USER MOD reduce.3.24.130724 H: found=0, std=0, add=1105, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1109 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 137 HIS : no HD1:sc= -0.178 X(o=-1.5,f=-1.2) USER MOD Set 1.2: A 141 GLN : amide:sc= -1.28 X(o=-1.5,f=-1.4) USER MOD Set 2.1: A 118 THR OG1 : rot -135:sc= 1.3 USER MOD Set 2.2: A 120 THR OG1 : rot 180:sc= 0.0158 USER MOD Set 3.1: A 96 HIS :FLIP no HD1:sc= 0.0759 F(o=-1.3,f=0.35) USER MOD Set 3.2: A 108 THR OG1 : rot 180:sc= 0 USER MOD Set 3.3: A 109 SER OG : rot 131:sc= 0.274 USER MOD Set 4.1: A 87 HIS : +bothHN:sc= 0.022 K(o=3.5,f=-4.1!) USER MOD Set 4.2: A 97 SER OG : rot 55:sc= 1.41 USER MOD Set 4.3: A 107 THR OG1 : rot -80:sc= 2.05 USER MOD Set 5.1: A 74 ASN : amide:sc= -3.66! C(o=-2.8!,f=-2.4!) USER MOD Set 5.2: A 80 GLN : amide:sc= 0.888 K(o=-2.8,f=-3.4) USER MOD Set 6.1: A 31 HIS : no HD1:sc= 0.79 K(o=0.79,f=-3.8!) USER MOD Set 6.2: A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= -0.0406 X(o=-0.041,f=-0.32) USER MOD Single : A 6 GLN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD Single : A 8 LYS NZ :NH3+ 156:sc= 1.17 (180deg=0.988) USER MOD Single : A 13 THR OG1 : rot 3:sc= 1.01 USER MOD Single : A 24 THR OG1 : rot 39:sc= 0.0478 USER MOD Single : A 27 TYR OH : rot 100:sc= -0.12 USER MOD Single : A 29 CYS SG : rot 180:sc= 0.00807 USER MOD Single : A 32 ASN : amide:sc= -0.0495 K(o=-0.049,f=-1.7!) USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 ASN : amide:sc= 1.29 K(o=1.3,f=-4.6!) USER MOD Single : A 43 THR OG1 : rot 180:sc=-0.00376 USER MOD Single : A 45 THR OG1 : rot -49:sc= 2.17 USER MOD Single : A 48 SER OG : rot -133:sc= 1.27 USER MOD Single : A 54 THR OG1 : rot 24:sc= 0.832 USER MOD Single : A 56 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -0.125 X(o=-0.13,f=-0.072) USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN :FLIP amide:sc= 0 F(o=-1.7!,f=0) USER MOD Single : A 88 SER OG : rot 42:sc= 1.17 USER MOD Single : A 89 LYS NZ :NH3+ 161:sc= -0.0242 (180deg=-0.302) USER MOD Single : A 90 THR OG1 : rot 137:sc= 1.02 USER MOD Single : A 92 HIS : no HE2:sc= 1.17 K(o=1.2,f=-4.2!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 62:sc= 1.12 USER MOD Single : A 99 LYS NZ :NH3+ -163:sc= 1.15 (180deg=0.699) USER MOD Single : A 101 THR OG1 : rot -58:sc= 0.115 USER MOD Single : A 105 THR OG1 : rot 61:sc= 0.271 USER MOD Single : A 115 SER OG : rot 67:sc= 0.314 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 124 LYS NZ :NH3+ 150:sc= 1.21 (180deg=0.924) USER MOD Single : A 128 CYS SG : rot -6:sc=-0.00356 USER MOD Single : A 131 CYS SG : rot 74:sc= 0.674 USER MOD Single : A 132 SER OG : rot 63:sc= 0.84 USER MOD Single : A 133 THR OG1 : rot 152:sc= -1.15 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 GLN : amide:sc= -0.0966 K(o=-0.097,f=-0.66) USER MOD Single : A 145 GLN : amide:sc= -0.0454 K(o=-0.045,f=-3.2!) USER MOD Single : A 146 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= -0.0172 USER MOD Single : A 154 ASN : amide:sc= -0.117 K(o=-0.12,f=-2.3!) USER MOD Single : A 155 ASN : amide:sc= -0.488 K(o=-0.49,f=-2.3!) USER MOD Single : A 156 GLN : amide:sc= 0.979 K(o=0.98,f=-0.32) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0.00379 USER MOD Single : A 161 THR OG1 : rot 136:sc= 0.839 USER MOD Single : A 171 ASN : amide:sc= -0.0158 K(o=-0.016,f=-5.5!) USER MOD Single : A 173 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 44 N ASN A 4 5.559 -14.934 11.017 1.00 0.00 N ATOM 45 CA ASN A 4 5.711 -13.522 10.712 1.00 0.00 C ATOM 46 C ASN A 4 6.121 -13.324 9.254 1.00 0.00 C ATOM 47 O ASN A 4 7.254 -13.596 8.869 1.00 0.00 O ATOM 48 CB ASN A 4 6.707 -12.847 11.675 1.00 0.00 C ATOM 49 CG ASN A 4 8.045 -13.563 11.783 1.00 0.00 C ATOM 50 OD1 ASN A 4 8.974 -13.285 11.029 1.00 0.00 O ATOM 51 ND2 ASN A 4 8.158 -14.478 12.734 1.00 0.00 N ATOM 0 HA ASN A 4 4.744 -13.039 10.855 1.00 0.00 H new ATOM 0 HB2 ASN A 4 6.880 -11.823 11.343 1.00 0.00 H new ATOM 0 HB3 ASN A 4 6.256 -12.789 12.666 1.00 0.00 H new ATOM 0 HD21 ASN A 4 9.038 -14.978 12.859 1.00 0.00 H new ATOM 0 HD22 ASN A 4 7.365 -14.683 13.342 1.00 0.00 H new ATOM 58 N LEU A 5 5.168 -12.877 8.439 1.00 0.00 N ATOM 59 CA LEU A 5 5.414 -12.652 7.020 1.00 0.00 C ATOM 60 C LEU A 5 6.211 -11.368 6.794 1.00 0.00 C ATOM 61 O LEU A 5 7.437 -11.386 6.862 1.00 0.00 O ATOM 62 CB LEU A 5 4.090 -12.605 6.248 1.00 0.00 C ATOM 63 CG LEU A 5 3.285 -13.906 6.267 1.00 0.00 C ATOM 64 CD1 LEU A 5 1.937 -13.707 5.593 1.00 0.00 C ATOM 65 CD2 LEU A 5 4.058 -15.024 5.585 1.00 0.00 C ATOM 0 H LEU A 5 4.217 -12.664 8.740 1.00 0.00 H new ATOM 0 HA LEU A 5 6.008 -13.486 6.645 1.00 0.00 H new ATOM 0 HB2 LEU A 5 3.473 -11.807 6.662 1.00 0.00 H new ATOM 0 HB3 LEU A 5 4.300 -12.340 5.212 1.00 0.00 H new ATOM 0 HG LEU A 5 3.115 -14.189 7.306 1.00 0.00 H new ATOM 0 HD11 LEU A 5 1.377 -14.642 5.615 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.376 -12.936 6.121 1.00 0.00 H new ATOM 0 HD13 LEU A 5 2.089 -13.400 4.558 1.00 0.00 H new ATOM 0 HD21 LEU A 5 3.469 -15.941 5.609 1.00 0.00 H new ATOM 0 HD22 LEU A 5 4.259 -14.749 4.550 1.00 0.00 H new ATOM 0 HD23 LEU A 5 5.001 -15.185 6.107 1.00 0.00 H new ATOM 77 N GLN A 6 5.501 -10.258 6.548 1.00 0.00 N ATOM 78 CA GLN A 6 6.127 -8.952 6.290 1.00 0.00 C ATOM 79 C GLN A 6 6.935 -8.965 4.988 1.00 0.00 C ATOM 80 O GLN A 6 7.909 -9.701 4.851 1.00 0.00 O ATOM 81 CB GLN A 6 7.016 -8.534 7.470 1.00 0.00 C ATOM 82 CG GLN A 6 7.831 -7.275 7.211 1.00 0.00 C ATOM 83 CD GLN A 6 8.704 -6.881 8.390 1.00 0.00 C ATOM 84 OE1 GLN A 6 8.242 -7.158 9.601 1.00 0.00 O flip ATOM 85 NE2 GLN A 6 9.787 -6.328 8.212 1.00 0.00 N flip ATOM 0 H GLN A 6 4.482 -10.239 6.522 1.00 0.00 H new ATOM 0 HA GLN A 6 5.328 -8.219 6.179 1.00 0.00 H new ATOM 0 HB2 GLN A 6 6.388 -8.375 8.347 1.00 0.00 H new ATOM 0 HB3 GLN A 6 7.695 -9.352 7.708 1.00 0.00 H new ATOM 0 HG2 GLN A 6 8.461 -7.430 6.335 1.00 0.00 H new ATOM 0 HG3 GLN A 6 7.155 -6.453 6.976 1.00 0.00 H new ATOM 0 HE21 GLN A 6 10.109 -6.131 7.265 1.00 0.00 H new ATOM 0 HE22 GLN A 6 10.363 -6.066 9.012 1.00 0.00 H new ATOM 94 N GLY A 7 6.522 -8.147 4.030 1.00 0.00 N ATOM 95 CA GLY A 7 7.194 -8.120 2.742 1.00 0.00 C ATOM 96 C GLY A 7 6.548 -9.050 1.734 1.00 0.00 C ATOM 97 O GLY A 7 6.935 -9.091 0.569 1.00 0.00 O ATOM 0 H GLY A 7 5.736 -7.503 4.119 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.185 -7.102 2.352 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.239 -8.401 2.874 1.00 0.00 H new ATOM 101 N LYS A 8 5.552 -9.798 2.180 1.00 0.00 N ATOM 102 CA LYS A 8 4.830 -10.702 1.296 1.00 0.00 C ATOM 103 C LYS A 8 3.474 -10.096 0.998 1.00 0.00 C ATOM 104 O LYS A 8 3.038 -9.190 1.703 1.00 0.00 O ATOM 105 CB LYS A 8 4.651 -12.098 1.921 1.00 0.00 C ATOM 106 CG LYS A 8 5.947 -12.876 2.161 1.00 0.00 C ATOM 107 CD LYS A 8 6.769 -12.276 3.290 1.00 0.00 C ATOM 108 CE LYS A 8 7.904 -13.187 3.733 1.00 0.00 C ATOM 109 NZ LYS A 8 8.907 -13.418 2.661 1.00 0.00 N ATOM 0 H LYS A 8 5.225 -9.798 3.146 1.00 0.00 H new ATOM 0 HA LYS A 8 5.408 -10.830 0.381 1.00 0.00 H new ATOM 0 HB2 LYS A 8 4.130 -11.988 2.872 1.00 0.00 H new ATOM 0 HB3 LYS A 8 4.006 -12.689 1.271 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.709 -13.913 2.397 1.00 0.00 H new ATOM 0 HG3 LYS A 8 6.539 -12.885 1.246 1.00 0.00 H new ATOM 0 HD2 LYS A 8 7.180 -11.320 2.967 1.00 0.00 H new ATOM 0 HD3 LYS A 8 6.118 -12.072 4.140 1.00 0.00 H new ATOM 0 HE2 LYS A 8 8.399 -12.748 4.599 1.00 0.00 H new ATOM 0 HE3 LYS A 8 7.492 -14.145 4.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 9.819 -13.677 3.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 8.583 -14.189 2.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 9.022 -12.550 2.100 1.00 0.00 H new ATOM 123 N PHE A 9 2.802 -10.582 -0.025 1.00 0.00 N ATOM 124 CA PHE A 9 1.511 -10.021 -0.393 1.00 0.00 C ATOM 125 C PHE A 9 0.538 -11.109 -0.811 1.00 0.00 C ATOM 126 O PHE A 9 0.937 -12.153 -1.331 1.00 0.00 O ATOM 127 CB PHE A 9 1.659 -8.972 -1.505 1.00 0.00 C ATOM 128 CG PHE A 9 2.158 -9.499 -2.824 1.00 0.00 C ATOM 129 CD1 PHE A 9 3.516 -9.640 -3.065 1.00 0.00 C ATOM 130 CD2 PHE A 9 1.266 -9.827 -3.833 1.00 0.00 C ATOM 131 CE1 PHE A 9 3.972 -10.102 -4.285 1.00 0.00 C ATOM 132 CE2 PHE A 9 1.717 -10.292 -5.053 1.00 0.00 C ATOM 133 CZ PHE A 9 3.071 -10.429 -5.280 1.00 0.00 C ATOM 0 H PHE A 9 3.119 -11.354 -0.612 1.00 0.00 H new ATOM 0 HA PHE A 9 1.106 -9.526 0.489 1.00 0.00 H new ATOM 0 HB2 PHE A 9 0.691 -8.497 -1.665 1.00 0.00 H new ATOM 0 HB3 PHE A 9 2.342 -8.195 -1.161 1.00 0.00 H new ATOM 0 HD1 PHE A 9 4.225 -9.386 -2.291 1.00 0.00 H new ATOM 0 HD2 PHE A 9 0.205 -9.718 -3.663 1.00 0.00 H new ATOM 0 HE1 PHE A 9 5.032 -10.207 -4.461 1.00 0.00 H new ATOM 0 HE2 PHE A 9 1.010 -10.548 -5.829 1.00 0.00 H new ATOM 0 HZ PHE A 9 3.426 -10.791 -6.234 1.00 0.00 H new ATOM 143 N ILE A 10 -0.737 -10.862 -0.565 1.00 0.00 N ATOM 144 CA ILE A 10 -1.778 -11.806 -0.922 1.00 0.00 C ATOM 145 C ILE A 10 -2.423 -11.411 -2.240 1.00 0.00 C ATOM 146 O ILE A 10 -2.560 -10.226 -2.547 1.00 0.00 O ATOM 147 CB ILE A 10 -2.858 -11.916 0.178 1.00 0.00 C ATOM 148 CG1 ILE A 10 -3.423 -10.533 0.528 1.00 0.00 C ATOM 149 CG2 ILE A 10 -2.283 -12.592 1.414 1.00 0.00 C ATOM 150 CD1 ILE A 10 -4.452 -10.558 1.640 1.00 0.00 C ATOM 0 H ILE A 10 -1.076 -10.011 -0.117 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.306 -12.783 -1.027 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.677 -12.527 -0.202 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.602 -9.878 0.820 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -3.875 -10.099 -0.364 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -3.054 -12.663 2.181 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.936 -13.592 1.154 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -1.446 -12.005 1.794 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -4.806 -9.545 1.831 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -5.292 -11.186 1.344 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -3.999 -10.961 2.546 1.00 0.00 H new ATOM 162 N ILE A 11 -2.806 -12.400 -3.025 1.00 0.00 N ATOM 163 CA ILE A 11 -3.413 -12.139 -4.315 1.00 0.00 C ATOM 164 C ILE A 11 -4.891 -11.828 -4.129 1.00 0.00 C ATOM 165 O ILE A 11 -5.719 -12.730 -4.016 1.00 0.00 O ATOM 166 CB ILE A 11 -3.249 -13.339 -5.283 1.00 0.00 C ATOM 167 CG1 ILE A 11 -1.768 -13.725 -5.421 1.00 0.00 C ATOM 168 CG2 ILE A 11 -3.847 -13.020 -6.652 1.00 0.00 C ATOM 169 CD1 ILE A 11 -0.897 -12.625 -5.983 1.00 0.00 C ATOM 0 H ILE A 11 -2.708 -13.388 -2.793 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.903 -11.283 -4.758 1.00 0.00 H new ATOM 0 HB ILE A 11 -3.790 -14.187 -4.864 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -1.385 -14.013 -4.442 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -1.690 -14.601 -6.065 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -3.720 -13.877 -7.313 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -4.909 -12.801 -6.543 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.340 -12.154 -7.078 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.133 -12.975 -6.050 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -1.252 -12.351 -6.977 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.943 -11.754 -5.329 1.00 0.00 H new ATOM 181 N ALA A 12 -5.201 -10.543 -4.062 1.00 0.00 N ATOM 182 CA ALA A 12 -6.571 -10.097 -3.904 1.00 0.00 C ATOM 183 C ALA A 12 -7.129 -9.592 -5.225 1.00 0.00 C ATOM 184 O ALA A 12 -8.246 -9.932 -5.598 1.00 0.00 O ATOM 185 CB ALA A 12 -6.647 -9.002 -2.857 1.00 0.00 C ATOM 0 H ALA A 12 -4.516 -9.789 -4.115 1.00 0.00 H new ATOM 0 HA ALA A 12 -7.172 -10.946 -3.577 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -7.681 -8.675 -2.747 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.284 -9.385 -1.903 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.031 -8.158 -3.167 1.00 0.00 H new ATOM 191 N THR A 13 -6.316 -8.785 -5.928 1.00 0.00 N ATOM 192 CA THR A 13 -6.698 -8.146 -7.196 1.00 0.00 C ATOM 193 C THR A 13 -7.975 -7.305 -7.033 1.00 0.00 C ATOM 194 O THR A 13 -8.487 -7.159 -5.923 1.00 0.00 O ATOM 195 CB THR A 13 -6.857 -9.180 -8.354 1.00 0.00 C ATOM 196 OG1 THR A 13 -7.951 -10.075 -8.119 1.00 0.00 O ATOM 197 CG2 THR A 13 -5.575 -9.984 -8.542 1.00 0.00 C ATOM 0 H THR A 13 -5.368 -8.557 -5.629 1.00 0.00 H new ATOM 0 HA THR A 13 -5.882 -7.478 -7.471 1.00 0.00 H new ATOM 0 HB THR A 13 -7.065 -8.613 -9.261 1.00 0.00 H new ATOM 0 HG1 THR A 13 -8.409 -9.821 -7.291 1.00 0.00 H new ATOM 0 HG21 THR A 13 -5.709 -10.698 -9.354 1.00 0.00 H new ATOM 0 HG22 THR A 13 -4.754 -9.309 -8.784 1.00 0.00 H new ATOM 0 HG23 THR A 13 -5.344 -10.520 -7.622 1.00 0.00 H new ATOM 343 N ARG A 23 -2.231 1.126 -8.275 1.00 0.00 N ATOM 344 CA ARG A 23 -2.175 0.984 -6.823 1.00 0.00 C ATOM 345 C ARG A 23 -2.878 -0.296 -6.372 1.00 0.00 C ATOM 346 O ARG A 23 -3.202 -0.459 -5.196 1.00 0.00 O ATOM 347 CB ARG A 23 -2.786 2.196 -6.093 1.00 0.00 C ATOM 348 CG ARG A 23 -2.575 3.537 -6.783 1.00 0.00 C ATOM 349 CD ARG A 23 -1.108 3.871 -6.993 1.00 0.00 C ATOM 350 NE ARG A 23 -0.959 4.960 -7.955 1.00 0.00 N ATOM 351 CZ ARG A 23 0.014 5.869 -7.928 1.00 0.00 C ATOM 352 NH1 ARG A 23 0.948 5.831 -6.982 1.00 0.00 N ATOM 353 NH2 ARG A 23 0.054 6.823 -8.851 1.00 0.00 N ATOM 0 HA ARG A 23 -1.119 0.929 -6.557 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -3.857 2.029 -5.977 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -2.361 2.249 -5.091 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -3.082 3.527 -7.748 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -3.039 4.323 -6.188 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -0.655 4.154 -6.043 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -0.576 2.989 -7.350 1.00 0.00 H new ATOM 0 HE ARG A 23 -1.650 5.029 -8.702 1.00 0.00 H new ATOM 0 HH11 ARG A 23 0.923 5.102 -6.269 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.690 6.531 -6.969 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -0.660 6.859 -9.579 1.00 0.00 H new ATOM 0 HH22 ARG A 23 0.798 7.520 -8.832 1.00 0.00 H new ATOM 367 N THR A 24 -3.097 -1.205 -7.308 1.00 0.00 N ATOM 368 CA THR A 24 -3.771 -2.455 -7.011 1.00 0.00 C ATOM 369 C THR A 24 -2.773 -3.554 -6.662 1.00 0.00 C ATOM 370 O THR A 24 -1.795 -3.760 -7.382 1.00 0.00 O ATOM 371 CB THR A 24 -4.629 -2.912 -8.204 1.00 0.00 C ATOM 372 OG1 THR A 24 -3.832 -2.922 -9.394 1.00 0.00 O ATOM 373 CG2 THR A 24 -5.830 -1.998 -8.399 1.00 0.00 C ATOM 0 H THR A 24 -2.816 -1.098 -8.283 1.00 0.00 H new ATOM 0 HA THR A 24 -4.415 -2.276 -6.150 1.00 0.00 H new ATOM 0 HB THR A 24 -4.996 -3.917 -7.997 1.00 0.00 H new ATOM 0 HG1 THR A 24 -2.933 -3.249 -9.183 1.00 0.00 H new ATOM 0 HG21 THR A 24 -6.418 -2.346 -9.249 1.00 0.00 H new ATOM 0 HG22 THR A 24 -6.448 -2.012 -7.501 1.00 0.00 H new ATOM 0 HG23 THR A 24 -5.486 -0.981 -8.587 1.00 0.00 H new ATOM 381 N VAL A 25 -3.043 -4.250 -5.560 1.00 0.00 N ATOM 382 CA VAL A 25 -2.236 -5.378 -5.105 1.00 0.00 C ATOM 383 C VAL A 25 -0.914 -4.907 -4.505 1.00 0.00 C ATOM 384 O VAL A 25 0.113 -4.855 -5.180 1.00 0.00 O ATOM 385 CB VAL A 25 -1.978 -6.418 -6.224 1.00 0.00 C ATOM 386 CG1 VAL A 25 -1.202 -7.611 -5.686 1.00 0.00 C ATOM 387 CG2 VAL A 25 -3.290 -6.882 -6.838 1.00 0.00 C ATOM 0 H VAL A 25 -3.836 -4.044 -4.952 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.817 -5.875 -4.328 1.00 0.00 H new ATOM 0 HB VAL A 25 -1.380 -5.937 -6.998 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -1.033 -8.328 -6.490 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -0.243 -7.274 -5.293 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.773 -8.088 -4.889 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.087 -7.612 -7.622 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -3.910 -7.340 -6.068 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.814 -6.027 -7.265 1.00 0.00 H new ATOM 397 N ILE A 26 -0.968 -4.525 -3.237 1.00 0.00 N ATOM 398 CA ILE A 26 0.222 -4.138 -2.497 1.00 0.00 C ATOM 399 C ILE A 26 0.540 -5.252 -1.489 1.00 0.00 C ATOM 400 O ILE A 26 -0.032 -6.337 -1.579 1.00 0.00 O ATOM 401 CB ILE A 26 0.023 -2.754 -1.810 1.00 0.00 C ATOM 402 CG1 ILE A 26 -0.636 -1.771 -2.785 1.00 0.00 C ATOM 403 CG2 ILE A 26 1.348 -2.164 -1.337 1.00 0.00 C ATOM 404 CD1 ILE A 26 0.205 -1.472 -4.014 1.00 0.00 C ATOM 0 H ILE A 26 -1.832 -4.475 -2.697 1.00 0.00 H new ATOM 0 HA ILE A 26 1.070 -4.020 -3.172 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.618 -2.912 -0.943 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -1.596 -2.177 -3.103 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.843 -0.838 -2.261 1.00 0.00 H new ATOM 0 HG21 ILE A 26 1.168 -1.199 -0.863 1.00 0.00 H new ATOM 0 HG22 ILE A 26 1.812 -2.840 -0.619 1.00 0.00 H new ATOM 0 HG23 ILE A 26 2.012 -2.031 -2.191 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -0.326 -0.770 -4.656 1.00 0.00 H new ATOM 0 HD12 ILE A 26 1.155 -1.035 -3.707 1.00 0.00 H new ATOM 0 HD13 ILE A 26 0.390 -2.396 -4.562 1.00 0.00 H new ATOM 416 N TYR A 27 1.417 -5.005 -0.531 1.00 0.00 N ATOM 417 CA TYR A 27 1.958 -6.078 0.284 1.00 0.00 C ATOM 418 C TYR A 27 1.535 -5.946 1.741 1.00 0.00 C ATOM 419 O TYR A 27 0.884 -4.974 2.133 1.00 0.00 O ATOM 420 CB TYR A 27 3.492 -6.098 0.185 1.00 0.00 C ATOM 421 CG TYR A 27 4.175 -4.941 0.893 1.00 0.00 C ATOM 422 CD1 TYR A 27 4.040 -3.637 0.434 1.00 0.00 C ATOM 423 CD2 TYR A 27 4.952 -5.156 2.026 1.00 0.00 C ATOM 424 CE1 TYR A 27 4.654 -2.583 1.082 1.00 0.00 C ATOM 425 CE2 TYR A 27 5.571 -4.107 2.678 1.00 0.00 C ATOM 426 CZ TYR A 27 5.417 -2.824 2.203 1.00 0.00 C ATOM 427 OH TYR A 27 6.028 -1.775 2.853 1.00 0.00 O ATOM 0 H TYR A 27 1.768 -4.076 -0.300 1.00 0.00 H new ATOM 0 HA TYR A 27 1.557 -7.017 -0.098 1.00 0.00 H new ATOM 0 HB2 TYR A 27 3.860 -7.034 0.604 1.00 0.00 H new ATOM 0 HB3 TYR A 27 3.778 -6.086 -0.867 1.00 0.00 H new ATOM 0 HD1 TYR A 27 3.444 -3.444 -0.446 1.00 0.00 H new ATOM 0 HD2 TYR A 27 5.074 -6.161 2.403 1.00 0.00 H new ATOM 0 HE1 TYR A 27 4.536 -1.575 0.712 1.00 0.00 H new ATOM 0 HE2 TYR A 27 6.172 -4.292 3.556 1.00 0.00 H new ATOM 0 HH TYR A 27 5.498 -1.523 3.638 1.00 0.00 H new ATOM 437 N ILE A 28 1.908 -6.944 2.527 1.00 0.00 N ATOM 438 CA ILE A 28 1.686 -6.932 3.959 1.00 0.00 C ATOM 439 C ILE A 28 2.838 -6.215 4.641 1.00 0.00 C ATOM 440 O ILE A 28 3.971 -6.707 4.638 1.00 0.00 O ATOM 441 CB ILE A 28 1.578 -8.364 4.529 1.00 0.00 C ATOM 442 CG1 ILE A 28 0.447 -9.129 3.837 1.00 0.00 C ATOM 443 CG2 ILE A 28 1.357 -8.331 6.037 1.00 0.00 C ATOM 444 CD1 ILE A 28 -0.908 -8.462 3.954 1.00 0.00 C ATOM 0 H ILE A 28 2.374 -7.785 2.186 1.00 0.00 H new ATOM 0 HA ILE A 28 0.746 -6.415 4.149 1.00 0.00 H new ATOM 0 HB ILE A 28 2.517 -8.882 4.335 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.693 -9.246 2.782 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.386 -10.131 4.263 1.00 0.00 H new ATOM 0 HG21 ILE A 28 1.284 -9.350 6.416 1.00 0.00 H new ATOM 0 HG22 ILE A 28 2.195 -7.824 6.516 1.00 0.00 H new ATOM 0 HG23 ILE A 28 0.434 -7.795 6.258 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.656 -9.065 3.439 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -1.178 -8.370 5.006 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -0.866 -7.471 3.502 1.00 0.00 H new ATOM 456 N CYS A 29 2.543 -5.061 5.215 1.00 0.00 N ATOM 457 