VAL A 75 -17.455 -3.377 -2.131 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -17.307 -3.484 -3.648 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -17.184 -4.745 -1.500 1.00 0.00 C ATOM 0 H VAL A 75 -17.326 -1.683 0.246 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.444 -2.651 -1.862 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.467 -3.055 -1.886 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.020 -4.213 -4.033 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.501 -2.512 -4.102 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.294 -3.803 -3.893 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.896 -5.473 -1.889 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.170 -5.063 -1.743 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.292 -4.674 -0.418 1.00 0.00 H new ATOM 1211 N VAL A 76 -15.901 -0.442 -2.994 1.00 0.00 N ATOM 1212 CA VAL A 76 -16.161 0.904 -3.582 1.00 0.00 C ATOM 1213 C VAL A 76 -15.832 0.892 -5.078 1.00 0.00 C ATOM 1214 O VAL A 76 -14.973 0.157 -5.533 1.00 0.00 O ATOM 1215 CB VAL A 76 -15.283 1.941 -2.880 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -15.687 2.044 -1.408 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -13.817 1.513 -2.975 1.00 0.00 C ATOM 0 H VAL A 76 -15.027 -0.882 -3.283 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.213 1.157 -3.447 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.414 2.911 -3.360 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.060 2.783 -0.910 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -16.732 2.347 -1.338 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -15.557 1.075 -0.926 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.189 2.251 -2.475 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.689 0.543 -2.495 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.527 1.440 -4.023 1.00 0.00 H new ATOM 1227 N HIS A 77 -16.517 1.696 -5.849 1.00 0.00 N ATOM 1228 CA HIS A 77 -16.255 1.735 -7.316 1.00 0.00 C ATOM 1229 C HIS A 77 -15.980 3.178 -7.741 1.00 0.00 C ATOM 1230 O HIS A 77 -16.204 3.550 -8.876 1.00 0.00 O ATOM 1231 CB HIS A 77 -17.483 1.220 -8.073 1.00 0.00 C ATOM 1232 CG HIS A 77 -17.959 -0.063 -7.453 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -17.511 -1.299 -7.884 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -18.837 -0.316 -6.429 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -18.114 -2.234 -7.128 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -18.934 -1.689 -6.225 1.00 0.00 N ATOM 0 H HIS A 77 -17.248 2.328 -5.524 1.00 0.00 H new ATOM 0 HA HIS A 77 -15.394 1.107 -7.545 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -18.278 1.965 -8.046 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -17.234 1.058 -9.122 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.371 0.436 -5.867 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -17.955 -3.297 -7.238 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -19.507 -2.174 -5.535 1.00 0.00 H new ATOM 1244 N ASP A 78 -15.494 3.994 -6.843 1.00 0.00 N ATOM 1245 CA ASP A 78 -15.206 5.409 -7.207 1.00 0.00 C ATOM 1246 C ASP A 78 -14.371 6.068 -6.108 1.00 0.00 C ATOM 1247 O ASP A 78 -14.818 6.232 -4.991 1.00 0.00 O ATOM 1248 CB ASP A 78 -16.522 6.172 -7.377 1.00 0.00 C ATOM 1249 CG ASP A 78 -16.423 7.098 -8.592 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -15.860 8.171 -8.449 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -16.909 6.718 -9.644 1.00 0.00 O ATOM 0 H ASP A 78 -15.285 3.741 -5.877 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.649 5.432 -8.143 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.347 5.471 -7.507 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -16.736 6.753 -6.480 1.00 0.00 H new ATOM 1256 N VAL A 79 -13.151 6.426 -6.416 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.258 7.070 -5.402 1.00 0.00 C ATOM 1258 C VAL A 79 -13.044 8.090 -4.562 1.00 0.00 C ATOM 1259 O VAL A 79 -12.802 8.251 -3.381 1.00 0.00 O ATOM 1260 CB VAL A 79 -11.120 7.786 -6.135 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.287 8.594 -5.138 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -10.230 6.750 -6.826 1.00 0.00 C ATOM 0 H VAL A 79 -12.730 6.299 -7.336 1.00 0.00 H new ATOM 0 HA VAL A 79 -11.860 6.305 -4.736 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.540 8.462 -6.880 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.479 9.101 -5.666 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.921 9.333 -4.649 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.866 7.924 -4.388 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.419 7.258 -7.349 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.813 6.073 -6.080 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.823 6.181 -7.542 1.00 0.00 H new ATOM 1272 N ALA A 80 -13.980 8.775 -5.162 1.00 0.00 N ATOM 1273 CA ALA A 80 -14.780 9.783 -4.402 1.00 0.00 C ATOM 1274 C ALA A 80 -15.494 9.106 -3.227 1.00 0.00 C ATOM 1275 O ALA A 80 -15.581 9.651 -2.142 1.00 0.00 O ATOM 1276 CB ALA A 80 -15.818 10.412 -5.333 1.00 0.00 C ATOM 0 H ALA A 80 -14.227 8.681 -6.147 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.113 10.555 -4.018 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.403 11.148 -4.781 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.312 10.901 -6.165 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.480 9.636 -5.717 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.005 7.923 -3.436 1.00 0.00 N ATOM 1283 CA ALA A 81 -16.715 7.208 -2.339 1.00 0.00 C ATOM 1284 C ALA A 81 -15.726 6.867 -1.224 1.00 0.00 C ATOM 1285 O ALA A 81 -16.002 7.067 -0.057 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.328 5.917 -2.886 1.00 0.00 C ATOM 0 H ALA A 81 -15.961 7.420 -4.322 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.503 7.848 -1.941 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -17.848 5.393 -2.084 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.035 6.158 -3.680 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.539 5.280 -3.284 1.00 0.00 H new ATOM 1292 N VAL A 82 -14.579 6.344 -1.569 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.574 5.980 -0.520 1.00 0.00 C ATOM 1294 C VAL A 82 -13.284 7.197 0.363 1.00 0.00 C ATOM 1295 O VAL A 82 -13.135 7.082 1.564 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.267 5.518 -1.176 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.457 4.696 -0.172 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -12.573 4.654 -2.402 1.00 0.00 C ATOM 0 H VAL A 82 -14.293 6.152 -2.529 1.00 0.00 H new ATOM 0 HA VAL A 82 -13.981 5.171 0.086 1.00 0.00 H new ATOM 0 HB VAL A 82 -11.696 6.393 -1.486 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.528 4.367 -0.637 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.229 5.309 0.700 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.036 3.826 0.137 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.639 4.330 -2.861 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.149 3.780 -2.097 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.149 5.235 -3.122 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.192 8.359 -0.225 1.00 0.00 N ATOM 1309 CA PHE A 83 -12.901 9.584 0.575 1.00 0.00 C ATOM 1310 C PHE A 83 -14.021 9.819 1.591 1.00 0.00 C ATOM 1311 O PHE A 83 -13.784 10.259 2.698 1.00 0.00 O ATOM 1312 CB PHE A 83 -12.802 10.790 -0.361 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.412 10.863 -0.946 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.308 11.028 -0.104 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -11.228 10.765 -2.330 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -9.020 11.095 -0.645 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -9.939 10.831 -2.869 1.00 0.00 C ATOM 1318 CZ PHE A 83 -8.836 10.996 -2.026 1.00 0.00 C ATOM 0 H PHE A 83 -13.306 8.513 -1.227 1.00 0.00 H new ATOM 0 HA PHE A 83 -11.958 9.452 1.105 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.540 10.705 -1.159 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.027 11.706 0.185 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.450 11.104 0.964 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.080 10.639 -2.981 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.167 11.223 0.005 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.796 10.754 -3.937 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.841 11.047 -2.443 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.242 9.536 1.220 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.380 9.752 2.162 1.00 0.00 C ATOM 1330 C ALA A 84 -16.171 8.934 3.442 1.00 0.00 C ATOM 1331 O ALA A 84 -16.138 9.472 4.531 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.686 9.317 1.492 1.00 0.00 C ATOM 0 H ALA A 84 -15.501 9.165 0.306 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.430 10.810 2.419 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.517 9.474 2.179 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -17.845 9.906 0.589 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.626 8.261 1.230 1.00 0.00 H new ATOM 1338 N TYR A 85 -16.058 7.635 3.320 1.00 0.00 N ATOM 1339 CA TYR A 85 -15.879 6.767 4.527 1.00 0.00 C ATOM 1340 C TYR A 85 -14.797 7.331 5.456 1.00 0.00 C ATOM 1341 O TYR A 85 -15.026 7.528 6.634 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.476 5.360 4.081 1.00 0.00 C ATOM 1343 CG TYR A 85 -15.935 4.354 5.109 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.298 4.065 5.247 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -14.997 3.709 5.925 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -17.723 3.132 6.201 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.422 2.776 6.878 1.00 0.00 C ATOM 1348 CZ TYR A 85 -16.784 2.488 7.017 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.202 1.568 7.957 1.00 0.00 O ATOM 0 H TYR A 85 -16.082 7.135 2.431 1.00 0.00 H new ATOM 0 HA TYR A 85 -16.822 6.736 5.073 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -15.920 5.133 3.112 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.395 5.302 3.958 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.022 4.562 4.618 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.946 3.932 5.819 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.774 2.909 6.308 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.698 2.278 7.506 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.165 1.972 8.849 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.621 7.587 4.944 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.527 8.130 5.807 1.00 0.00 C ATOM 1361 C ALA A 86 -13.017 9.375 6.553 1.00 0.00 C ATOM 1362 O ALA A 86 -12.822 9.513 7.745 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.327 8.499 4.931 1.00 0.00 C ATOM 0 H ALA A 86 -13.370 7.444 3.966 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.234 7.372 6.534 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.528 8.895 5.557 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -10.972 7.611 4.408 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.626 9.254 4.204 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.658 10.276 5.862 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.167 11.510 6.526 1.00 0.00 C ATOM 1371 C LYS A 87 -15.223 11.135 7.571 1.00 0.00 C ATOM 1372 O LYS A 87 -15.496 11.887 8.486 1.00 0.00 O ATOM 1373 CB LYS A 87 -14.799 12.425 5.474 1.00 0.00 C ATOM 1374 CG LYS A 87 -14.747 13.879 5.955 1.00 0.00 C ATOM 1375 CD LYS A 87 -16.081 14.572 5.655 1.00 0.00 C ATOM 1376 CE LYS A 87 -15.873 15.652 4.590 1.00 0.00 C ATOM 1377 NZ LYS A 87 -15.982 15.041 3.235 1.00 0.00 N ATOM 0 H LYS A 87 -13.852 10.211 4.863 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.341 12.026 7.015 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.269 12.326 4.527 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.832 12.128 5.294 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -14.543 13.911 7.025 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.933 14.407 5.459 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -16.812 13.841 5.308 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -16.483 15.017 6.565 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.617 16.440 4.706 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.895 16.116 4.