CA CYS A 29 3.560 -4.230 5.840 1.00 0.00 C ATOM 458 C CYS A 29 4.195 -4.962 7.014 1.00 0.00 C ATOM 459 O CYS A 29 5.411 -5.141 7.063 1.00 0.00 O ATOM 460 CB CYS A 29 2.947 -2.907 6.308 1.00 0.00 C ATOM 461 SG CYS A 29 2.065 -2.005 5.007 1.00 0.00 S ATOM 0 H CYS A 29 1.600 -4.675 5.261 1.00 0.00 H new ATOM 0 HA CYS A 29 4.336 -4.016 5.105 1.00 0.00 H new ATOM 0 HB2 CYS A 29 2.258 -3.107 7.129 1.00 0.00 H new ATOM 0 HB3 CYS A 29 3.739 -2.271 6.704 1.00 0.00 H new ATOM 0 HG CYS A 29 1.580 -0.902 5.496 1.00 0.00 H new ATOM 467 N GLU A 30 3.362 -5.403 7.947 1.00 0.00 N ATOM 468 CA GLU A 30 3.845 -6.109 9.121 1.00 0.00 C ATOM 469 C GLU A 30 2.889 -7.207 9.554 1.00 0.00 C ATOM 470 O GLU A 30 1.696 -6.973 9.722 1.00 0.00 O ATOM 471 CB GLU A 30 4.023 -5.155 10.306 1.00 0.00 C ATOM 472 CG GLU A 30 5.142 -4.142 10.152 1.00 0.00 C ATOM 473 CD GLU A 30 5.318 -3.303 11.401 1.00 0.00 C ATOM 474 OE1 GLU A 30 4.631 -2.269 11.528 1.00 0.00 O ATOM 475 OE2 GLU A 30 6.139 -3.679 12.269 1.00 0.00 O ATOM 0 H GLU A 30 2.350 -5.283 7.912 1.00 0.00 H new ATOM 0 HA GLU A 30 4.802 -6.546 8.837 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.087 -4.619 10.465 1.00 0.00 H new ATOM 0 HB3 GLU A 30 4.209 -5.745 11.203 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.074 -4.661 9.929 1.00 0.00 H new ATOM 0 HG3 GLU A 30 4.929 -3.491 9.304 1.00 0.00 H new ATOM 482 N HIS A 31 3.410 -8.409 9.713 1.00 0.00 N ATOM 483 CA HIS A 31 2.751 -9.397 10.542 1.00 0.00 C ATOM 484 C HIS A 31 3.608 -9.540 11.781 1.00 0.00 C ATOM 485 O HIS A 31 4.616 -10.246 11.780 1.00 0.00 O ATOM 486 CB HIS A 31 2.602 -10.740 9.818 1.00 0.00 C ATOM 487 CG HIS A 31 1.821 -11.781 10.581 1.00 0.00 C ATOM 488 ND1 HIS A 31 2.326 -12.467 11.665 1.00 0.00 N ATOM 489 CD2 HIS A 31 0.569 -12.266 10.388 1.00 0.00 C ATOM 490 CE1 HIS A 31 1.419 -13.326 12.102 1.00 0.00 C ATOM 491 NE2 HIS A 31 0.345 -13.228 11.345 1.00 0.00 N ATOM 0 H HIS A 31 4.280 -8.722 9.283 1.00 0.00 H new ATOM 0 HA HIS A 31 1.738 -9.081 10.790 1.00 0.00 H new ATOM 0 HB2 HIS A 31 2.113 -10.569 8.859 1.00 0.00 H new ATOM 0 HB3 HIS A 31 3.595 -11.135 9.604 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -0.126 -11.954 9.622 1.00 0.00 H new ATOM 0 HE1 HIS A 31 1.539 -13.996 12.940 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -0.510 -13.774 11.451 1.00 0.00 H new ATOM 500 N ASN A 32 3.187 -8.882 12.837 1.00 0.00 N ATOM 501 CA ASN A 32 4.032 -8.680 14.005 1.00 0.00 C ATOM 502 C ASN A 32 3.480 -9.461 15.183 1.00 0.00 C ATOM 503 O ASN A 32 3.121 -8.890 16.213 1.00 0.00 O ATOM 504 CB ASN A 32 4.117 -7.182 14.328 1.00 0.00 C ATOM 505 CG ASN A 32 5.286 -6.829 15.234 1.00 0.00 C ATOM 506 OD1 ASN A 32 5.699 -7.615 16.085 1.00 0.00 O ATOM 507 ND2 ASN A 32 5.838 -5.639 15.044 1.00 0.00 N ATOM 0 H ASN A 32 2.256 -8.472 12.916 1.00 0.00 H new ATOM 0 HA ASN A 32 5.038 -9.045 13.796 1.00 0.00 H new ATOM 0 HB2 ASN A 32 4.205 -6.621 13.398 1.00 0.00 H new ATOM 0 HB3 ASN A 32 3.189 -6.867 14.804 1.00 0.00 H new ATOM 0 HD21 ASN A 32 6.633 -5.349 15.614 1.00 0.00 H new ATOM 0 HD22 ASN A 32 5.468 -5.014 14.328 1.00 0.00 H new ATOM 514 N ASP A 33 3.401 -10.775 14.986 1.00 0.00 N ATOM 515 CA ASP A 33 2.872 -11.718 15.975 1.00 0.00 C ATOM 516 C ASP A 33 1.398 -11.460 16.279 1.00 0.00 C ATOM 517 O ASP A 33 0.548 -12.278 15.951 1.00 0.00 O ATOM 518 CB ASP A 33 3.688 -11.697 17.267 1.00 0.00 C ATOM 519 CG ASP A 33 3.246 -12.788 18.224 1.00 0.00 C ATOM 520 OD1 ASP A 33 3.719 -13.936 18.083 1.00 0.00 O ATOM 521 OD2 ASP A 33 2.406 -12.513 19.103 1.00 0.00 O ATOM 0 H ASP A 33 3.707 -11.224 14.123 1.00 0.00 H new ATOM 0 HA ASP A 33 2.956 -12.710 15.531 1.00 0.00 H new ATOM 0 HB2 ASP A 33 4.745 -11.824 17.033 1.00 0.00 H new ATOM 0 HB3 ASP A 33 3.583 -10.725 17.749 1.00 0.00 H new ATOM 526 N ASN A 34 1.107 -10.324 16.895 1.00 0.00 N ATOM 527 CA ASN A 34 -0.255 -9.976 17.280 1.00 0.00 C ATOM 528 C ASN A 34 -0.948 -9.183 16.183 1.00 0.00 C ATOM 529 O ASN A 34 -2.131 -9.383 15.911 1.00 0.00 O ATOM 530 CB ASN A 34 -0.256 -9.152 18.573 1.00 0.00 C ATOM 531 CG ASN A 34 0.239 -9.937 19.770 1.00 0.00 C ATOM 532 OD1 ASN A 34 -0.541 -10.606 20.450 1.00 0.00 O ATOM 533 ND2 ASN A 34 1.530 -9.846 20.053 1.00 0.00 N ATOM 0 H ASN A 34 1.803 -9.620 17.142 1.00 0.00 H new ATOM 0 HA ASN A 34 -0.798 -10.907 17.441 1.00 0.00 H new ATOM 0 HB2 ASN A 34 0.371 -8.271 18.437 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -1.267 -8.796 18.771 1.00 0.00 H new ATOM 0 HD21 ASN A 34 1.911 -10.341 20.859 1.00 0.00 H new ATOM 0 HD22 ASN A 34 2.143 -9.281 19.464 1.00 0.00 H new ATOM 540 N GLY A 35 -0.211 -8.286 15.551 1.00 0.00 N ATOM 541 CA GLY A 35 -0.807 -7.414 14.561 1.00 0.00 C ATOM 542 C GLY A 35 -0.499 -7.837 13.144 1.00 0.00 C ATOM 543 O GLY A 35 0.569 -8.383 12.866 1.00 0.00 O ATOM 0 H GLY A 35 0.788 -8.145 15.704 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -1.888 -7.397 14.703 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.448 -6.397 14.717 1.00 0.00 H new ATOM 547 N THR A 36 -1.438 -7.588 12.252 1.00 0.00 N ATOM 548 CA THR A 36 -1.258 -7.872 10.843 1.00 0.00 C ATOM 549 C THR A 36 -1.722 -6.675 10.025 1.00 0.00 C ATOM 550 O THR A 36 -2.919 -6.457 9.855 1.00 0.00 O ATOM 551 CB THR A 36 -2.043 -9.128 10.416 1.00 0.00 C ATOM 552 OG1 THR A 36 -1.734 -10.222 11.293 1.00 0.00 O ATOM 553 CG2 THR A 36 -1.706 -9.512 8.980 1.00 0.00 C ATOM 0 H THR A 36 -2.345 -7.184 12.484 1.00 0.00 H new ATOM 0 HA THR A 36 -0.199 -8.061 10.664 1.00 0.00 H new ATOM 0 HB THR A 36 -3.108 -8.904 10.477 1.00 0.00 H new ATOM 0 HG1 THR A 36 -2.238 -11.016 11.016 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.271 -10.401 8.699 1.00 0.00 H new ATOM 0 HG22 THR A 36 -1.967 -8.690 8.313 1.00 0.00 H new ATOM 0 HG23 THR A 36 -0.639 -9.720 8.900 1.00 0.00 H new ATOM 561 N ILE A 37 -0.769 -5.896 9.537 1.00 0.00 N ATOM 562 CA ILE A 37 -1.072 -4.659 8.836 1.00 0.00 C ATOM 563 C ILE A 37 -0.728 -4.791 7.356 1.00 0.00 C ATOM 564 O ILE A 37 0.416 -5.081 7.004 1.00 0.00 O ATOM 565 CB ILE A 37 -0.293 -3.452 9.427 1.00 0.00 C ATOM 566 CG1 ILE A 37 -0.649 -3.224 10.905 1.00 0.00 C ATOM 567 CG2 ILE A 37 -0.568 -2.185 8.623 1.00 0.00 C ATOM 568 CD1 ILE A 37 0.099 -4.122 11.872 1.00 0.00 C ATOM 0 H ILE A 37 0.227 -6.101 9.615 1.00 0.00 H new ATOM 0 HA ILE A 37 -2.139 -4.476 8.959 1.00 0.00 H new ATOM 0 HB ILE A 37 0.770 -3.687 9.364 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.444 -2.184 11.160 