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -15.841 15.774 2.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -15.256 14.304 3.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -16.925 14.618 3.120 1.00 0.00 H new ATOM 1391 N GLN A 88 -15.833 9.989 7.428 1.00 0.00 N ATOM 1392 CA GLN A 88 -16.889 9.577 8.397 1.00 0.00 C ATOM 1393 C GLN A 88 -16.273 8.846 9.596 1.00 0.00 C ATOM 1394 O GLN A 88 -16.719 9.007 10.716 1.00 0.00 O ATOM 1395 CB GLN A 88 -17.890 8.653 7.695 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.306 9.209 7.864 1.00 0.00 C ATOM 1397 CD GLN A 88 -20.137 8.877 6.623 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -21.026 8.051 6.676 1.00 0.00 O ATOM 1399 NE2 GLN A 88 -19.885 9.492 5.500 1.00 0.00 N ATOM 0 H GLN A 88 -15.645 9.320 6.681 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.397 10.471 8.760 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.644 8.571 6.636 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -17.830 7.649 8.115 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -19.772 8.782 8.752 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.269 10.288 8.012 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -19.139 10.186 5.455 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -20.434 9.279 4.667 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.273 8.029 9.383 1.00 0.00 N ATOM 1409 CA HIS A 89 -14.668 7.280 10.525 1.00 0.00 C ATOM 1410 C HIS A 89 -13.542 8.103 11.170 1.00 0.00 C ATOM 1411 O HIS A 89 -12.537 8.367 10.541 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.085 5.964 10.003 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.093 4.861 10.171 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -14.914 3.828 11.078 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.295 4.614 9.554 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -15.982 3.015 10.982 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -16.854 3.448 10.068 1.00 0.00 N ATOM 0 H HIS A 89 -14.851 7.849 8.472 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.439 7.087 11.271 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -13.815 6.066 8.952 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.171 5.720 10.544 1.00 0.00 H new ATOM 0 HD1 HIS A 89 -14.118 3.706 11.704 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.739 5.231 8.787 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.117 2.121 11.572 1.00 0.00 H new ATOM 1425 N PRO A 90 -13.736 8.469 12.420 1.00 0.00 N ATOM 1426 CA PRO A 90 -12.772 9.256 13.263 1.00 0.00 C ATOM 1427 C PRO A 90 -11.759 8.313 13.931 1.00 0.00 C ATOM 1428 O PRO A 90 -10.993 8.715 14.784 1.00 0.00 O ATOM 1429 CB PRO A 90 -13.616 9.950 14.325 1.00 0.00 C ATOM 1430 CG PRO A 90 -14.953 9.236 14.372 1.00 0.00 C ATOM 1431 CD PRO A 90 -14.950 8.188 13.261 1.00 0.00 C ATOM 0 HA PRO A 90 -12.209 9.972 12.664 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.123 9.908 15.296 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.751 11.004 14.081 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.103 8.765 15.344 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -15.771 9.943 14.231 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -14.911 7.181 13.676 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -15.860 8.251 12.664 1.00 0.00 H new ATOM 1439 N ASP A 91 -11.744 7.065 13.538 1.00 0.00 N ATOM 1440 CA ASP A 91 -10.778 6.094 14.133 1.00 0.00 C ATOM 1441 C ASP A 91 -10.240 5.175 13.028 1.00 0.00 C ATOM 1442 O ASP A 91 -9.523 4.228 13.286 1.00 0.00 O ATOM 1443 CB ASP A 91 -11.485 5.255 15.200 1.00 0.00 C ATOM 1444 CG ASP A 91 -10.583 5.123 16.429 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -10.366 6.124 17.091 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -10.125 4.022 16.687 1.00 0.00 O ATOM 0 H ASP A 91 -12.363 6.675 12.827 1.00 0.00 H new ATOM 0 HA ASP A 91 -9.951 6.636 14.592 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.430 5.723 15.478 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.723 4.268 14.803 1.00 0.00 H new ATOM 1451 N GLN A 92 -10.582 5.457 11.799 1.00 0.00 N ATOM 1452 CA GLN A 92 -10.106 4.627 10.660 1.00 0.00 C ATOM 1453 C GLN A 92 -9.875 5.557 9.473 1.00 0.00 C ATOM 1454 O GLN A 92 -10.808 5.935 8.792 1.00 0.00 O ATOM 1455 CB GLN A 92 -11.184 3.598 10.301 1.00 0.00 C ATOM 1456 CG GLN A 92 -10.528 2.294 9.847 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.495 1.130 10.066 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -12.505 0.976 9.255 1.00 0.00 O flip ATOM 1459 NE2 GLN A 92 -11.331 0.353 10.986 1.00 0.00 N flip ATOM 0 H GLN A 92 -11.180 6.240 11.535 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.186 4.103 10.920 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.824 3.412 11.164 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -11.823 3.989 9.509 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.255 2.360 8.794 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.607 2.125 10.405 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -10.541 0.473 11.620 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -11.983 -0.419 11.124 1.00 0.00 H new ATOM 1468 N GLU A 93 -8.654 5.945 9.212 1.00 0.00 N ATOM 1469 CA GLU A 93 -8.401 6.865 8.071 1.00 0.00 C ATOM 1470 C GLU A 93 -8.357 6.072 6.765 1.00 0.00 C ATOM 1471 O GLU A 93 -8.796 4.942 6.698 1.00 0.00 O ATOM 1472 CB GLU A 93 -7.064 7.579 8.292 1.00 0.00 C ATOM 1473 CG GLU A 93 -7.247 8.694 9.324 1.00 0.00 C ATOM 1474 CD GLU A 93 -7.487 10.023 8.604 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -8.333 10.053 7.726 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -6.821 10.987 8.943 1.00 0.00 O ATOM 0 H GLU A 93 -7.827 5.665 9.738 1.00 0.00 H new ATOM 0 HA GLU A 93 -9.203 7.601 8.009 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.313 6.869 8.637 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.701 7.995 7.352 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.089 8.465 9.977 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.363 8.766 9.958 1.00 0.00 H new ATOM 1483 N LEU A 94 -7.821 6.659 5.731 1.00 0.00 N ATOM 1484 CA LEU A 94 -7.733 5.951 4.426 1.00 0.00 C ATOM 1485 C LEU A 94 -6.294 5.477 4.202 1.00 0.00 C ATOM 1486 O LEU A 94 -5.382 6.272 4.084 1.00 0.00 O ATOM 1487 CB LEU A 94 -8.146 6.909 3.307 1.00 0.00 C ATOM 1488 CG LEU A 94 -8.978 6.163 2.264 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -10.382 5.898 2.819 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -9.077 7.018 0.995 1.00 0.00 C ATOM 0 H LEU A 94 -7.438 7.604 5.735 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.398 5.087 4.426 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.722 7.737 3.720 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.260 7.339 2.839 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.502 5.211 2.028 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.973 5.366 2.074 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.308 5.293 3.723 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.865 6.846 3.056 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.669 6.491 0.247 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.555 7.968 1.233 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.077 7.203 0.602 1.00 0.00 H new ATOM 1502 N VAL A 95 -6.083 4.190 4.138 1.00 0.00 N ATOM 1503 CA VAL A 95 -4.702 3.671 3.909 1.00 0.00 C ATOM 1504 C VAL A 95 -4.666 2.965 2.555 1.00 0.00 C ATOM 1505 O VAL A 95 -5.434 2.060 2.298 1.00 0.00 O ATOM 1506 CB VAL A 95 -4.315 2.683 5.014 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -2.859 2.255 4.828 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -4.472 3.356 6.379 1.00 0.00 C ATOM 0 H VAL A 95 -6.805 3.476 4.234 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.994 4.500 3.922 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.964 1.809 4.961 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.583 1.552 5.614 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.742 1.776 3.856 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.213 3.131 4.882 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.197 2.653 7.165 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.823 4.230 6.430 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.508 3.665 6.515 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.798 3.388 1.679 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.728 2.754 0.333 1.00 0.00 C ATOM 1520 C ILE A 96 -2.861 1.498 0.396 1.00 0.00 C ATOM 1521 O ILE A 96 -1.895 1.429 1.135 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.125 3.741 -0.668 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -3.906 5.060 -0.628 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.198 3.146 -2.075 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.370 4.806 -0.993 1.00 0.00 C ATOM 0 H ILE A 96 -3.134 4.146 1.837 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.734 2.481 0.014 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.084 3.931 -0.406 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.841 5.502 0.366 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.467 5.775 -1.324 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.769 3.848 -2.790 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.639 2.211 -2.104 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.239 2.954 -2.335 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.921 5.746 -0.963 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.427 4.384 -1.996 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.807 4.107 -0.280 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.185 0.517 -0.402 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.384 -0.737 -0.429 1.00 0.00 C ATOM 1539 C ALA A 97 -2.027 -1.078 -1.883 1.00 0.00 C ATOM 1540 O ALA A 97 -1.282 -2.001 -2.147 1.00 0.00 O ATOM 1541 CB ALA A 97 -3.199 -1.876 0.180 1.00 0.00 C ATOM 0 H ALA A 97 -3.979 0.533 -1.042 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.470 -0.601 0.148 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.612 -2.794 0.160 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.454 -1.630 1.211 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.114 -2.017 -0.396 1.00 0.00 H new ATOM 1547 N GLY A 98 -2.527 -0.316 -2.827 1.00 0.00 N ATOM 1548 CA GLY A 98 -2.188 -0.569 -4.260 1.00 0.00 C ATOM 1549 C GLY A 98 -3.264 -1.426 -4.945 1.00 0.00 C ATOM 1550 O GLY A 98 -4.402 -1.469 -4.518 1.00 0.00 O ATOM 0 H GLY A 98 -3.156 0.471 -2.665 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -2.087 0.381 -4.785 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.223 -1.073 -4.324 1.00 0.00 H new ATOM 1554 N GLY A 99 -2.924 -2.096 -6.028 1.00 0.00 N ATOM 1555 CA GLY A 99 -1.526 -2.054 -6.565 1.00 0.00 C ATOM 1556 C GLY A 99 -1.182 -0.685 -7.174 1.00 0.00 C ATOM 1557 O GLY A 99 -1.540 0.356 -6.661 1.00 0.00 O ATOM 0 H GLY A 99 -3.567 -2.676 -6.566 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.823 -2.281 -5.763 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.406 -2.828 -7.323 1.00 0.00 H new ATOM 1561 N ALA A 100 -0.464 -0.692 -8.267 1.00 0.00 N ATOM 1562 CA ALA A 100 -0.047 0.589 -8.915 1.00 0.00 C ATOM 1563 C ALA A 100 -1.264 1.396 -9.368 1.00 0.00 C ATOM 1564 O ALA A 100 -1.299 2.603 -9.222 1.00 0.00 O ATOM 1565 CB ALA A 100 0.828 0.277 -10.130 1.00 0.00 C ATOM 0 H ALA A 100 -0.146 -1.536 -8.743 1.00 0.00 H new ATOM 0 HA ALA A 100 0.510 1.179 -8.187 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.135 1.208 -10.606 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.712 -0.275 -9.810 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.262 -0.325 -10.841 1.00 0.00 H new ATOM 1571 N GLN A 101 -2.249 0.759 -9.937 1.00 0.00 N ATOM 1572 CA GLN A 101 -3.438 1.518 -10.416 1.00 0.00 C ATOM 1573 C GLN A 101 -4.038 2.322 -9.260 1.00 0.00 C ATOM 1574 O GLN A 101 -4.532 3.418 -9.452 1.00 0.00 O ATOM 1575 CB GLN A 101 -4.485 0.540 -10.960 1.00 0.00 C ATOM 1576 CG GLN A 101 -4.578 0.685 -12.481 1.00 0.00 C ATOM 1577 CD GLN A 101 -5.926 0.149 -12.965 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -6.963 0.682 -12.624 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -5.956 -0.891 -13.753 1.00 0.00 N ATOM 0 H GLN A 101 -2.283 -0.249 -10.091 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.134 2.201 -11.209 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -4.214 -0.483 -10.697 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.455 0.739 -10.505 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -4.468 1.732 -12.764 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.765 0.139 -12.959 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -5.086 -1.339 -14.040 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -6.850 -1.256 -14.082 1.00 0.00 H new ATOM 1588 N ILE A 102 -4.027 1.789 -8.066 1.00 0.00 N ATOM 1589 CA ILE A 102 -4.628 2.526 -6.921 1.00 0.00 C ATOM 1590 C ILE A 102 -3.685 3.629 -6.426 1.00 0.00 C ATOM 1591 O ILE A 102 -4.128 4.619 -5.881 1.00 0.00 O ATOM 1592 CB ILE A 102 -4.907 1.532 -5.788 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -5.727 0.354 -6.330 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -5.693 2.220 -4.673 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -7.014 0.872 -6.980 1.00 0.00 C ATOM 0 H ILE A 102 -3.629 0.878 -7.837 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.556 2.997 -7.246 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.959 1.170 -5.391 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.140 -0.204 -7.059 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.969 -0.335 -5.521 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.887 1.507 -3.872 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.114 3.056 -4.282 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.640 2.588 -5.069 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.592 0.031 -7.363 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.605 1.411 -6.239 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.762 1.543 -7.801 1.00 0.00 H new ATOM 1607 N PHE A 103 -2.395 3.487 -6.599 1.00 0.00 N ATOM 1608 CA PHE A 103 -1.469 4.557 -6.120 1.00 0.00 C ATOM 1609 C PHE A 103 -1.553 5.769 -7.053 1.00 0.00 C ATOM 1610 O PHE A 103 -1.252 6.881 -6.665 1.00 0.00 O ATOM 1611 CB PHE A 103 -0.026 4.035 -6.123 1.00 0.00 C ATOM 1612 CG PHE A 103 0.163 2.981 -5.054 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.412 3.143 -3.786 1.00 0.00 C ATOM 1614 CD2 PHE A 103 0.927 1.840 -5.333 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.225 2.164 -2.802 1.00 0.00 C ATOM 1616 CE2 PHE A 103 1.114 0.862 -4.349 1.00 0.00 C ATOM 1617 CZ PHE A 103 0.538 1.024 -3.083 1.00 0.00 C ATOM 0 H PHE A 103 -1.947 2.687 -7.046 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.757 4.845 -5.109 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.212 3.616 -7.100 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.665 4.861 -5.953 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.999 4.023 -3.568 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.372 1.715 -6.309 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.670 2.288 -1.826 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.702 -0.017 -4.566 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.682 0.270 -2.323 1.00 0.00 H new ATOM 1627 N THR A 104 -1.941 5.560 -8.282 1.00 0.00 N ATOM 1628 CA THR A 104 -2.023 6.696 -9.246 1.00 0.00 C ATOM 1629 C THR A 104 -3.295 7.513 -9.001 1.00 0.00 C ATOM 1630 O THR A 104 -3.251 8.723 -8.892 1.00 0.00 O ATOM 1631 CB THR A 104 -2.044 6.150 -10.676 1.00 0.00 C ATOM 1632 OG1 THR A 104 -1.174 5.026 -10.766 1.00 0.00 O ATOM 1633 CG2 THR A 104 -1.591 7.244 -11.650 1.00 0.00 C ATOM 0 H THR A 104 -2.205 4.651 -8.661 1.00 0.00 H new ATOM 0 HA THR A 104 -1.154 7.339 -9.105 1.00 0.00 H new ATOM 0 HB THR A 104 -3.057 5.841 -10.935 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.188 4.674 -11.681 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.606 6.854 -12.668 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.265 8.097 -11.578 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.579 7.559 -11.398 1.00 0.00 H new ATOM 1641 N ALA A 105 -4.427 6.868 -8.927 1.00 0.00 N ATOM 1642 CA ALA A 105 -5.700 7.617 -8.706 1.00 0.00 C ATOM 1643 C ALA A 105 -5.663 8.349 -7.361 1.00 0.00 C ATOM 1644 O ALA A 105 -6.310 9.362 -7.182 1.00 0.00 O ATOM 1645 CB ALA A 105 -6.875 6.637 -8.716 1.00 0.00 C ATOM 0 H ALA A 105 -4.527 5.856 -9.010 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.820 8.350 -9.504 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.805 7.182 -8.555 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.915 6.127 -9.679 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.743 5.902 -7.922 1.00 0.00 H new ATOM 1651 N PHE A 106 -4.933 7.837 -6.407 1.00 0.00 N ATOM 1652 CA PHE A 106 -4.882 8.501 -5.069 1.00 0.00 C ATOM 1653 C PHE A 106 -3.610 9.348 -4.933 1.00 0.00 C ATOM 1654 O PHE A 106 -3.403 10.007 -3.932 1.00 0.00 O ATOM 1655 CB PHE A 106 -4.887 7.429 -3.979 1.00 0.00 C ATOM 1656 CG PHE A 106 -6.282 6.875 -3.820 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -7.176 7.479 -2.933 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -6.679 5.755 -4.557 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -8.466 6.965 -2.782 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -7.969 5.241 -4.407 1.00 0.00 C ATOM 1661 CZ PHE A 106 -8.863 5.845 -3.520 1.00 0.00 C ATOM 0 H PHE A 106 -4.371 6.990 -6.494 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.750 9.152 -4.966 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.194 6.628 -4.239 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.544 7.854 -3.036 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.870 8.344 -2.364 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.988 5.287 -5.242 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -9.157 7.432 -2.096 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -8.275 4.376 -4.977 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.860 5.447 -3.404 1.00 0.00 H new ATOM 1671 N LYS A 107 -2.742 9.320 -5.910 1.00 0.00 N ATOM 1672 CA LYS A 107 -1.480 10.110 -5.803 1.00 0.00 C ATOM 1673 C LYS A 107 -1.787 11.605 -5.617 1.00 0.00 C ATOM 1674 O LYS A 107 -1.098 12.294 -4.894 1.00 0.00 O ATOM 1675 CB LYS A 107 -0.616 9.888 -7.057 1.00 0.00 C ATOM 1676 CG LYS A 107 -1.033 10.832 -8.193 1.00 0.00 C ATOM 1677 CD LYS A 107 -0.001 10.752 -9.322 1.00 0.00 C ATOM 1678 CE LYS A 107 1.363 11.217 -8.804 1.00 0.00 C ATOM 1679 NZ LYS A 107 2.170 11.767 -9.931 1.00 0.00 N ATOM 0 H LYS A 107 -2.851 8.787 -6.773 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.927 9.768 -4.928 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.434 10.051 -6.812 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.709 8.854 -7.388 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.019 10.557 -8.566 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.106 11.855 -7.823 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.069 9.729 -9.693 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.315 11.374 -10.160 1.00 0.00 H new ATOM 0 HE2 LYS A 107 1.230 11.978 -8.035 1.00 0.00 H new ATOM 0 HE3 LYS A 107 1.890 10.383 -8.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 3.179 11.580 -9.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 1.880 11.312 -10.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 2.015 12.793 -10.001 1.00 0.00 H new ATOM 1693 N ASP A 108 -2.801 12.121 -6.263 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.119 13.575 -6.119 1.00 0.00 C ATOM 1695 C ASP A 108 -3.585 13.891 -4.692 1.00 0.00 C ATOM 1696 O ASP A 108 -3.292 14.943 -4.156 1.00 0.00 O ATOM 1697 CB ASP A 108 -4.234 13.940 -7.102 1.00 0.00 C ATOM 1698 CG ASP A 108 -4.089 15.403 -7.523 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -3.127 15.710 -8.207 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -4.945 16.191 -7.157 1.00 0.00 O ATOM 0 H ASP A 108 -3.422 11.600 -6.883 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.220 14.154 -6.329 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.187 13.293 -7.978 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.208 13.779 -6.639 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.324 13.005 -4.083 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.828 13.267 -2.701 1.00 0.00 C ATOM 1707 C ASP A 109 -4.123 12.345 -1.702 1.00 0.00 C ATOM 1708 O ASP A 109 -4.621 11.286 -1.372 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.334 13.007 -2.658 1.00 0.00 C ATOM 1710 CG ASP A 109 -7.083 14.245 -3.154 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -6.909 14.595 -4.310 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.819 14.822 -2.370 1.00 0.00 O ATOM 0 H ASP A 109 -4.602 12.108 -4.482 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.623 14.304 -2.434 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.582 12.146 -3.279 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.643 12.766 -1.641 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.971 12.735 -1.215 1.00 0.00 N ATOM 1718 CA VAL A 110 -2.244 11.873 -0.234 1.00 0.00 C ATOM 1719 C VAL A 110 -2.081 12.629 1.091 1.00 0.00 C ATOM 1720 O VAL A 110 -2.062 13.844 1.125 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.856 11.528 -0.783 1.00 0.00 C ATOM 1722 CG1 VAL A 110 -0.265 10.358 0.007 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -0.964 11.140 -2.258 1.00 0.00 C ATOM 0 H VAL A 110 -2.504 13.610 -1.454 