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.720 -3.379 11.037 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.012 -1.352 9.055 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.254 -2.334 7.590 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.635 -1.962 8.649 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.211 -3.896 12.892 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.125 -5.165 11.647 1.00 0.00 H new ATOM 0 HD13 ILE A 37 1.171 -3.951 11.772 1.00 0.00 H new ATOM 580 N GLY A 38 -1.718 -4.590 6.498 1.00 0.00 N ATOM 581 CA GLY A 38 -1.480 -4.623 5.068 1.00 0.00 C ATOM 582 C GLY A 38 -2.437 -3.724 4.315 1.00 0.00 C ATOM 583 O GLY A 38 -3.472 -3.323 4.852 1.00 0.00 O ATOM 0 H GLY A 38 -2.684 -4.404 6.767 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -0.455 -4.314 4.863 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -1.583 -5.646 4.707 1.00 0.00 H new ATOM 587 N VAL A 39 -2.094 -3.399 3.077 1.00 0.00 N ATOM 588 CA VAL A 39 -2.944 -2.559 2.240 1.00 0.00 C ATOM 589 C VAL A 39 -3.237 -3.260 0.913 1.00 0.00 C ATOM 590 O VAL A 39 -2.475 -3.156 -0.045 1.00 0.00 O ATOM 591 CB VAL A 39 -2.310 -1.164 1.994 1.00 0.00 C ATOM 592 CG1 VAL A 39 -2.423 -0.304 3.245 1.00 0.00 C ATOM 593 CG2 VAL A 39 -0.848 -1.287 1.568 1.00 0.00 C ATOM 0 H VAL A 39 -1.231 -3.704 2.627 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.882 -2.400 2.771 1.00 0.00 H new ATOM 0 HB VAL A 39 -2.858 -0.685 1.183 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.974 0.671 3.058 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.474 -0.176 3.505 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -1.902 -0.791 4.069 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.432 -0.293 1.403 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.282 -1.792 2.351 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -0.785 -1.864 0.645 1.00 0.00 H new ATOM 603 N ILE A 40 -4.331 -4.014 0.869 1.00 0.00 N ATOM 604 CA ILE A 40 -4.621 -4.848 -0.296 1.00 0.00 C ATOM 605 C ILE A 40 -6.086 -4.764 -0.731 1.00 0.00 C ATOM 606 O ILE A 40 -6.551 -5.601 -1.503 1.00 0.00 O ATOM 607 CB ILE A 40 -4.266 -6.342 -0.055 1.00 0.00 C ATOM 608 CG1 ILE A 40 -5.115 -6.957 1.076 1.00 0.00 C ATOM 609 CG2 ILE A 40 -2.779 -6.504 0.235 1.00 0.00 C ATOM 610 CD1 ILE A 40 -4.707 -6.552 2.480 1.00 0.00 C ATOM 0 H ILE A 40 -5.024 -4.066 1.615 1.00 0.00 H new ATOM 0 HA ILE A 40 -3.990 -4.449 -1.090 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.501 -6.885 -0.970 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -6.157 -6.675 0.922 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.064 -8.043 0.998 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.553 -7.557 0.400 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.201 -6.138 -0.613 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.518 -5.933 1.126 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -5.363 -7.036 3.203 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.677 -6.859 2.662 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -4.787 -5.470 2.584 1.00 0.00 H new ATOM 622 N ILE A 41 -6.809 -3.751 -0.263 1.00 0.00 N ATOM 623 CA ILE A 41 -8.221 -3.617 -0.624 1.00 0.00 C ATOM 624 C ILE A 41 -8.382 -2.979 -2.005 1.00 0.00 C ATOM 625 O ILE A 41 -9.429 -3.120 -2.643 1.00 0.00 O ATOM 626 CB ILE A 41 -9.033 -2.829 0.425 1.00 0.00 C ATOM 627 CG1 ILE A 41 -8.416 -1.455 0.691 1.00 0.00 C ATOM 628 CG2 ILE A 41 -9.141 -3.631 1.716 1.00 0.00 C ATOM 629 CD1 ILE A 41 -9.207 -0.630 1.684 1.00 0.00 C ATOM 0 H ILE A 41 -6.452 -3.023 0.355 1.00 0.00 H new ATOM 0 HA ILE A 41 -8.624 -4.629 -0.653 1.00 0.00 H new ATOM 0 HB ILE A 41 -10.035 -2.667 0.027 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -7.400 -1.586 1.064 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -8.342 -0.908 -0.249 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -9.716 -3.065 2.449 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -9.641 -4.578 1.515 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -8.143 -3.824 2.109 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -8.717 0.333 1.829 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -10.216 -0.470 1.303 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.259 -1.158 2.636 1.00 0.00 H new ATOM 641 N ASN A 42 -7.338 -2.274 -2.452 1.00 0.00 N ATOM 642 CA ASN A 42 -7.224 -1.818 -3.846 1.00 0.00 C ATOM 643 C ASN A 42 -8.360 -0.877 -4.251 1.00 0.00 C ATOM 644 O ASN A 42 -8.956 -1.046 -5.316 1.00 0.00 O ATOM 645 CB ASN A 42 -7.222 -3.028 -4.791 1.00 0.00 C ATOM 646 CG ASN A 42 -6.192 -4.071 -4.409 1.00 0.00 C ATOM 647 OD1 ASN A 42 -5.120 -3.746 -3.907 1.00 0.00 O ATOM 648 ND2 ASN A 42 -6.513 -5.337 -4.632 1.00 0.00 N ATOM 0 H ASN A 42 -6.550 -2.003 -1.863 1.00 0.00 H new ATOM 0 HA ASN A 42 -6.287 -1.266 -3.923 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.212 -3.485 -4.791 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -7.028 -2.688 -5.808 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -5.860 -6.080 -4.384 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -7.414 -5.569 -5.051 1.00 0.00 H new ATOM 655 N THR A 43 -8.656 0.123 -3.434 1.00 0.00 N ATOM 656 CA THR A 43 -9.759 1.022 -3.740 1.00 0.00 C ATOM 657 C THR A 43 -9.466 2.448 -3.267 1.00 0.00 C ATOM 658 O THR A 43 -8.972 2.660 -2.155 1.00 0.00 O ATOM 659 CB THR A 43 -11.089 0.507 -3.134 1.00 0.00 C ATOM 660 OG1 THR A 43 -12.187 1.293 -3.608 1.00 0.00 O ATOM 661 CG2 THR A 43 -11.063 0.528 -1.611 1.00 0.00 C ATOM 0 H THR A 43 -8.158 0.331 -2.569 1.00 0.00 H new ATOM 0 HA THR A 43 -9.867 1.044 -4.824 1.00 0.00 H new ATOM 0 HB THR A 43 -11.214 -0.527 -3.455 1.00 0.00 H new ATOM 0 HG1 THR A 43 -13.022 0.957 -3.220 1.00 0.00 H new ATOM 0 HG21 THR A 43 -12.014 0.160 -1.226 1.00 0.00 H new ATOM 0 HG22 THR A 43 -10.255 -0.109 -1.252 1.00 0.00 H new ATOM 0 HG23 THR A 43 -10.902 1.549 -1.264 1.00 0.00 H new ATOM 669 N PRO A 44 -9.731 3.443 -4.131 1.00 0.00 N ATOM 670 CA PRO A 44 -9.516 4.856 -3.810 1.00 0.00 C ATOM 671 C PRO A 44 -10.567 5.399 -2.843 1.00 0.00 C ATOM 672 O PRO A 44 -11.601 4.770 -2.615 1.00 0.00 O ATOM 673 CB PRO A 44 -9.635 5.548 -5.169 1.00 0.00 C ATOM 674 CG PRO A 44 -10.534 4.667 -5.963 1.00 0.00 C ATOM 675 CD PRO A 44 -10.255 3.262 -5.501 1.00 0.00 C ATOM 0 HA PRO A 44 -8.560 5.020 -3.313 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -10.051 6.551 -5.068 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -8.661 