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.814 10.958 -0.070 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.208 12.399 -0.684 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.722 10.115 -0.386 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.179 10.635 1.058 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.917 9.489 -0.087 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.026 10.896 -2.643 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.617 10.273 -2.359 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.378 11.974 -2.824 1.00 0.00 H new ATOM 1733 N ASP A 111 -1.958 11.915 2.179 1.00 0.00 N ATOM 1734 CA ASP A 111 -1.786 12.583 3.503 1.00 0.00 C ATOM 1735 C ASP A 111 -0.577 11.979 4.231 1.00 0.00 C ATOM 1736 O ASP A 111 0.126 12.661 4.953 1.00 0.00 O ATOM 1737 CB ASP A 111 -3.045 12.377 4.350 1.00 0.00 C ATOM 1738 CG ASP A 111 -4.103 13.409 3.954 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -3.875 14.583 4.192 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -5.124 13.007 3.421 1.00 0.00 O ATOM 0 H ASP A 111 -1.969 10.895 2.208 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.622 13.650 3.349 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.433 11.369 4.204 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.804 12.476 5.408 1.00 0.00 H new ATOM 1745 N THR A 112 -0.333 10.706 4.048 1.00 0.00 N ATOM 1746 CA THR A 112 0.826 10.056 4.729 1.00 0.00 C ATOM 1747 C THR A 112 1.424 8.981 3.814 1.00 0.00 C ATOM 1748 O THR A 112 0.721 8.143 3.285 1.00 0.00 O ATOM 1749 CB THR A 112 0.351 9.409 6.034 1.00 0.00 C ATOM 1750 OG1 THR A 112 -0.521 10.302 6.712 1.00 0.00 O ATOM 1751 CG2 THR A 112 1.556 9.096 6.924 1.00 0.00 C ATOM 0 H THR A 112 -0.888 10.088 3.455 1.00 0.00 H new ATOM 0 HA THR A 112 1.585 10.807 4.948 1.00 0.00 H new ATOM 0 HB THR A 112 -0.178 8.483 5.807 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.827 9.890 7.547 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.214 8.636 7.851 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.224 8.410 6.404 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.089 10.019 7.152 1.00 0.00 H new ATOM 1759 N LEU A 113 2.716 9.004 3.617 1.00 0.00 N ATOM 1760 CA LEU A 113 3.354 7.987 2.728 1.00 0.00 C ATOM 1761 C LEU A 113 4.175 7.002 3.566 1.00 0.00 C ATOM 1762 O LEU A 113 4.971 7.394 4.394 1.00 0.00 O ATOM 1763 CB LEU A 113 4.271 8.693 1.728 1.00 0.00 C ATOM 1764 CG LEU A 113 3.455 9.700 0.917 1.00 0.00 C ATOM 1765 CD1 LEU A 113 4.387 10.755 0.317 1.00 0.00 C ATOM 1766 CD2 LEU A 113 2.724 8.965 -0.208 1.00 0.00 C ATOM 0 H LEU A 113 3.356 9.681 4.032 1.00 0.00 H new ATOM 0 HA LEU A 113 2.578 7.440 2.193 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.079 9.202 2.254 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.734 7.963 1.063 1.00 0.00 H new ATOM 0 HG LEU A 113 2.731 10.190 1.568 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.802 11.471 -0.260 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.910 11.276 1.119 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.113 10.270 -0.335 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.140 9.679 -0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.451 8.477 -0.857 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.059 8.215 0.220 1.00 0.00 H new ATOM 1778 N LEU A 114 3.990 5.724 3.348 1.00 0.00 N ATOM 1779 CA LEU A 114 4.760 4.704 4.122 1.00 0.00 C ATOM 1780 C LEU A 114 5.431 3.736 3.140 1.00 0.00 C ATOM 1781 O LEU A 114 4.829 2.782 2.687 1.00 0.00 O ATOM 1782 CB LEU A 114 3.808 3.925 5.035 1.00 0.00 C ATOM 1783 CG LEU A 114 2.951 4.901 5.846 1.00 0.00 C ATOM 1784 CD1 LEU A 114 1.591 4.265 6.139 1.00 0.00 C ATOM 1785 CD2 LEU A 114 3.657 5.221 7.165 1.00 0.00 C ATOM 0 H LEU A 114 3.336 5.342 2.664 1.00 0.00 H new ATOM 0 HA LEU A 114 5.517 5.199 4.731 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.168 3.275 4.438 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.378 3.283 5.706 1.00 0.00 H new ATOM 0 HG LEU A 114 2.807 5.819 5.276 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.981 4.960 6.716 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.088 4.034 5.200 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.734 3.347 6.710 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.049 5.916 7.744 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.799 4.302 7.734 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.627 5.673 6.958 1.00 0.00 H new ATOM 1797 N VAL A 115 6.662 3.994 2.788 1.00 0.00 N ATOM 1798 CA VAL A 115 7.360 3.106 1.809 1.00 0.00 C ATOM 1799 C VAL A 115 8.520 2.352 2.472 1.00 0.00 C ATOM 1800 O VAL A 115 9.210 2.870 3.327 1.00 0.00 O ATOM 1801 CB VAL A 115 7.899 3.961 0.658 1.00 0.00 C ATOM 1802 CG1 VAL A 115 8.938 4.951 1.191 1.00 0.00 C ATOM 1803 CG2 VAL A 115 8.547 3.056 -0.392 1.00 0.00 C ATOM 0 H VAL A 115 7.215 4.779 3.134 1.00 0.00 H new ATOM 0 HA VAL A 115 6.647 2.371 1.436 1.00 0.00 H new ATOM 0 HB VAL A 115 7.076 4.513 0.204 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.319 5.557 0.369 1.00 0.00 H new ATOM 0 HG12 VAL A 115 8.475 5.599 1.935 1.00 0.00 H new ATOM 0 HG13 VAL A 115 9.761 4.403 1.649 1.00 0.00 H new ATOM 0 HG21 VAL A 115 8.930 3.665 -1.211 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.368 2.501 0.063 1.00 0.00 H new ATOM 0 HG23 VAL A 115 7.805 2.356 -0.777 1.00 0.00 H new ATOM 1813 N THR A 116 8.743 1.129 2.055 1.00 0.00 N ATOM 1814 CA THR A 116 9.865 0.325 2.623 1.00 0.00 C ATOM 1815 C THR A 116 10.997 0.271 1.592 1.00 0.00 C ATOM 1816 O THR A 116 10.818 -0.210 0.491 1.00 0.00 O ATOM 1817 CB THR A 116 9.388 -1.103 2.922 1.00 0.00 C ATOM 1818 OG1 THR A 116 8.010 -1.091 3.270 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.201 -1.680 4.080 1.00 0.00 C ATOM 0 H THR A 116 8.191 0.653 1.341 1.00 0.00 H new ATOM 0 HA THR A 116 10.214 0.785 3.548 1.00 0.00 H new ATOM 0 HB THR A 116 9.527 -1.720 2.034 1.00 0.00 H new ATOM 0 HG1 THR A 116 7.712 -2.006 3.458 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.862 -2.694 4.293 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.257 -1.699 3.809 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.065 -1.059 4.965 1.00 0.00 H new ATOM 1827 N ARG A 117 12.156 0.772 1.932 1.00 0.00 N ATOM 1828 CA ARG A 117 13.289 0.759 0.959 1.00 0.00 C ATOM 1829 C ARG A 117 14.182 -0.461 1.202 1.00 0.00 C ATOM 1830 O ARG A 117 14.879 -0.541 2.194 1.00 0.00 O ATOM 1831 CB ARG A 117 14.118 2.034 1.130 1.00 0.00 C ATOM 1832 CG ARG A 117 13.276 3.253 0.741 1.00 0.00 C ATOM 1833 CD ARG A 117 13.609 3.677 -0.692 1.00 0.00 C ATOM 1834 NE ARG A 117 14.034 5.108 -0.702 1.00 0.00 N ATOM 1835 CZ ARG A 117 14.344 5.705 -1.827 1.00 0.00 C ATOM 1836 NH1 ARG A 117 14.289 5.059 -2.964 1.00 0.00 N ATOM 1837 NH2 ARG A 117 14.712 6.957 -1.813 1.00 0.00 N ATOM 0 H ARG A 117 12.367 1.189 2.839 1.00 0.00 H new ATOM 0 HA ARG A 117 12.887 0.709 -0.053 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.453 2.126 2.163 1.00 0.00 H new ATOM 0 HB3 ARG A 117 15.012 1.984 0.509 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.215 3.015 0.822 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.472 4.076 1.428 1.00 0.00 H new ATOM 0 HD2 ARG A 117 14.403 3.048 -1.093 1.00 0.00 H new ATOM 0 HD3 ARG A 117 12.739 3.540 -1.334 1.00 0.00 H new ATOM 0 HE ARG A 117 14.084 5.626 0.175 1.00 0.00 H new ATOM 0 HH11 ARG A 117 14.002 4.080 -2.981 1.00 0.00 H new ATOM 0 HH12 ARG A 117 14.533 5.534 -3.833 1.00 0.00 H new ATOM 0 HH21 ARG A 117 14.757 7.465 -0.930 1.00 0.00 H new ATOM 0 HH22 ARG A 117 14.954 7.427 -2.685 1.00 0.00 H new ATOM 1851 N LEU A 118 14.179 -1.403 0.293 1.00 0.00 N ATOM 1852 CA LEU A 118 15.040 -2.610 0.461 1.00 0.00 C ATOM 1853 C LEU A 118 16.441 -2.301 -0.074 1.00 0.00 C ATOM 1854 O LEU A 118 16.615 -1.441 -0.915 1.00 0.00 O ATOM 1855 CB LEU A 118 14.448 -3.787 -0.321 1.00 0.00 C ATOM 1856 CG LEU A 118 13.225 -4.337 0.413 1.00 0.00 C ATOM 1857 CD1 LEU A 118 11.985 -3.530 0.023 1.00 0.00 C ATOM 1858 CD2 LEU A 118 13.020 -5.804 0.025 1.00 0.00 C ATOM 0 H LEU A 118 13.617 -1.387 -0.558 1.00 0.00 H new ATOM 0 HA LEU A 118 15.093 -2.873 1.517 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.167 -3.464 -1.323 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.196 -4.571 -0.437 1.00 0.00 H new ATOM 0 HG LEU A 118 13.382 -4.260 1.489 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.115 -3.924 0.548 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.131 -2.485 0.296 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.825 -3.605 -1.053 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.149 -6.200 0.547 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.863 -5.877 -1.051 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.902 -6.381 0.303 1.00 0.00 H new ATOM 1870 N ALA A 119 17.441 -2.986 0.411 1.00 0.00 N ATOM 1871 CA ALA A 119 18.829 -2.719 -0.065 1.00 0.00 C ATOM 1872 C ALA A 119 19.120 -3.531 -1.331 1.00 0.00 C ATOM 1873 O ALA A 119 19.962 -3.163 -2.128 1.00 0.00 O ATOM 1874 CB ALA A 119 19.825 -3.110 1.029 1.00 0.00 C ATOM 0 H ALA A 119 17.357 -3.719 1.116 1.00 0.00 H new ATOM 0 HA ALA A 119 18.928 -1.658 -0.293 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.840 -2.916 0.683 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.629 -2.523 1.926 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.716 -4.170 1.258 1.00 0.00 H new ATOM 1880 N GLY A 120 18.444 -4.633 -1.524 1.00 0.00 N ATOM 1881 CA GLY A 120 18.699 -5.462 -2.740 1.00 0.00 C ATOM 1882 C GLY A 120 18.034 -4.819 -3.959 1.00 0.00 C ATOM 1883 O GLY A 120 17.266 -3.884 -3.838 1.00 0.00 O ATOM 0 H GLY A 120 17.728 -4.995 -0.894 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.772 -5.556 -2.908 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.310 -6.469 -2.592 1.00 0.00 H new ATOM 1887 N SER A 121 18.327 -5.313 -5.135 1.00 0.00 N ATOM 1888 CA SER A 121 17.717 -4.734 -6.367 1.00 0.00 C ATOM 1889 C SER A 121 17.034 -5.843 -7.172 1.00 0.00 C ATOM 1890 O SER A 121 17.674 -6.761 -7.649 1.00 0.00 O ATOM 1891 CB SER A 121 18.809 -4.089 -7.218 1.00 0.00 C ATOM 1892 OG SER A 121 18.228 -3.102 -8.060 1.00 0.00 O ATOM 0 H SER A 121 18.964 -6.094 -5.294 1.00 0.00 H new ATOM 0 HA SER A 121 16.979 -3.982 -6.087 1.00 0.00 H new ATOM 0 HB2 SER A 121 19.566 -3.637 -6.577 1.00 0.00 H new ATOM 0 HB3 SER A 121 19.312 -4.846 -7.820 1.00 0.00 H new ATOM 0 HG SER A 121 18.784 -2.985 -8.859 1.00 0.00 H new ATOM 1898 N PHE A 122 15.738 -5.770 -7.318 1.00 0.00 N ATOM 1899 CA PHE A 122 15.007 -6.823 -8.081 1.00 0.00 C ATOM 1900 C PHE A 122 14.515 -6.254 -9.415 1.00 0.00 C ATOM 1901 O PHE A 122 14.419 -5.056 -9.594 1.00 0.00 O ATOM 1902 CB PHE A 122 13.813 -7.309 -7.257 1.00 0.00 C ATOM 1903 CG PHE A 122 14.288 -7.715 -5.883 1.00 0.00 C ATOM 1904 CD1 PHE A 122 14.559 -6.734 -4.921 1.00 0.00 C ATOM 1905 CD2 PHE A 122 14.465 -9.068 -5.572 1.00 0.00 C ATOM 1906 CE1 PHE A 122 15.004 -7.107 -3.647 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.911 -9.441 -4.297 1.00 0.00 C ATOM 1908 CZ PHE A 122 15.181 -8.460 -3.335 1.00 0.00 C ATOM 0 H PHE A 122 15.153 -5.025 -6.941 1.00 0.00 H new ATOM 0 HA PHE A 122 15.679 -7.658 -8.278 1.00 0.00 H new ATOM 0 HB2 PHE A 122 13.066 -6.519 -7.178 1.00 0.00 H new ATOM 0 HB3 PHE A 122 13.334 -8.153 -7.753 