5.654 -5.646 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -11.579 4.930 -5.802 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -10.340 4.772 -7.030 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -11.158 2.651 -5.507 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -9.530 2.765 -6.145 1.00 0.00 H new ATOM 683 N THR A 45 -10.296 6.559 -2.265 1.00 0.00 N ATOM 684 CA THR A 45 -11.259 7.207 -1.388 1.00 0.00 C ATOM 685 C THR A 45 -12.004 8.300 -2.147 1.00 0.00 C ATOM 686 O THR A 45 -11.958 8.362 -3.377 1.00 0.00 O ATOM 687 CB THR A 45 -10.582 7.849 -0.156 1.00 0.00 C ATOM 688 OG1 THR A 45 -9.807 8.980 -0.556 1.00 0.00 O ATOM 689 CG2 THR A 45 -9.681 6.869 0.569 1.00 0.00 C ATOM 0 H THR A 45 -9.421 7.069 -2.386 1.00 0.00 H new ATOM 0 HA THR A 45 -11.947 6.434 -1.047 1.00 0.00 H new ATOM 0 HB THR A 45 -11.376 8.156 0.525 1.00 0.00 H new ATOM 0 HG1 THR A 45 -9.234 8.733 -1.312 1.00 0.00 H new ATOM 0 HG21 THR A 45 -9.225 7.361 1.428 1.00 0.00 H new ATOM 0 HG22 THR A 45 -10.269 6.017 0.909 1.00 0.00 H new ATOM 0 HG23 THR A 45 -8.900 6.524 -0.108 1.00 0.00 H new ATOM 697 N ASP A 46 -12.698 9.150 -1.409 1.00 0.00 N ATOM 698 CA ASP A 46 -13.302 10.342 -1.983 1.00 0.00 C ATOM 699 C ASP A 46 -12.514 11.563 -1.524 1.00 0.00 C ATOM 700 O ASP A 46 -12.933 12.708 -1.692 1.00 0.00 O ATOM 701 CB ASP A 46 -14.768 10.460 -1.561 1.00 0.00 C ATOM 702 CG ASP A 46 -15.537 11.428 -2.435 1.00 0.00 C ATOM 703 OD1 ASP A 46 -15.780 11.093 -3.613 1.00 0.00 O ATOM 704 OD2 ASP A 46 -15.897 12.526 -1.960 1.00 0.00 O ATOM 0 H ASP A 46 -12.858 9.037 -0.408 1.00 0.00 H new ATOM 0 HA ASP A 46 -13.273 10.276 -3.071 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -15.238 9.478 -1.608 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -14.821 10.789 -0.523 1.00 0.00 H new ATOM 709 N LEU A 47 -11.351 11.295 -0.952 1.00 0.00 N ATOM 710 CA LEU A 47 -10.515 12.331 -0.374 1.00 0.00 C ATOM 711 C LEU A 47 -9.263 12.539 -1.214 1.00 0.00 C ATOM 712 O LEU A 47 -8.734 11.598 -1.814 1.00 0.00 O ATOM 713 CB LEU A 47 -10.129 11.945 1.058 1.00 0.00 C ATOM 714 CG LEU A 47 -9.330 12.988 1.837 1.00 0.00 C ATOM 715 CD1 LEU A 47 -10.201 14.193 2.146 1.00 0.00 C ATOM 716 CD2 LEU A 47 -8.770 12.382 3.116 1.00 0.00 C ATOM 0 H LEU A 47 -10.962 10.355 -0.876 1.00 0.00 H new ATOM 0 HA LEU A 47 -11.077 13.265 -0.356 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -11.041 11.725 1.613 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -9.548 11.023 1.021 1.00 0.00 H new ATOM 0 HG LEU A 47 -8.492 13.319 1.223 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -9.620 14.929 2.701 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -10.553 14.636 1.214 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -11.057 13.880 2.744 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -8.203 13.138 3.659 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -9.590 12.026 3.739 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -8.115 11.547 2.867 1.00 0.00 H new ATOM 728 N SER A 48 -8.796 13.771 -1.256 1.00 0.00 N ATOM 729 CA SER A 48 -7.579 14.099 -1.974 1.00 0.00 C ATOM 730 C SER A 48 -6.401 14.105 -1.010 1.00 0.00 C ATOM 731 O SER A 48 -6.564 14.419 0.170 1.00 0.00 O ATOM 732 CB SER A 48 -7.719 15.467 -2.642 1.00 0.00 C ATOM 733 OG SER A 48 -8.878 15.518 -3.453 1.00 0.00 O ATOM 0 H SER A 48 -9.243 14.566 -0.799 1.00 0.00 H new ATOM 0 HA SER A 48 -7.404 13.349 -2.745 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.769 16.245 -1.880 1.00 0.00 H new ATOM 0 HB3 SER A 48 -6.837 15.672 -3.249 1.00 0.00 H new ATOM 0 HG SER A 48 -8.650 15.900 -4.326 1.00 0.00 H new ATOM 739 N VAL A 49 -5.216 13.762 -1.501 1.00 0.00 N ATOM 740 CA VAL A 49 -4.023 13.775 -0.662 1.00 0.00 C ATOM 741 C VAL A 49 -3.724 15.202 -0.200 1.00 0.00 C ATOM 742 O VAL A 49 -3.210 15.424 0.892 1.00 0.00 O ATOM 743 CB VAL A 49 -2.793 13.181 -1.394 1.00 0.00 C ATOM 744 CG1 VAL A 49 -2.408 14.007 -2.613 1.00 0.00 C ATOM 745 CG2 VAL A 49 -1.612 13.041 -0.442 1.00 0.00 C ATOM 0 H VAL A 49 -5.056 13.474 -2.466 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.222 13.146 0.205 1.00 0.00 H new ATOM 0 HB VAL A 49 -3.072 12.188 -1.747 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -1.542 13.558 -3.098 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -3.243 14.033 -3.313 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.163 15.023 -2.302 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -0.760 12.622 -0.978 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -1.345 14.021 -0.046 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -1.884 12.379 0.380 1.00 0.00 H new ATOM 755 N LEU A 50 -4.090 16.168 -1.034 1.00 0.00 N ATOM 756 CA LEU A 50 -3.910 17.576 -0.708 1.00 0.00 C ATOM 757 C LEU A 50 -4.952 18.022 0.313 1.00 0.00 C ATOM 758 O LEU A 50 -4.717 18.941 1.091 1.00 0.00 O ATOM 759 CB LEU A 50 -4.021 18.433 -1.973 1.00 0.00 C ATOM 760 CG LEU A 50 -3.029 18.093 -3.088 1.00 0.00 C ATOM 761 CD1 LEU A 50 -3.270 18.975 -4.303 1.00 0.00 C ATOM 762 CD2 LEU A 50 -1.595 18.240 -2.599 1.00 0.00 C ATOM 0 H LEU A 50 -4.515 16.000 -1.946 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.917 17.706 -0.278 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.032 18.337 -2.368 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.885 19.478 -1.696 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.186 17.054 -3.378 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -2.556 18.719 -5.086 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.284 18.818 -4.671 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -3.144 20.021 -4.024 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -0.908 17.993 -3.408 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.424 19.267 -2.278 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.426 17.565 -1.760 1.00 0.00 H new ATOM 774 N GLU A 51 -6.093 17.339 0.312 1.00 0.00 N ATOM 775 CA GLU A 51 -7.216 17.694 1.173 1.00 0.00 C ATOM 776 C GLU A 51 -6.872 17.420 2.636 1.00 0.00 C ATOM 777 O GLU A 51 -7.191 18.211 3.526 1.00 0.00 O ATOM 778 CB GLU A 51 -8.449 16.889 0.753 1.00 0.00 C ATOM 779 CG GLU A 51 -9.725 17.706 0.622 1.00 0.00 C ATOM 780 CD GLU A 51 -10.244 18.213 1.949 1.00 0.00 C ATOM 781 OE1 GLU A 51 -10.694 17.387 2.771 1.00 0.00 O ATOM 782 OE2 GLU A 51 -10.234 19.441 2.164 1.00 0.00 O ATOM 0 H GLU A 51 -6.265 16.528 -0.282 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.429 18.758 1.068 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -8.243 16.406 -0.202 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -8.614 16.096 1.482 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -9.540 18.554 -0.037 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -10.493 17.095 0.148 1.00 0.00 H new ATOM 789 N LEU A 52 -6.203 16.299 2.880 1.00 0.00 N ATOM 790 CA LEU A 52 -5.768 15.962 4.228 1.00 0.00 C ATOM 791 C LEU A 52 -4.620 16.874 4.651 1.00 0.00 C ATOM 792 O LEU A 52 -4.468 17.199 5.832 1.00 0.00 O ATOM 793 CB LEU A 52 -5.369 14.480 4.312 1.00 0.00 C ATOM 794 CG LEU A 52 -4.182 14.047 3.441 1.00 0.00 C ATOM 795 CD1 LEU A 52 -2.875 14.139 4.213 1.00 0.00 C ATOM 796 CD2 LEU A 52 -4.392 12.638 2.916 1.00 0.00 C ATOM 0 H LEU A 52 -5.952 15.614 2.168 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.597 16.119 4.918 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.135 14.247 5.351 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.234 13.876 4.037 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.121 14.728 2.592 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.051 13.826 3.572 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -2.714 15.168 4.535 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.922 13.489 5.087 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -3.540 12.348 2.301 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.486 11.948 3.754 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.301 12.605 2.316 1.00 0.00 H new ATOM 808 N LEU A 53 -3.829 17.303 3.673 1.00 0.00 N ATOM 809 CA LEU A 53 -2.741 18.237 3.924 1.00 0.00 C ATOM 810 C LEU A 53 -3.294 19.590 4.357 1.00 0.00 C ATOM 811 O LEU A 53 -2.857 20.157 5.354 1.00 0.00 O ATOM 812 CB LEU A 53 -1.864 18.401 2.680 1.00 0.00 C ATOM 813 CG LEU A 53 -1.093 17.151 2.249 1.00 0.00 C ATOM 814 CD1 LEU A 53 -0.287 17.432 0.991 1.00 0.00 C ATOM 815 CD2 LEU A 53 -0.181 16.671 3.367 1.00 0.00 C ATOM 0 H LEU A 53 -3.923 17.017 2.698 1.00 0.00 H new ATOM 0 HA LEU A 53 -2.125 17.832 4.727 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.495 18.721 1.851 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.149 19.203 2.864 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.813 16.362 2.031 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.255 16.533 0.698 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.960 17.728 0.186 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.422 18.236 1.185 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.358 15.782 3.040 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.532 17.456 3.617 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.779 16.431 4.246 1.00 0.00 H new ATOM 827 N THR A 54 -4.272 20.095 3.612 1.00 0.00 N ATOM 828 CA THR A 54 -4.901 21.367 3.943 1.00 0.00 C ATOM 829 C THR A 54 -5.566 21.313 5.315 1.00 0.00 C ATOM 830 O THR A 54 -5.652 22.325 6.012 1.00 0.00 O ATOM 831 CB THR A 54 -5.936 21.787 2.881 1.00 0.00 C ATOM 832 OG1 THR A 54 -6.734 20.665 2.480 1.00 0.00 O ATOM 833 CG2 THR A 54 -5.246 22.386 1.668 1.00 0.00 C ATOM 0 H THR A 54 -4.645 19.643 2.777 1.00 0.00 H new ATOM 0 HA THR A 54 -4.107 22.114 3.963 1.00 0.00 H new ATOM 0 HB THR A 54 -6.586 22.541 3.325 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.737 19.994 3.194 1.00 0.00 H new ATOM 0 HG21 THR A 54 -5.994 22.676 0.930 1.00 0.00 H new ATOM 0 HG22 THR A 54 -4.675 23.264 1.971 1.00 0.00 H new ATOM 0 HG23 THR A 54 -4.573 21.648 1.231 1.00 0.00 H new ATOM 841 N ARG A 55 -6.030 20.126 5.696 1.00 0.00 N ATOM 842 CA ARG A 55 -6.670 19.934 6.990 1.00 0.00 C ATOM 843 C ARG A 55 -5.645 19.979 8.125 1.00 0.00 C ATOM 844 O ARG A 55 -5.812 20.729 9.088 1.00 0.00 O ATOM 845 CB ARG A 55 -7.436 18.610 7.020 1.00 0.00 C ATOM 846 CG ARG A 55 -8.115 18.330 8.353 1.00 0.00 C ATOM 847 CD ARG A 55 -8.945 17.058 8.303 1.00 0.00 C ATOM 848 NE ARG A 55 -9.544 16.745 9.600 1.00 0.00 N ATOM 849 CZ ARG A 55 -10.848 16.559 9.797 1.00 0.00 C ATOM 850 NH1 ARG A 55 -11.711 16.722 8.801 1.00 0.00 N ATOM 851 NH2 ARG A 55 -11.286 16.233 11.006 1.00 0.00 N ATOM 0 H ARG A 55 -5.974 19.283 5.125 1.00 0.00 H new ATOM 0 HA ARG A 55 -7.376 20.751 7.137 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -8.189 18.618 6.232 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -6.747 17.796 6.794 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -7.360 18.242 9.135 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -8.754 19.172 8.620 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -9.732 17.167 7.557 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -8.316 16.227 7.984 1.00 0.00 H new ATOM 0 HE ARG A 55 -8.923 16.664 10.405 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -11.377 16.992 7.876 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -12.708 16.577 8.961 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -10.626 16.127 11.776 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -12.283 16.089 11.165 1.00 0.00 H new ATOM 865 N MET A 56 -4.593 19.175 8.020 1.00 0.00 N ATOM 866 CA MET A 56 -3.567 19.133 9.053 1.00 0.00 C ATOM 867 C MET A 56 -2.454 20.134 8.749 1.00 0.00 C ATOM 868 O MET A 56 -2.546 21.306 9.124 1.00 0.00 O ATOM 869 CB MET A 56 -2.995 17.717 9.179 1.00 0.00 C ATOM 870 CG MET A 56 -4.042 16.667 9.508 1.00 0.00 C ATOM 871 SD MET A 56 -3.322 15.032 9.791 1.00 0.00 S ATOM 872 CE MET A 56 -4.789 14.067 10.157 1.00 0.00 C ATOM 0 H MET A 56 -4.429 18.546 7.234 1.00 0.00 H new ATOM 0 HA MET A 56 -4.024 19.409 10.003 1.00 0.00 H new ATOM 0 HB2 MET A 56 -2.503 17.448 8.244 1.00 0.00 H new ATOM 0 HB3 MET A 56 -2.229 17.711 9.955 1.00 0.00 H new ATOM 0 HG2 MET A 56 -4.594 16.975 10.396 1.00 0.00 H new ATOM 0 HG3 MET A 56 -4.761 16.607 8.691 1.00 0.00 H new ATOM 0 HE1 MET A 56 -4.505 13.033 10.354 1.00 0.00 H new ATOM 0 HE2 MET A 56 -5.287 14.480 11.034 1.00 0.00 H new ATOM 0 HE3 MET A 56 -5.468 14.101 9.305 1.00 0.00 H new ATOM 1089 N ASP A 69 -5.955 17.442 -8.893 1.00 0.00 N ATOM 1090 CA ASP A 69 -5.419 17.039 -7.605 1.00 0.00 C ATOM 1091 C ASP A 69 -5.343 15.522 -7.530 1.00 0.00 C ATOM 1092 O ASP A 69 -6.020 14.819 -8.283 1.00 0.00 O ATOM 1093 CB ASP A 69 -6.279 17.591 -6.462 1.00 0.00 C ATOM 1094 CG ASP A 69 -7.709 17.084 -6.502 1.00 0.00 C ATOM 1095 OD1 ASP A 69 -8.539 17.689 -7.215 1.00 0.00 O ATOM 1096 OD2 ASP A 69 -8.013 16.085 -5.817 1.00 0.00 O ATOM 0 HA ASP A 69 -4.415 