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.425 -5.690 -5.162 1.00 0.00 H new ATOM 0 HD2 PHE A 122 14.258 -9.824 -6.314 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.211 -6.350 -2.905 1.00 0.00 H new ATOM 0 HE2 PHE A 122 15.046 -10.485 -4.056 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.526 -8.747 -2.353 1.00 0.00 H new ATOM 1918 N GLU A 123 14.199 -7.112 -10.351 1.00 0.00 N ATOM 1919 CA GLU A 123 13.707 -6.633 -11.677 1.00 0.00 C ATOM 1920 C GLU A 123 12.211 -6.937 -11.809 1.00 0.00 C ATOM 1921 O GLU A 123 11.696 -7.846 -11.188 1.00 0.00 O ATOM 1922 CB GLU A 123 14.474 -7.345 -12.794 1.00 0.00 C ATOM 1923 CG GLU A 123 14.471 -6.474 -14.054 1.00 0.00 C ATOM 1924 CD GLU A 123 14.290 -7.360 -15.288 1.00 0.00 C ATOM 1925 OE1 GLU A 123 13.213 -7.911 -15.444 1.00 0.00 O ATOM 1926 OE2 GLU A 123 15.231 -7.471 -16.056 1.00 0.00 O ATOM 0 H GLU A 123 14.261 -8.125 -10.254 1.00 0.00 H new ATOM 0 HA GLU A 123 13.866 -5.558 -11.756 1.00 0.00 H new ATOM 0 HB2 GLU A 123 15.498 -7.541 -12.478 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.015 -8.311 -13.006 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.667 -5.740 -13.999 1.00 0.00 H new ATOM 0 HG3 GLU A 123 15.406 -5.918 -14.127 1.00 0.00 H new ATOM 1933 N GLY A 124 11.513 -6.183 -12.619 1.00 0.00 N ATOM 1934 CA GLY A 124 10.050 -6.422 -12.802 1.00 0.00 C ATOM 1935 C GLY A 124 9.530 -5.507 -13.912 1.00 0.00 C ATOM 1936 O GLY A 124 10.290 -5.018 -14.725 1.00 0.00 O ATOM 0 H GLY A 124 11.895 -5.409 -13.163 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.868 -7.466 -13.059 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.517 -6.225 -11.872 1.00 0.00 H new ATOM 1940 N ASP A 125 8.246 -5.261 -13.955 1.00 0.00 N ATOM 1941 CA ASP A 125 7.686 -4.364 -15.009 1.00 0.00 C ATOM 1942 C ASP A 125 6.692 -3.385 -14.364 1.00 0.00 C ATOM 1943 O ASP A 125 6.269 -2.422 -14.973 1.00 0.00 O ATOM 1944 CB ASP A 125 6.962 -5.203 -16.064 1.00 0.00 C ATOM 1945 CG ASP A 125 7.989 -5.958 -16.909 1.00 0.00 C ATOM 1946 OD1 ASP A 125 8.597 -6.876 -16.385 1.00 0.00 O ATOM 1947 OD2 ASP A 125 8.150 -5.604 -18.066 1.00 0.00 O ATOM 0 H ASP A 125 7.560 -5.644 -13.304 1.00 0.00 H new ATOM 0 HA ASP A 125 8.495 -3.808 -15.483 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.284 -5.907 -15.581 1.00 0.00 H new ATOM 0 HB3 ASP A 125 6.354 -4.560 -16.700 1.00 0.00 H new ATOM 1952 N THR A 126 6.321 -3.628 -13.132 1.00 0.00 N ATOM 1953 CA THR A 126 5.365 -2.724 -12.433 1.00 0.00 C ATOM 1954 C THR A 126 6.138 -1.909 -11.399 1.00 0.00 C ATOM 1955 O THR A 126 6.704 -2.453 -10.472 1.00 0.00 O ATOM 1956 CB THR A 126 4.292 -3.560 -11.728 1.00 0.00 C ATOM 1957 OG1 THR A 126 3.826 -4.572 -12.610 1.00 0.00 O ATOM 1958 CG2 THR A 126 3.123 -2.663 -11.313 1.00 0.00 C ATOM 0 H THR A 126 6.644 -4.421 -12.578 1.00 0.00 H new ATOM 0 HA THR A 126 4.884 -2.059 -13.151 1.00 0.00 H new ATOM 0 HB THR A 126 4.722 -4.021 -10.839 1.00 0.00 H new ATOM 0 HG1 THR A 126 3.141 -5.109 -12.159 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.364 -3.263 -10.812 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.481 -1.890 -10.633 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.691 -2.196 -12.198 1.00 0.00 H new ATOM 1966 N LYS A 127 6.190 -0.615 -11.557 1.00 0.00 N ATOM 1967 CA LYS A 127 6.951 0.217 -10.585 1.00 0.00 C ATOM 1968 C LYS A 127 6.018 1.222 -9.913 1.00 0.00 C ATOM 1969 O LYS A 127 4.982 1.579 -10.441 1.00 0.00 O ATOM 1970 CB LYS A 127 8.064 0.965 -11.320 1.00 0.00 C ATOM 1971 CG LYS A 127 9.202 -0.007 -11.636 1.00 0.00 C ATOM 1972 CD LYS A 127 10.474 0.779 -11.964 1.00 0.00 C ATOM 1973 CE LYS A 127 11.641 0.235 -11.136 1.00 0.00 C ATOM 1974 NZ LYS A 127 12.930 0.754 -11.681 1.00 0.00 N ATOM 0 H LYS A 127 5.740 -0.100 -12.314 1.00 0.00 H new ATOM 0 HA LYS A 127 7.385 -0.430 -9.822 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.678 1.402 -12.241 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.432 1.787 -10.706 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.378 -0.665 -10.785 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.928 -0.642 -12.478 1.00 0.00 H new ATOM 0 HD2 LYS A 127 10.700 0.698 -13.027 1.00 0.00 H new ATOM 0 HD3 LYS A 127 10.325 1.837 -11.750 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.530 0.533 -10.093 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.638 -0.855 -11.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 13.630 -0.015 -11.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 12.778 1.119 -12.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 13.281 1.520 -11.072 1.00 0.00 H new ATOM 1988 N MET A 128 6.383 1.678 -8.747 1.00 0.00 N ATOM 1989 CA MET A 128 5.530 2.657 -8.020 1.00 0.00 C ATOM 1990 C MET A 128 5.399 3.940 -8.844 1.00 0.00 C ATOM 1991 O MET A 128 6.263 4.273 -9.632 1.00 0.00 O ATOM 1992 CB MET A 128 6.178 2.978 -6.674 1.00 0.00 C ATOM 1993 CG MET A 128 5.089 3.180 -5.622 1.00 0.00 C ATOM 1994 SD MET A 128 4.798 4.949 -5.388 1.00 0.00 S ATOM 1995 CE MET A 128 3.412 4.783 -4.242 1.00 0.00 C ATOM 0 H MET A 128 7.241 1.412 -8.264 1.00 0.00 H new ATOM 0 HA MET A 128 4.539 2.232 -7.861 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.842 2.167 -6.375 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.790 3.876 -6.757 1.00 0.00 H new ATOM 0 HG2 MET A 128 4.169 2.688 -5.937 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.389 2.722 -4.680 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.487 5.063 -4.747 1.00 0.00 H new ATOM 0 HE2 MET A 128 3.342 3.749 -3.903 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.569 5.436 -3.384 1.00 0.00 H new ATOM 2005 N ILE A 129 4.321 4.657 -8.672 1.00 0.00 N ATOM 2006 CA ILE A 129 4.123 5.915 -9.447 1.00 0.00 C ATOM 2007 C ILE A 129 5.022 7.021 -8.882 1.00 0.00 C ATOM 2008 O ILE A 129 5.381 6.994 -7.722 1.00 0.00 O ATOM 2009 CB ILE A 129 2.659 6.349 -9.340 1.00 0.00 C ATOM 2010 CG1 ILE A 129 2.258 6.444 -7.862 1.00 0.00 C ATOM 2011 CG2 ILE A 129 1.771 5.321 -10.044 1.00 0.00 C ATOM 2012 CD1 ILE A 129 1.649 7.821 -7.581 1.00 0.00 C ATOM 0 H ILE A 129 3.567 4.424 -8.026 1.00 0.00 H new ATOM 0 HA ILE A 129 4.382 5.740 -10.491 1.00 0.00 H new ATOM 0 HB ILE A 129 2.534 7.323 -9.812 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.539 5.661 -7.619 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.130 6.285 -7.227 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.728 5.629 -9.969 1.00 0.00 H new ATOM 0 HG22 ILE A 129 2.055 5.254 -11.094 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.897 4.347 -9.571 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.365 7.886 -6.531 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.381 8.596 -7.807 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.766 7.963 -8.205 1.00 0.00 H new ATOM 2024 N PRO A 130 5.356 7.965 -9.728 1.00 0.00 N ATOM 2025 CA PRO A 130 6.226 9.151 -9.406 1.00 0.00 C ATOM 2026 C PRO A 130 5.602 9.964 -8.268 1.00 0.00 C ATOM 2027 O PRO A 130 4.701 10.753 -8.481 1.00 0.00 O ATOM 2028 CB PRO A 130 6.316 10.006 -10.667 1.00 0.00 C ATOM 2029 CG PRO A 130 5.467 9.352 -11.735 1.00 0.00 C ATOM 2030 CD PRO A 130 4.933 8.041 -11.172 1.00 0.00 C ATOM 0 HA PRO A 130 7.217 8.826 -9.088 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.965 11.018 -10.467 1.00 0.00 H new ATOM 0 HB3 PRO A 130 7.351 10.088 -10.999 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.644 10.007 -12.022 1.00 0.00 H new ATOM 0 HG3 PRO A 130 6.057 9.169 -12.633 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.847 8.001 -11.256 1.00 0.00 H new ATOM 0 HD3 PRO A 130 5.328 7.194 -11.733 1.00 0.00 H new ATOM 2038 N LEU A 131 6.071 9.778 -7.063 1.00 0.00 N ATOM 2039 CA LEU A 131 5.502 10.541 -5.915 1.00 0.00 C ATOM 2040 C LEU A 131 6.267 11.857 -5.754 1.00 0.00 C ATOM 2041 O LEU A 131 7.400 11.982 -6.175 1.00 0.00 O ATOM 2042 CB LEU A 131 5.629 9.708 -4.637 1.00 0.00 C ATOM 2043 CG LEU A 131 4.294 9.022 -4.346 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.466 8.036 -3.188 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.252 10.080 -3.972 1.00 0.00 C ATOM 0 H LEU A 131 6.823 9.131 -6.824 1.00 0.00 H new ATOM 0 HA LEU A 131 4.449 10.755 -6.101 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.416 8.963 -4.752 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.913 10.346 -3.800 1.00 0.00 H new ATOM 0 HG LEU A 131 3.961 8.481 -5.231 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.514 7.548 -2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.208 7.285 -3.457 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.799 8.573 -2.300 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.299 9.594 -3.764 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.585 10.621 -3.086 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.130 10.779 -4.799 1.00 0.00 H new ATOM 2057 N ASN A 132 5.648 12.848 -5.166 1.00 0.00 N ATOM 2058 CA ASN A 132 6.333 14.163 -4.998 1.00 0.00 C ATOM 2059 C ASN A 132 7.003 14.239 -3.622 1.00 0.00 C ATOM 2060 O ASN A 132 6.595 14.996 -2.762 1.00 0.00 O ATOM 2061 CB ASN A 132 5.307 15.291 -5.132 1.00 0.00 C ATOM 2062 CG ASN A 132 5.958 16.494 -5.816 1.00 0.00 C ATOM 2063 OD1 ASN A 132 5.873 17.604 -5.330 1.00 0.00 O ATOM 2064 ND2 ASN A 132 6.610 16.321 -6.933 1.00 0.00 N ATOM 0 H ASN A 132 4.699 12.803 -4.795 1.00 0.00 H new ATOM 0 HA ASN A 132 7.097 14.268 -5.768 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.449 14.950 -5.712 1.00 0.00 H new ATOM 0 HB3 ASN A 132 4.934 15.576 -4.148 1.00 0.00 H new ATOM 0 HD21 ASN A 132 7.047 17.117 -7.397 1.00 0.00 H new ATOM 0 HD22 ASN A 132 6.682 15.390 -7.342 1.00 0.00 H new ATOM 2071 N TRP A 133 8.032 13.461 -3.410 1.00 0.00 N ATOM 2072 CA TRP A 133 8.737 13.484 -2.093 1.00 0.00 C ATOM 2073 C TRP A 133 9.112 14.926 -1.735 1.00 0.00 C ATOM 2074 O TRP A 133 9.177 15.292 -0.578 1.00 0.00 O ATOM 2075 CB TRP A 133 10.010 12.636 -2.178 1.00 0.00 C ATOM 2076 CG TRP A 133 9.666 11.275 -2.691 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.811 10.868 -3.972 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.121 10.139 -1.960 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.384 9.557 -4.075 1.00 0.00 N ATOM 2080 CE2 TRP A 133 8.951 9.064 -2.861 1.00 0.00 C ATOM 2081 CE3 TRP A 133 8.761 9.941 -0.615 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.440 7.835 -2.444 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.247 8.706 -0.192 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.087 7.655 -1.105 1.00 0.00 C ATOM 0 H TRP A 133 8.416 12.809 -4.094 1.00 0.00 H new ATOM 0 HA TRP A 133 8.078 13.078 -1.325 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.735 13.113 -2.838 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.476 12.559 -1.195 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.197 11.469 -4.782 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.388 9.020 -4.942 1.00 0.00 H new ATOM 0 HE3 TRP A 133 8.881 10.745 0.097 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.318 7.028 -3.152 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 7.973 8.565 0.843 1.00 0.00 H new ATOM 0 HH2 TRP A 133 7.691 6.707 -0.773 1.00 0.00 H new ATOM 2095 N ASP A 134 9.361 15.745 -2.722 1.00 0.00 N ATOM 2096 CA ASP A 134 9.733 17.163 -2.447 1.00 0.00 C ATOM 2097 C ASP A 134 8.569 17.886 -1.761 1.00 0.00 C ATOM 2098 O ASP A 134 8.770 18.806 -0.992 1.00 0.00 O ATOM 2099 CB ASP A 134 10.069 17.867 -3.766 1.00 0.00 C ATOM 2100 CG ASP A 134 11.497 18.413 -3.707 1.00 0.00 C ATOM 2101 OD1 ASP A 134 12.407 17.618 -3.535 1.00 0.00 O ATOM 2102 OD2 ASP A 134 11.657 19.616 -3.835 1.00 0.00 O ATOM 0 H ASP A 134 9.323 15.492 -3.709 1.00 0.00 H new ATOM 0 HA ASP A 134 10.602 17.184 -1.790 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.970 17.170 -4.598 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.365 18.680 -3.946 1.00 0.00 H new ATOM 2107 N ASP A 135 7.355 17.479 -2.026 1.00 0.00 N ATOM 2108 CA ASP A 135 6.184 18.145 -1.382 1.00 0.00 C ATOM 2109 C ASP A 135 5.883 17.469 -0.039 1.00 0.00 C ATOM 2110 O ASP A 135 5.080 17.945 0.739 1.00 0.00 O ATOM 2111 CB ASP A 135 4.962 18.023 -2.300 1.00 0.00 C ATOM 2112 CG ASP A 135 4.459 19.417 -2.678 1.00 0.00 C ATOM 2113 OD1 ASP A 135 4.998 19.988 -3.612 1.00 0.00 O ATOM 2114 OD2 ASP A 135 3.542 19.891 -2.027 1.00 0.00 O ATOM 0 H ASP A 135 7.124 16.714 -2.660 1.00 0.00 H new ATOM 0 HA ASP A 135 6.412 19.198 -1.214 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.225 17.465 -3.199 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.172 17.465 -1.797 1.00 0.00 H new ATOM 2119 N PHE A 136 6.525 16.365 0.236 1.00 0.00 N ATOM 2120 CA PHE A 136 6.281 15.658 1.524 1.00 0.00 C ATOM 2121 C PHE A 136 7.570 15.638 2.344 1.00 0.00 C ATOM 2122 O PHE A 136 8.645 15.902 1.842 1.00 0.00 O ATOM 2123 CB PHE A 136 5.844 14.218 1.245 1.00 0.00 C ATOM 2124 CG PHE A 136 4.429 14.200 0.719 1.00 0.00 C ATOM 2125 CD1 PHE A 136 3.352 14.140 1.611 1.00 0.00 C ATOM 2126 CD2 PHE A 136 4.193 14.230 -0.660 1.00 0.00 C ATOM 2127 CE1 PHE A 136 2.040 14.112 1.124 1.00 0.00 C ATOM 2128 CE2 PHE A 136 2.882 14.199 -1.147 1.00 0.00 C ATOM 2129 CZ PHE A 136 1.805 14.140 -0.255 1.00 0.00 C ATOM 0 H PHE A 136 7.209 15.923 -0.378 1.00 0.00 H new ATOM 0 HA PHE A 136 5.499 16.177 2.077 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.516 13.759 0.520 1.00 0.00 H new ATOM 0 HB3 PHE A 136 5.909 13.626 2.158 1.00 0.00 H new ATOM 0 HD1 PHE A 136 3.533 14.115 2.675 1.00 0.00 H new ATOM 0 HD2 PHE A 136 5.024 14.277 -1.349 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.209 14.069 1.813 1.00 0.00 H new ATOM 0 HE2 PHE A 136 2.701 14.221 -2.211 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.793 14.116 -0.631 1.00 0.00 H new ATOM 2139 N THR A 137 7.466 15.318 3.603 1.00 0.00 N ATOM 2140 CA THR A 137 8.681 15.268 4.464 1.00 0.00 C ATOM 2141 C THR A 137 8.636 14.017 5.338 1.00 0.00 C ATOM 2142 O THR A 137 7.624 13.701 5.933 1.00 0.00 O ATOM 2143 CB THR A 137 8.736 16.514 5.350 1.00 0.00 C ATOM 2144 OG1 THR A 137 8.563 17.672 4.546 1.00 0.00 O ATOM 2145 CG2 THR A 137 10.092 16.579 6.055 1.00 0.00 C ATOM 0 H THR A 137 6.591 15.088 4.074 1.00 0.00 H new ATOM 0 HA THR A 137 9.570 15.237 3.834 1.00 0.00 H new ATOM 0 HB THR A 137 7.942 16.467 6.095 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.919 18.454 5.018 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.132 17.467 6.686 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.225 15.689 6.671 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.887 16.627 5.311 1.00 0.00 H new ATOM 2153 N LYS A 138 9.724 13.299 5.421 1.00 0.00 N ATOM 2154 CA LYS A 138 9.742 12.066 6.254 1.00 0.00 C ATOM 2155 C LYS A 138 9.711 12.461 7.732 1.00 0.00 C ATOM 2156 O LYS A 138 10.600 13.127 8.226 1.00 0.00 O ATOM 2157 CB LYS A 138 11.018 11.276 5.954 1.00 0.00 C ATOM 2158 CG LYS A 138 10.905 9.869 6.545 1.00 0.00 C ATOM 2159 CD LYS A 138 11.723 9.792 7.834 1.00 0.00 C ATOM 2160 CE LYS A 138 13.214 9.873 7.497 1.00 0.00 C ATOM 2161 NZ LYS A 138 13.918 10.685 8.531 1.00 0.00 N ATOM 0 H LYS A 138 10.601 13.515 4.947 1.00 0.00 H new ATOM 0 HA LYS A 138 8.874 11.448 6.026 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.176 11.217 4.877 1.00 0.00 H new ATOM 0 HB3 LYS A 138 11.882 11.789 6.375 1.00 0.00 H new ATOM 0 HG2 LYS A 138 9.861 9.631 6.749 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.266 9.131 5.828 1.00 0.00 H new ATOM 0 HD2 LYS A 138 11.446 10.607 8.503 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.508 8.861 8.359 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.642 8.872 7.453 1.00 0.00 H new ATOM 0 HE3 LYS A 138 13.351 10.321 6.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 14.931 10.739 8.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 13.516 11.644 8.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 13.799 10.239 9.463 1.00 0.00 H new ATOM 2175 N VAL A 139 8.682 12.067 8.435 1.00 0.00 N ATOM 2176 CA VAL A 139 8.575 12.431 9.879 1.00 0.00 C ATOM 2177 C VAL A 139 9.064 11.276 10.757 1.00 0.00 C ATOM 2178 O VAL A 139 9.469 11.477 11.885 1.00 0.00 O ATOM 2179 CB VAL A 139 7.114 12.741 10.218 1.00 0.00 C ATOM 2180 CG1 VAL A 139 6.686 14.033 9.518 1.00 0.00 C ATOM 2181 CG2 VAL A 139 6.224 11.586 9.748 1.00 0.00 C ATOM 0 H VAL A 139 7.910 11.508 8.071 1.00 0.00 H new ATOM 0 HA VAL A 139 9.195 13.307 10.069 1.00 0.00 H new ATOM 0 HB VAL A 139 7.012 12.864 11.296 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.646 14.251 9.761 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.317 14.855 9.854 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.789 13.914 8.439 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.184 11.806 9.989 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.328 11.462 8.670 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.526 10.667 10.250 1.00 0.00 H new ATOM 2191 N SER A 140 9.023 10.068 10.260 1.00 0.00 N ATOM 2192 CA SER A 140 9.480 8.912 11.086 1.00 0.00 C ATOM 2193 C SER A 140 10.165 7.875 10.194 1.00 0.00 C ATOM 2194 O SER A 140 9.704 7.568 9.112 1.00 0.00 O ATOM 2195 CB SER A 140 8.272 8.274 11.775 1.00 0.00 C ATOM 2196 OG SER A 140 8.296 8.598 13.159 1.00 0.00 O ATOM 0 H SER A 140 8.695 9.832 9.323 1.00 0.00 H new ATOM 0 HA SER A 140 10.189 9.262 11.836 1.00 0.00 H new ATOM 0 HB2 SER A 140 7.348 8.633 11.321 1.00 0.00 H new ATOM 0 HB3 SER A 140 8.292 7.192 11.642 1.00 0.00 H new ATOM 0 HG SER A 140 7.522 8.192 13.603 1.00 0.00 H new ATOM 2202 N SER A 141 11.262 7.328 10.648 1.00 0.00 N ATOM 2203 CA SER A 141 11.978 6.305 9.836 1.00 0.00 C ATOM 2204 C SER A 141 12.692 5.314 10.757 1.00 0.00 C ATOM 2205 O SER A 141 13.343 5.695 11.710 1.00 0.00 O ATOM 2206 CB SER A 141 13.006 6.992 8.936 1.00 0.00 C ATOM 2207 OG SER A 141 12.595 6.874 7.580 1.00 0.00 O ATOM 0 H SER A 141 11.692 7.547 11.547 1.00 0.00 H new ATOM 0 HA SER A 141 11.255 5.768 9.222 1.00 0.00 H new ATOM 0 HB2 SER A 141 13.101 8.043 9.209 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.987 6.537 9.072 1.00 0.00 H new ATOM 0 HG SER A 141 13.385 6.823 7.002 1.00 0.00 H new ATOM 2213 N ARG A 142 12.585 4.045 10.470 1.00 0.00 N ATOM 2214 CA ARG A 142 13.266 3.020 11.309 1.00 0.00 C ATOM 2215 C ARG A 142 14.078 2.111 10.387 1.00 0.00 C ATOM 2216 O ARG A 142 13.568 1.612 9.403 1.00 0.00 O ATOM 2217 CB ARG A 142 12.217 2.191 12.055 1.00 0.00 C ATOM 2218 CG ARG A 142 12.818 1.647 13.354 1.00 0.00 C ATOM 2219 CD ARG A 142 11.877 1.946 14.523 1.00 0.00 C ATOM 2220 NE ARG A 142 11.837 3.420 14.762 1.00 0.00 N ATOM 2221 CZ ARG A 142 11.683 3.904 15.973 1.00 0.00 C ATOM 2222 NH1 ARG A 142 11.543 3.111 17.005 1.00 0.00 N ATOM 2223 NH2 ARG A 142 11.662 5.197 16.150 1.00 0.00 N ATOM 0 H ARG A 142 12.051 3.673 9.685 1.00 0.00 H new ATOM 0 HA ARG A 142 13.920 3.500 12.037 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.344 2.805 12.276 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.877 1.367 11.427 1.00 0.00 H new ATOM 0 HG2 ARG A 142 12.978 0.572 13.270 1.00 0.00 H new ATOM 0 HG3 ARG A 142 13.792 2.102 13.533 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.876 1.575 14.303 1.00 0.00 H new ATOM 0 HD3 ARG A 142 12.218 1.430 15.420 1.00 0.00 H new ATOM 0 HE ARG A 142 11.931 4.060 13.973 1.00 0.00 H new ATOM 0 HH11 ARG A 142 11.552 2.099 16.876 1.00 0.00 H new ATOM 0 HH12 ARG A 142 11.424 3.505 17.938 1.00 0.00 H new ATOM 0 HH21 ARG A 142 11.765 5.823 15.351 1.00 0.00 H new ATOM 0 HH22 ARG A 142 11.543 5.582 17.087 1.00 0.00 H new ATOM 2237 N THR A 143 15.334 1.893 10.677 1.00 0.00 N ATOM 2238 CA THR A 143 16.160 1.020 9.794 1.00 0.00 C ATOM 2239 C THR A 143 16.338 -0.349 10.450 1.00 0.00 C ATOM 2240 O THR A 143 16.766 -0.452 11.583 1.00 0.00 O ATOM 2241 CB THR A 143 17.533 1.664 9.586 1.00 0.00 C ATOM 2242 OG1 THR A 143 17.366 3.046 9.283 1.00 0.00 O ATOM 2243 CG2 THR A 143 18.264 0.961 8.437 1.00 0.00 C ATOM 0 H THR A 143 15.822 2.281 11.485 1.00 0.00 H new ATOM 0 HA THR A 143 15.661 0.900 8.832 1.00 0.00 H new ATOM 0 HB THR A 143 18.125 1.564 10.496 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.244 3.460 9.151 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.241 1.422 8.291 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.393 -0.094 8.679 1.00 0.00 H new ATOM 0 HG23 THR A 143 17.679 1.055 7.522 1.00 0.00 H new ATOM 2251 N VAL A 144 16.017 -1.402 9.747 1.00 0.00 N ATOM 2252 CA VAL A 144 16.170 -2.761 10.335 1.00 0.00 C ATOM 2253 C VAL A 144 17.046 -3.620 9.414 1.00 0.00 C ATOM 2254 O VAL A 144 16.789 -3.754 8.230 1.00 0.00 O ATOM 2255 CB VAL A 144 14.773 -3.388 10.521 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.631 -4.676 9.702 1.00 0.00 C ATOM 2257 CG2 VAL A 144 14.546 -3.704 12.005 1.00 0.00 C ATOM 0 H VAL A 144 15.656 -1.379 8.793 1.00 0.00 H new ATOM 0 HA VAL A 144 16.657 -2.701 11.308 1.00 0.00 H new ATOM 0 HB VAL A 144 14.029 -2.672 10.171 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.636 -5.095 9.853 1.00 0.00 H new ATOM 0 HG12 VAL A 144 14.774 -4.453 8.645 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.382 -5.397 10.025 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.559 -4.147 12.136 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.307 -4.405 12.348 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.611 -2.785 12.587 1.00 0.00 H new ATOM 2267 N GLU A 145 18.085 -4.193 9.958 1.00 0.00 N ATOM 2268 CA GLU A 145 19.001 -5.039 9.141 1.00 0.00 C ATOM 2269 C GLU A 145 18.497 -6.484 9.139 1.00 0.00 C ATOM 2270 O GLU A 145 17.703 -6.876 9.971 1.00 0.00 O ATOM 2271 CB GLU A 145 20.409 -4.992 9.741 1.00 0.00 C ATOM 2272 CG GLU A 145 21.242 -3.935 9.012 1.00 0.00 C ATOM 2273 CD GLU A 145 22.678 -4.438 8.849 1.00 0.00 C ATOM 2274 OE1 GLU A 145 22.866 -5.418 8.147 1.00 0.00 O ATOM 2275 OE2 GLU A 145 23.565 -3.834 9.429 1.00 0.00 O ATOM 0 H GLU A 145 18.340 -4.110 10.942 1.00 0.00 H new ATOM 0 HA GLU A 145 19.027 -4.662 8.119 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.355 -4.757 10.804 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.885 -5.969 9.654 1.00 0.00 H new ATOM 0 HG2 GLU A 145 20.807 -3.724 8.035 1.00 0.00 H new ATOM 0 HG3 GLU A 145 21.234 -3.001 9.573 1.00 0.00 H new ATOM 2282 N ASP A 146 18.953 -7.277 8.207 1.00 0.00 N ATOM 2283 CA ASP A 146 18.505 -8.697 8.148 1.00 0.00 C ATOM 2284 C ASP A 146 19.693 -9.594 7.790 1.00 0.00 C ATOM 2285 O ASP A 146 20.668 -9.149 7.217 1.00 0.00 O ATOM 2286 CB ASP A 146 17.412 -8.842 7.084 1.00 0.00 C ATOM 2287 CG ASP A 146 16.255 -9.671 7.647 1.00 0.00 C ATOM 2288 OD1 ASP A 146 15.448 -9.112 8.371 1.00 0.00 O ATOM 2289 OD2 ASP A 146 16.195 -10.851 7.342 1.00 0.00 O ATOM 0 H ASP A 146 19.617 -7.002 7.483 1.00 0.00 H new ATOM 0 HA ASP A 146 18.108 -8.995 9.119 1.00 0.00 H new ATOM 0 HB2 ASP A 146 17.054 -7.859 6.780 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.818 -9.323 6.194 1.00 0.00 H new ATOM 2294 N THR A 147 19.613 -10.858 8.114 1.00 0.00 N ATOM 2295 CA THR A 147 20.732 -11.790 7.783 1.00 0.00 C ATOM 2296 C THR A 147 20.953 -11.796 6.266 1.00 0.00 C ATOM 2297 O THR A 147 22.021 -12.119 5.783 1.00 0.00 O ATOM 2298 CB THR A 147 20.375 -13.201 8.256 1.00 0.00 C ATOM 2299 OG1 THR A 147 19.005 -13.459 7.978 1.00 0.00 O ATOM 2300 CG2 THR A 147 20.622 -13.315 9.761 1.00 0.00 C ATOM 0 H THR A 147 18.821 -11.286 8.594 1.00 0.00 H new ATOM 0 HA THR A 147 21.644 -11.462 8.282 1.00 0.00 H new ATOM 0 HB THR A 147 20.996 -13.928 7.733 1.00 0.00 H new ATOM 0 HG1 THR A 147 18.775 -14.363 8.279 1.00 0.00 H new ATOM 0 HG21 THR A 147 20.367 -14.320 10.096 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.673 -13.117 9.973 1.00 0.00 H new ATOM 0 HG23 THR A 147 20.002 -12.589 10.287 1.00 0.00 H new ATOM 2308 N ASN A 148 19.945 -11.436 5.517 1.00 0.00 N ATOM 2309 CA ASN A 148 20.084 -11.412 4.033 1.00 0.00 C ATOM 2310 C ASN A 148 20.400 -9.980 3.576 1.00 0.00 C ATOM 2311 O ASN A 148 19.602 -9.085 3.771 1.00 0.00 O ATOM 2312 CB ASN A 148 18.776 -11.878 3.386 1.00 0.00 C ATOM 2313 CG ASN A 148 19.074 -12.973 2.360 1.00 0.00 C ATOM 2314 OD1 ASN A 148 19.585 -14.021 2.702 1.00 0.00 O ATOM 2315 ND2 ASN A 148 18.775 -12.772 1.106 1.00 0.00 N ATOM 0 H ASN A 148 19.030 -11.157 5.870 1.00 0.00 H new ATOM 0 HA ASN A 148 20.892 -12.079 3.733 1.00 0.00 H new ATOM 0 HB2 ASN A 148 18.095 -12.256 4.149 1.00 0.00 H new ATOM 0 HB3 ASN A 148 18.278 -11.038 2.902 1.00 0.00 H new ATOM 0 HD21 ASN A 148 18.970 -13.495 0.413 1.00 0.00 H new ATOM 0 HD22 ASN A 148 18.346 -11.892 0.819 1.00 0.00 H new ATOM 2322 N PRO A 149 21.558 -9.802 2.984 1.00 0.00 N ATOM 2323 CA PRO A 149 22.071 -8.487 2.462 1.00 0.00 C ATOM 2324 C PRO A 149 20.977 -7.778 1.659 1.00 0.00 C ATOM 2325 O PRO A 149 20.770 -6.588 1.792 1.00 0.00 O ATOM 2326 CB PRO A 149 23.261 -8.801 1.558 1.00 0.00 C ATOM 2327 CG PRO A 149 23.579 -10.273 1.709 1.00 0.00 C ATOM 2328 CD PRO A 149 22.593 -10.861 2.712 1.00 0.00 C ATOM 0 HA PRO A 149 22.365 -7.831 3.281 1.00 0.00 H new ATOM 0 HB2 PRO A 149 23.025 -8.565 0.520 1.00 0.00 H new ATOM 0 HB3 PRO A 149 24.122 -8.193 1.835 1.00 0.00 H new ATOM 0 HG2 PRO A 149 23.497 -10.782 0.749 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.603 -10.409 2.055 1.00 0.00 H new ATOM 0 HD2 PRO A 149 22.127 -11.762 2.312 1.00 0.00 H new ATOM 0 HD3 PRO A 149 23.103 -11.147 3.632 1.00 0.00 H new ATOM 2336 N ALA A 150 20.289 -8.498 0.815 1.00 0.00 N ATOM 2337 CA ALA A 150 19.222 -7.865 -0.011 1.00 0.00 C ATOM 2338 C ALA A 150 17.948 -7.689 0.819 1.00 0.00 C ATOM 2339 O ALA A 150 17.200 -6.751 0.621 1.00 0.00 O ATOM 2340 CB ALA A 150 18.921 -8.754 -1.220 1.00 0.00 C ATOM 0 H ALA A 150 20.420 -9.498 0.662 1.00 0.00 H new ATOM 0 HA ALA A 150 19.566 -6.887 -0.348 1.00 0.00 H new ATOM 0 HB1 ALA A 150 18.141 -8.293 -1.825 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.824 -8.871 -1.819 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.584 -9.732 -0.877 1.00 0.00 H new ATOM 2346 N LEU A 151 17.682 -8.583 1.737 1.00 0.00 N ATOM 2347 CA LEU A 151 16.442 -8.459 2.561 1.00 0.00 C ATOM 2348 C LEU A 151 16.546 -7.274 3.530 1.00 0.00 C ATOM 2349 O LEU A 151 15.621 -6.993 4.264 1.00 0.00 O ATOM 2350 CB LEU A 151 16.220 -9.746 3.357 1.00 0.00 C ATOM 2351 CG LEU A 151 15.905 -10.896 2.396 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.809 -12.209 3.180 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.573 -10.624 1.686 1.00 0.00 C ATOM 0 H LEU A 151 18.267 -9.390 1.951 1.00 0.00 H new ATOM 0 HA LEU A 151 15.600 -8.289 1.890 1.00 0.00 H new ATOM 0 HB2 LEU A 151 17.109 -9.981 3.943 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.399 -9.613 4.062 1.00 0.00 H new ATOM 0 HG LEU A 151 16.700 -10.974 1.655 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.585 -13.026 2.495 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.758 -12.404 3.680 1.00 0.00 H new ATOM 0 HD13 LEU A 151 15.016 -12.131 3.924 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.351 -11.444 1.003 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.777 -10.542 2.426 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.644 -9.692 1.124 1.00 0.00 H new ATOM 2365 N THR A 152 17.644 -6.560 3.535 1.00 0.00 N ATOM 2366 CA THR A 152 17.753 -5.387 4.450 1.00 0.00 C ATOM 2367 C THR A 152 16.725 -4.349 4.000 1.00 0.00 C ATOM 2368 O THR A 152 16.485 -4.192 2.818 1.00 0.00 O ATOM 2369 CB THR A 152 19.163 -4.794 4.363 1.00 0.00 C ATOM 2370 OG1 THR A 152 20.122 -5.835 4.483 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.366 -3.778 5.489 1.00 0.00 C ATOM 0 H THR A 152 18.461 -6.737 2.951 1.00 0.00 H new ATOM 0 HA THR A 152 17.566 -5.686 5.481 1.00 0.00 H new ATOM 0 HB THR A 152 19.286 -4.295 3.402 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.386 -6.141 3.590 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.370 -3.358 5.424 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.632 -2.978 5.394 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.241 -4.273 6.452 1.00 0.00 H new ATOM 2379 N HIS A 153 16.098 -3.648 4.909 1.00 0.00 N ATOM 2380 CA HIS A 153 15.080 -2.650 4.468 1.00 0.00 C ATOM 2381 C HIS A 153 14.854 -1.579 5.535 1.00 0.00 C ATOM 2382 O HIS A 153 15.166 -1.757 6.696 1.00 0.00 O ATOM 2383 CB HIS A 153 13.757 -3.366 4.184 1.00 0.00 C ATOM 2384 CG HIS A 153 13.400 -4.255 5.344 1.00 0.00 C ATOM 2385 ND1 HIS A 153 14.054 -5.454 5.584 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.462 -4.135 6.339 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.505 -6.003 6.683 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.529 -5.240 7.183 1.00 0.00 N ATOM 0 H HIS A 153 16.242 -3.720 5.916 1.00 0.00 H new ATOM 0 HA HIS A 153 15.449 -2.163 3.565 1.00 0.00 H new ATOM 0 HB2 HIS A 153 12.966 -2.635 4.017 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.842 -3.958 3.273 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.813 -5.848 5.028 1.00 0.00 H new ATOM 0 HD2 HIS A 153 11.776 -3.308 6.450 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.816 -6.946 7.109 1.00 0.00 H new ATOM 2396 N THR A 154 14.301 -0.465 5.131 1.00 0.00 N ATOM 2397 CA THR A 154 14.030 0.643 6.087 1.00 0.00 C ATOM 2398 C THR A 154 12.589 1.128 5.893 1.00 0.00 C ATOM 2399 O THR A 154 12.031 1.019 4.819 1.00 0.00 O ATOM 2400 CB THR A 154 14.997 1.797 5.803 1.00 0.00 C ATOM 2401 OG1 THR A 154 16.291 1.275 5.534 1.00 0.00 O ATOM 2402 CG2 THR A 154 15.061 2.728 7.012 1.00 0.00 C ATOM 0 H THR A 154 14.023 -0.276 4.168 1.00 0.00 H new ATOM 0 HA THR A 154 14.166 0.294 7.111 1.00 0.00 H new ATOM 0 HB THR A 154 14.644 2.358 4.938 1.00 0.00 H new ATOM 0 HG1 THR A 154 16.910 2.013 5.351 1.00 0.00 H new ATOM 0 HG21 THR A 154 15.750 3.547 6.805 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.069 3.131 7.214 1.00 0.00 H new ATOM 0 HG23 THR A 154 15.410 2.171 7.882 1.00 0.00 H new ATOM 2410 N TYR A 155 11.983 1.665 6.919 1.00 0.00 N ATOM 2411 CA TYR A 155 10.582 2.161 6.784 1.00 0.00 C ATOM 2412 C TYR A 155 10.598 3.690 6.744 1.00 0.00 C ATOM 2413 O TYR A 155 11.081 4.330 7.655 1.00 0.00 O ATOM 2414 CB TYR A 155 9.753 1.706 7.989 1.00 0.00 C ATOM 2415 CG TYR A 155 9.811 0.203 8.123 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.087 -0.608 7.241 1.00 0.00 C ATOM 2417 CD2 TYR A 155 10.582 -0.378 9.136 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.134 -2.001 7.373 1.00 0.00 C ATOM 2419 CE2 TYR A 155 10.631 -1.771 9.267 1.00 0.00 C ATOM 2420 CZ TYR A 155 9.906 -2.583 8.386 1.00 0.00 C ATOM 2421 OH TYR A 155 9.951 -3.957 8.517 1.00 0.00 O ATOM 0 H TYR A 155 12.397 1.781 7.844 1.00 0.00 H new ATOM 0 HA TYR A 155 10.143 1.763 5.869 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.131 2.174 8.898 1.00 0.00 H new ATOM 0 HB3 TYR A 155 8.719 2.028 7.871 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.492 -0.159 6.459 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.139 0.248 9.817 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.575 -2.627 6.693 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.228 -2.219 10.047 1.00 0.00 H new ATOM 0 HH TYR A 155 10.533 -4.195 9.268 1.00 0.00 H new ATOM 2431 N GLU A 156 10.085 4.285 5.699 1.00 0.00 N ATOM 2432 CA GLU A 156 10.085 5.774 5.619 1.00 0.00 C ATOM 2433 C GLU A 156 8.646 6.293 5.671 1.00 0.00 C ATOM 2434 O GLU A 156 7.824 5.952 4.843 1.00 0.00 O ATOM 2435 CB GLU A 156 10.735 6.213 4.305 1.00 0.00 C ATOM 2436 CG GLU A 156 12.227 5.872 4.328 1.00 0.00 C ATOM 2437 CD GLU A 156 13.016 6.985 3.635 1.00 0.00 C ATOM 2438 OE1 GLU A 156 12.826 7.164 2.443 1.00 0.00 O ATOM 2439 OE2 GLU A 156 13.796 7.639 4.307 1.00 0.00 O ATOM 0 H GLU A 156 9.668 3.806 4.901 1.00 0.00 H new ATOM 0 HA GLU A 156 10.647 6.180 6.460 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.251 5.715 3.465 1.00 0.00 H new ATOM 0 HB3 GLU A 156 10.599 7.285 4.161 1.00 0.00 H new ATOM 0 HG2 GLU A 156 12.568 5.756 5.357 1.00 0.00 H new ATOM 0 HG3 GLU A 156 12.401 4.921 3.825 1.00 0.00 H new ATOM 2446 N VAL A 157 8.336 7.118 6.637 1.00 0.00 N ATOM 2447 CA VAL A 157 6.951 7.663 6.744 1.00 0.00 C ATOM 2448 C VAL A 157 6.973 9.162 6.433 1.00 0.00 C ATOM 2449 O VAL A 157 7.702 9.917 7.045 1.00 0.00 O ATOM 2450 CB VAL A 157 6.426 7.447 8.165 1.00 0.00 C ATOM 2451 CG1 VAL A 157 4.969 7.906 8.248 1.00 0.00 C ATOM 2452 CG2 VAL A 157 6.515 5.960 8.522 1.00 0.00 C ATOM 0 H VAL A 157 8.984 7.438 7.357 1.00 0.00 H new ATOM 0 HA VAL A 157 6.301 7.150 6.035 1.00 0.00 H new ATOM 0 HB VAL A 157 7.028 8.025 8.866 1.00 0.00 H new ATOM 0 HG11 VAL A 157 4.596 7.752 9.261 1.00 0.00 H new ATOM 0 HG12 VAL A 157 4.906 8.964 7.995 1.00 0.00 H new ATOM 0 HG13 VAL A 157 4.365 7.329 7.547 1.00 0.00 H new ATOM 0 HG21 VAL A 157 6.141 5.806 9.534 1.00 0.00 H new ATOM 0 HG22 VAL A 157 5.914 5.381 7.821 1.00 0.00 H new ATOM 0 HG23 VAL A 157 7.553 5.634 8.465 1.00 0.00 H new ATOM 2462 N TRP A 158 6.178 9.604 5.491 1.00 0.00 N ATOM 2463 CA TRP A 158 6.164 11.058 5.152 1.00 0.00 C ATOM 2464 C TRP A 158 4.794 11.658 5.481 1.00 0.00 C ATOM 2465 O TRP A 158 3.810 10.958 5.615 1.00 0.00 O ATOM 2466 CB TRP A 158 6.440 11.247 3.658 1.00 0.00 C ATOM 2467 CG TRP A 158 7.697 10.535 3.274 1.00 0.00 C ATOM 2468 CD1 TRP A 158 7.855 9.192 3.249 1.00 0.00 C ATOM 2469 CD2 TRP A 158 8.970 11.104 2.850 1.00 0.00 C ATOM 2470 NE1 TRP A 158 9.144 8.901 2.840 1.00 0.00 N ATOM 2471 CE2 TRP A 158 9.870 10.047 2.584 1.00 0.00 C ATOM 2472 CE3 TRP A 158 9.426 12.423 2.676 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 11.177 10.288 2.158 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 10.741 12.670 2.247 1.00 0.00 C ATOM 2475 CH2 TRP A 158 11.614 11.604 1.989 1.00 0.00 C ATOM 0 H TRP A 158 5.541 9.023 4.945 1.00 0.00 H new ATOM 0 HA TRP A 158 6.935 11.560 5.736 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.603 10.864 3.074 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.529 12.309 3.428 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.098 8.466 3.506 1.00 0.00 H new ATOM 0 HE1 TRP A 158 9.513 7.955 2.740 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.761 13.251 2.873 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 11.846 9.463 1.960 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 11.081 13.687 2.115 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.624 11.800 1.660 1.00 0.00 H new ATOM 2486 N GLN A 159 4.728 12.958 5.580 1.00 0.00 N ATOM 2487 CA GLN A 159 3.432 13.636 5.869 1.00 0.00 C ATOM 2488 C GLN A 159 3.340 14.884 4.990 1.00 0.00 C ATOM 2489 O GLN A 159 4.337 15.532 4.729 1.00 0.00 O ATOM 2490 CB GLN A 159 3.380 14.040 7.345 1.00 0.00 C ATOM 2491 CG GLN A 159 2.988 12.828 8.192 1.00 0.00 C ATOM 2492 CD GLN A 159 2.384 13.303 9.515 1.00 0.00 C ATOM 2493 OE1 GLN A 159 3.124 13.313 10.590 1.00 0.00 O flip ATOM 2494 NE2 GLN A 159 1.227 13.669 9.571 1.00 0.00 N flip ATOM 0 H GLN A 159 5.525 13.585 5.472 1.00 0.00 H new ATOM 0 HA GLN A 159 2.599 12.965 5.659 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.350 14.421 7.663 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.659 14.845 7.488 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.269 12.211 7.653 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.863 12.206 8.382 1.00 0.00 H new ATOM 0 HE21 GLN A 159 0.648 13.661 8.731 1.00 0.00 H new ATOM 0 HE22 GLN A 159 0.834 13.984 10.458 1.00 0.00 H new ATOM 2503 N LYS A 160 2.170 15.231 4.517 1.00 0.00 N ATOM 2504 CA LYS A 160 2.049 16.436 3.646 1.00 0.00 C ATOM 2505 C LYS A 160 2.323 17.700 4.462 1.00 0.00 C ATOM 2506 O LYS A 160 1.661 17.971 5.446 1.00 0.00 O ATOM 2507 CB LYS A 160 0.632 16.503 3.072 1.00 0.00 C ATOM 2508 CG LYS A 160 0.621 17.404 1.836 1.00 0.00 C ATOM 2509 CD LYS A 160 -0.770 18.020 1.668 1.00 0.00 C ATOM 2510 CE LYS A 160 -1.076 18.203 0.179 1.00 0.00 C ATOM 2511 NZ LYS A 160 -1.036 19.653 -0.161 1.00 0.00 N ATOM 0 H LYS A 160 1.298 14.734 4.696 1.00 0.00 H new ATOM 0 HA LYS A 160 2.775 16.368 2.836 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.288 15.503 2.808 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -0.057 16.890 3.823 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.369 18.190 1.939 1.00 0.00 H new ATOM 0 HG3 LYS A 160 0.885 16.827 0.950 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -1.521 17.377 2.127 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.817 18.981 2.180 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -0.349 17.657 -0.422 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -2.057 17.790 -0.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -1.244 19.778 -1.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.746 20.162 0.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -0.091 20.033 0.048 1.00 0.00 H new ATOM 2525 N LYS A 161 3.293 18.476 4.060 1.00 0.00 N ATOM 2526 CA LYS A 161 3.612 19.725 4.807 1.00 0.00 C ATOM 2527 C LYS A 161 2.758 20.876 4.272 1.00 0.00 C ATOM 2528 O LYS A 161 2.157 20.780 3.220 1.00 0.00 O ATOM 2529 CB LYS A 161 5.092 20.064 4.624 1.00 0.00 C ATOM 2530 CG LYS A 161 5.950 18.986 5.288 1.00 0.00 C ATOM 2531 CD LYS A 161 5.813 19.088 6.810 1.00 0.00 C ATOM 2532 CE LYS A 161 5.629 17.692 7.411 1.00 0.00 C ATOM 2533 NZ LYS A 161 6.724 17.425 8.387 1.00 0.00 N ATOM 0 H LYS A 161 3.879 18.298 3.245 1.00 0.00 H new ATOM 0 HA LYS A 161 3.399 19.577 5.866 1.00 0.00 H new ATOM 0 HB2 LYS A 161 5.332 20.132 3.563 1.00 0.00 H new ATOM 0 HB3 LYS A 161 5.310 21.038 5.063 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.637 17.998 4.950 1.00 0.00 H new ATOM 0 HG3 LYS A 161 6.994 19.107 4.997 1.00 0.00 H new ATOM 0 HD2 LYS A 161 6.699 19.562 7.233 1.00 0.00 H new ATOM 0 HD3 LYS A 161 4.962 19.719 7.066 1.00 0.00 H new ATOM 0 HE2 LYS A 161 4.660 17.622 7.906 1.00 0.00 H new ATOM 0 HE3 LYS A 161 5.639 16.940 6.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 6.960 16.412 8.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 7.564 17.979 8.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 6.413 17.697 9.341 1.00 0.00 H new ATOM 2547 N ALA A 162 2.702 21.965 4.991 1.00 0.00 N ATOM 2548 CA ALA A 162 1.890 23.127 4.530 1.00 0.00 C ATOM 2549 C ALA A 162 2.762 24.384 4.510 1.00 0.00 C ATOM 2550 O ALA A 162 3.416 24.643 5.507 1.00 0.00 O ATOM 2551 CB ALA A 162 0.712 23.338 5.483 1.00 0.00 C ATOM 2552 OXT ALA A 162 2.762 25.066 3.498 1.00 0.00 O ATOM 0 H ALA A 162 3.185 22.100 5.879 1.00 0.00 H new ATOM 0 HA ALA A 162 1.514 22.930 3.526 1.00 0.00 H new ATOM 0 HB1 ALA A 162 0.119 24.188 5.145 1.00 0.00 H new ATOM 0 HB2 ALA A 162 0.090 22.443 5.496 1.00 0.00 H new ATOM 0 HB3 ALA A 162 1.087 23.534 6.488 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 PA NDP A 168 -3.782 -2.977 -9.321 1.00 0.00 P HETATM 2560 O1A NDP A 168 -3.795 -4.087 -8.347 1.00 0.00 O HETATM 2561 O2A NDP A 168 -3.257 -1.676 -8.863 1.00 0.00 O HETATM 2562 O5B NDP A 168 -5.197 -2.811 -10.035 1.00 0.00 O HETATM 2563 C5B NDP A 168 -6.212 -1.966 -9.465 1.00 0.00 C HETATM 2564 C4B NDP A 168 -7.572 -2.329 -10.014 1.00 0.00 C HETATM 2565 O4B NDP A 168 -8.590 -1.586 -9.294 1.00 0.00 O HETATM 2566 C3B NDP A 168 -7.805 -1.983 -11.477 1.00 0.00 C HETATM 2567 O3B NDP A 168 -7.333 -3.026 -12.335 1.00 0.00 O HETATM 2568 C2B NDP A 168 -9.321 -1.845 -11.541 1.00 0.00 C HETATM 2569 O2B NDP A 168 -10.007 -3.073 -11.677 1.00 0.00 O HETATM 2570 C1B NDP A 168 -9.627 -1.208 -10.183 1.00 0.00 C HETATM 2571 N9A NDP A 168 -9.678 0.252 -10.223 1.00 0.00 N HETATM 2572 C8A NDP A 168 -8.634 1.129 -10.390 1.00 0.00 C HETATM 2573 N7A NDP A 168 -8.995 2.390 -10.376 1.00 0.00 N HETATM 2574 C5A NDP A 168 -10.370 2.340 -10.190 1.00 0.00 C HETATM 2575 C6A NDP A 168 -11.351 3.345 -10.084 1.00 0.00 C HETATM 2576 N6A NDP A 168 -11.083 4.651 -10.154 1.00 0.00 N HETATM 2577 N1A NDP A 168 -12.634 2.957 -9.900 1.00 0.00 N HETATM 2578 C2A NDP A 168 -12.904 1.646 -9.830 1.00 0.00 C HETATM 2579 N3A NDP A 168 -12.070 0.609 -9.916 1.00 0.00 N HETATM 2580 C4A NDP A 168 -10.804 1.029 -10.097 1.00 0.00 C HETATM 2581 O3 NDP A 168 -2.915 -3.450 -10.642 1.00 0.00 O HETATM 2582 PN NDP A 168 -1.421 -3.101 -11.249 1.00 0.00 P HETATM 2583 O1N NDP A 168 -1.158 -4.009 -12.383 1.00 0.00 O HETATM 2584 O2N NDP A 168 -1.351 -1.650 -11.507 1.00 0.00 O HETATM 2585 O5D NDP A 168 -0.567 -3.508 -9.968 1.00 0.00 O HETATM 2586 C5D NDP A 168 -0.960 -4.620 -9.144 1.00 0.00 C HETATM 2587 C4D NDP A 168 0.256 -5.405 -8.707 1.00 0.00 C HETATM 2588 O4D NDP A 168 1.155 -4.543 -7.959 1.00 0.00 O HETATM 2589 C3D NDP A 168 -0.006 -6.570 -7.767 1.00 0.00 C HETATM 2590 O3D NDP A 168 -0.385 -7.741 -8.498 1.00 0.00 O HETATM 2591 C2D NDP A 168 1.351 -6.753 -7.096 1.00 0.00 C HETATM 2592 O2D NDP A 168 2.276 -7.512 -7.876 1.00 0.00 O HETATM 2593 C1D NDP A 168 1.828 -5.303 -6.967 1.00 0.00 C HETATM 2594 N1N NDP A 168 1.562 -4.700 -5.660 1.00 0.00 N HETATM 2595 C2N NDP A 168 2.353 -3.965 -4.886 1.00 0.00 C HETATM 2596 C3N NDP A 168 2.050 -3.429 -3.746 1.00 0.00 C HETATM 2597 C7N NDP A 168 3.195 -2.769 -3.192 1.00 0.00 C HETATM 2598 O7N NDP A 168 2.737 -2.207 -2.094 1.00 0.00 O HETATM 2599 N7N NDP A 168 4.469 -2.667 -3.644 1.00 0.00 N HETATM 2600 C4N NDP A 168 0.659 -3.638 -3.223 1.00 0.00 C HETATM 2601 C5N NDP A 168 -0.257 -4.428 -4.001 1.00 0.00 C HETATM 2602 C6N NDP A 168 0.111 -5.000 -5.225 1.00 0.00 C HETATM 2603 P2B NDP A 168 -10.987 -3.565 -12.938 1.00 0.00 P HETATM 2604 O1X NDP A 168 -12.203 -4.090 -12.075 1.00 0.00 O HETATM 2605 O2X NDP A 168 -11.346 -2.212 -13.550 1.00 0.00 O HETATM 2606 O3X NDP A 168 -10.186 -4.756 -13.460 1.00 0.00 O HETATM 0 HO3N NDP A 168 0.419 -8.228 -8.775 1.00 0.00 H new HETATM 0 HO3A NDP A 168 -8.079 -3.614 -12.576 1.00 0.00 H new HETATM 0 HO2N NDP A 168 2.302 -8.435 -7.547 1.00 0.00 H new HETATM 0 H72N NDP A 168 5.161 -2.147 -3.105 1.00 0.00 H new HETATM 0 H71N NDP A 168 4.735 -3.110 -4.523 1.00 0.00 H new HETATM 0 H62A NDP A 168 -11.838 5.332 -10.070 1.00 0.00 H new HETATM 0 H61A NDP A 168 -10.123 4.968 -10.291 1.00 0.00 H new HETATM 0 H52N NDP A 168 -1.502 -4.260 -8.270 1.00 0.00 H new HETATM 0 H52A NDP A 168 -6.212 -2.069 -8.380 1.00 0.00 H new HETATM 0 H51N NDP A 168 -1.640 -5.268 -9.696 1.00 0.00 H new HETATM 0 H51A NDP A 168 -5.991 -0.922 -9.686 1.00 0.00 H new HETATM 0 H42N NDP A 168 0.741 -4.100 -2.239 1.00 0.00 H new HETATM 0 H41N NDP A 168 0.209 -2.656 -3.078 1.00 0.00 H new HETATM 0 H8A NDP A 168 -7.601 0.807 -10.522 1.00 0.00 H new HETATM 0 H6N NDP A 168 -0.570 -5.607 -5.821 1.00 0.00 H new HETATM 0 H5N NDP A 168 -1.268 -4.586 -3.627 1.00 0.00 H new HETATM 0 H4D NDP A 168 0.654 -5.790 -9.646 1.00 0.00 H new HETATM 0 H4B NDP A 168 -7.622 -3.412 -9.901 1.00 0.00 H new HETATM 0 H3D NDP A 168 -0.820 -6.395 -7.064 1.00 0.00 H new HETATM 0 H3B NDP A 168 -7.276 -1.089 -11.807 1.00 0.00 H new HETATM 0 H2N NDP A 168 3.366 -3.794 -5.249 1.00 0.00 H new HETATM 0 H2D NDP A 168 1.279 -7.308 -6.161 1.00 0.00 H new HETATM 0 H2B NDP A 168 -9.645 -1.276 -12.413 1.00 0.00 H new HETATM 0 H2A NDP A 168 -13.953 1.392 -9.682 1.00 0.00 H new HETATM 0 H1D NDP A 168 2.911 -5.304 -7.090 1.00 0.00 H new HETATM 0 H1B NDP A 168 -10.611 -1.555 -9.868 1.00 0.00 H new HETATM 2633 N1 TRR A 170 4.104 -5.075 1.555 1.00 0.00 N HETATM 2634 C2 TRR A 170 3.952 -3.738 1.840 1.00 0.00 C HETATM 2635 N2 TRR A 170 4.935 -3.070 2.537 1.00 0.00 N HETATM 2636 N3 TRR A 170 2.818 -3.069 1.428 1.00 0.00 N HETATM 2637 C4 TRR A 170 1.833 -3.738 0.730 1.00 0.00 C HETATM 2638 N4 TRR A 170 0.704 -3.065 0.321 1.00 0.00 N HETATM 2639 C5 TRR A 170 1.984 -5.091 0.441 1.00 0.00 C HETATM 2640 C6 TRR A 170 3.129 -5.754 0.860 1.00 0.00 C HETATM 2641 C7 TRR A 170 0.912 -5.828 -0.321 1.00 0.00 C HETATM 2642 C11 TRR A 170 0.941 -7.321 -0.108 1.00 0.00 C HETATM 2643 C12 TRR A 170 1.381 -8.161 -1.130 1.00 0.00 C HETATM 2644 C13 TRR A 170 1.406 -9.552 -0.936 1.00 0.00 C HETATM 2645 C14 TRR A 170 0.990 -10.087 0.282 1.00 0.00 C HETATM 2646 C15 TRR A 170 0.550 -9.250 1.306 1.00 0.00 C HETATM 2647 C16 TRR A 170 0.526 -7.861 1.109 1.00 0.00 C HETATM 2648 O13 TRR A 170 1.841 -10.415 -1.944 1.00 0.00 O HETATM 2649 O14 TRR A 170 1.015 -11.453 0.476 1.00 0.00 O HETATM 2650 O15 TRR A 170 0.140 -9.809 2.514 1.00 0.00 O HETATM 2651 C17 TRR A 170 2.264 -9.890 -3.179 1.00 0.00 C HETATM 2652 C18 TRR A 170 2.223 -12.038 0.881 1.00 0.00 C HETATM 2653 C19 TRR A 170 -0.298 -8.962 3.543 1.00 0.00 C HETATM 0 H193 TRR A 170 0.505 -8.278 3.818 1.00 0.00 H new HETATM 0 H192 TRR A 170 -1.160 -8.390 3.201 1.00 0.00 H new HETATM 0 H191 TRR A 170 -0.579 -9.559 4.411 1.00 0.00 H new HETATM 0 H183 TRR A 170 2.990 -11.845 0.131 1.00 0.00 H new HETATM 0 H182 TRR A 170 2.532 -11.611 1.835 1.00 0.00 H new HETATM 0 H181 TRR A 170 2.087 -13.114 0.992 1.00 0.00 H new HETATM 0 H173 TRR A 170 1.445 -9.337 -3.639 1.00 0.00 H new HETATM 0 H172 TRR A 170 3.110 -9.221 -3.019 1.00 0.00 H new HETATM 0 H171 TRR A 170 2.565 -10.705 -3.837 1.00 0.00 H new HETATM 0 H72 TRR A 170 -0.064 -5.445 -0.022 1.00 0.00 H new HETATM 0 H71 TRR A 170 1.024 -5.618 -1.385 1.00 0.00 H new HETATM 0 H6 TRR A 170 3.256 -6.814 0.638 1.00 0.00 H new HETATM 0 H42 TRR A 170 -0.025 -3.558 -0.195 1.00 0.00 H new HETATM 0 H41 TRR A 170 0.596 -2.073 0.534 1.00 0.00 H new HETATM 0 H22 TRR A 170 4.825 -2.079 2.750 1.00 0.00 H new HETATM 0 H21 TRR A 170 5.773 -3.567 2.840 1.00 0.00 H new HETATM 0 H16 TRR A 170 0.183 -7.204 1.908 1.00 0.00 H new HETATM 0 H12 TRR A 170 1.706 -7.738 -2.081 1.00 0.00 H new HETATM 0 H1 TRR A 170 4.944 -5.566 1.860 1.00 0.00 H new