17.450 -7.500 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -5.828 17.316 -5.509 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -6.283 18.680 -6.510 1.00 0.00 H new ATOM 1101 N GLN A 70 -4.502 15.019 -6.644 1.00 0.00 N ATOM 1102 CA GLN A 70 -4.310 13.584 -6.513 1.00 0.00 C ATOM 1103 C GLN A 70 -5.177 13.032 -5.389 1.00 0.00 C ATOM 1104 O GLN A 70 -5.123 13.519 -4.257 1.00 0.00 O ATOM 1105 CB GLN A 70 -2.836 13.267 -6.249 1.00 0.00 C ATOM 1106 CG GLN A 70 -1.898 13.729 -7.355 1.00 0.00 C ATOM 1107 CD GLN A 70 -2.160 13.031 -8.676 1.00 0.00 C ATOM 1108 OE1 GLN A 70 -1.590 11.974 -8.956 1.00 0.00 O ATOM 1109 NE2 GLN A 70 -3.020 13.612 -9.498 1.00 0.00 N ATOM 0 H GLN A 70 -3.941 15.582 -6.004 1.00 0.00 H new ATOM 0 HA GLN A 70 -4.608 13.108 -7.447 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -2.536 13.736 -5.312 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -2.724 12.191 -6.117 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -2.005 14.805 -7.490 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -0.867 13.547 -7.051 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -3.471 14.487 -9.229 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -3.232 13.185 -10.400 1.00 0.00 H new ATOM 1118 N MET A 71 -5.979 12.028 -5.704 1.00 0.00 N ATOM 1119 CA MET A 71 -6.831 11.396 -4.708 1.00 0.00 C ATOM 1120 C MET A 71 -6.055 10.329 -3.947 1.00 0.00 C ATOM 1121 O MET A 71 -5.130 9.719 -4.485 1.00 0.00 O ATOM 1122 CB MET A 71 -8.071 10.781 -5.363 1.00 0.00 C ATOM 1123 CG MET A 71 -9.005 11.806 -5.985 1.00 0.00 C ATOM 1124 SD MET A 71 -10.487 11.058 -6.692 1.00 0.00 S ATOM 1125 CE MET A 71 -11.293 12.502 -7.380 1.00 0.00 C ATOM 0 H MET A 71 -6.058 11.633 -6.641 1.00 0.00 H new ATOM 0 HA MET A 71 -7.158 12.162 -4.005 1.00 0.00 H new ATOM 0 HB2 MET A 71 -7.753 10.078 -6.133 1.00 0.00 H new ATOM 0 HB3 MET A 71 -8.620 10.209 -4.615 1.00 0.00 H new ATOM 0 HG2 MET A 71 -9.296 12.533 -5.227 1.00 0.00 H new ATOM 0 HG3 MET A 71 -8.472 12.352 -6.763 1.00 0.00 H new ATOM 0 HE1 MET A 71 -12.228 12.205 -7.855 1.00 0.00 H new ATOM 0 HE2 MET A 71 -11.501 13.217 -6.584 1.00 0.00 H new ATOM 0 HE3 MET A 71 -10.641 12.964 -8.121 1.00 0.00 H new ATOM 1135 N VAL A 72 -6.427 10.120 -2.696 1.00 0.00 N ATOM 1136 CA VAL A 72 -5.769 9.134 -1.855 1.00 0.00 C ATOM 1137 C VAL A 72 -6.615 7.860 -1.794 1.00 0.00 C ATOM 1138 O VAL A 72 -7.838 7.916 -1.940 1.00 0.00 O ATOM 1139 CB VAL A 72 -5.518 9.696 -0.433 1.00 0.00 C ATOM 1140 CG1 VAL A 72 -6.825 9.960 0.298 1.00 0.00 C ATOM 1141 CG2 VAL A 72 -4.631 8.768 0.379 1.00 0.00 C ATOM 0 H VAL A 72 -7.186 10.623 -2.237 1.00 0.00 H new ATOM 0 HA VAL A 72 -4.799 8.894 -2.291 1.00 0.00 H new ATOM 0 HB VAL A 72 -4.998 10.647 -0.549 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -6.613 10.353 1.292 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -7.415 10.686 -0.262 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -7.386 9.030 0.388 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -4.474 9.191 1.371 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -5.112 7.794 0.471 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -3.670 8.652 -0.122 1.00 0.00 H new ATOM 1151 N LEU A 73 -5.972 6.714 -1.623 1.00 0.00 N ATOM 1152 CA LEU A 73 -6.689 5.449 -1.585 1.00 0.00 C ATOM 1153 C LEU A 73 -6.905 4.969 -0.160 1.00 0.00 C ATOM 1154 O LEU A 73 -6.277 5.459 0.783 1.00 0.00 O ATOM 1155 CB LEU A 73 -5.962 4.366 -2.389 1.00 0.00 C ATOM 1156 CG LEU A 73 -6.083 4.482 -3.911 1.00 0.00 C ATOM 1157 CD1 LEU A 73 -5.138 5.538 -4.457 1.00 0.00 C ATOM 1158 CD2 LEU A 73 -5.826 3.134 -4.565 1.00 0.00 C ATOM 0 H LEU A 73 -4.962 6.634 -1.509 1.00 0.00 H new ATOM 0 HA LEU A 73 -7.662 5.630 -2.042 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -4.905 4.389 -2.123 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.346 3.393 -2.085 1.00 0.00 H new ATOM 0 HG LEU A 73 -7.100 4.794 -4.150 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -5.246 5.598 -5.540 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -5.378 6.505 -4.014 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -4.111 5.270 -4.209 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -5.915 3.232 -5.647 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -4.822 2.793 -4.313 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -6.556 2.410 -4.205 1.00 0.00 H new ATOM 1170 N ASN A 74 -7.812 4.014 -0.014 1.00 0.00 N ATOM 1171 CA ASN A 74 -8.089 3.415 1.280 1.00 0.00 C ATOM 1172 C ASN A 74 -7.057 2.347 1.580 1.00 0.00 C ATOM 1173 O ASN A 74 -6.862 1.429 0.785 1.00 0.00 O ATOM 1174 CB ASN A 74 -9.487 2.779 1.322 1.00 0.00 C ATOM 1175 CG ASN A 74 -10.619 3.783 1.449 1.00 0.00 C ATOM 1176 OD1 ASN A 74 -10.969 4.205 2.551 1.00 0.00 O ATOM 1177 ND2 ASN A 74 -11.225 4.149 0.328 1.00 0.00 N ATOM 0 H ASN A 74 -8.370 3.637 -0.780 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.046 4.208 2.027 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -9.635 2.192 0.415 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -9.534 2.086 2.162 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -12.009 4.801 0.361 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -10.907 3.779 -0.568 1.00 0.00 H new ATOM 1184 N GLY A 75 -6.387 2.472 2.710 1.00 0.00 N ATOM 1185 CA GLY A 75 -5.485 1.427 3.138 1.00 0.00 C ATOM 1186 C GLY A 75 -6.239 0.339 3.865 1.00 0.00 C ATOM 1187 O GLY A 75 -5.835 -0.826 3.878 1.00 0.00 O ATOM 0 H GLY A 75 -6.450 3.274 3.337 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.971 1.006 2.274 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -4.719 1.845 3.791 1.00 0.00 H new ATOM 1191 N GLY A 76 -7.346 0.736 4.471 1.00 0.00 N ATOM 1192 CA GLY A 76 -8.203 -0.190 5.172 1.00 0.00 C ATOM 1193 C GLY A 76 -9.237 0.545 5.990 1.00 0.00 C ATOM 1194 O GLY A 76 -9.211 1.774 6.051 1.00 0.00 O ATOM 0 H GLY A 76 -7.669 1.703 4.488 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -8.699 -0.846 4.456 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -7.603 -0.825 5.823 1.00 0.00 H new ATOM 1198 N PRO A 77 -10.171 -0.173 6.621 1.00 0.00 N ATOM 1199 CA PRO A 77 -11.211 0.429 7.445 1.00 0.00 C ATOM 1200 C PRO A 77 -10.759 0.651 8.888 1.00 0.00 C ATOM 1201 O PRO A 77 -11.537 1.097 9.731 1.00 0.00 O ATOM 1202 CB PRO A 77 -12.350 -0.605 7.398 1.00 0.00 C ATOM 1203 CG PRO A 77 -11.809 -1.806 6.673 1.00 0.00 C ATOM 1204 CD PRO A 77 -10.320 -1.628 6.566 1.00 0.00 C ATOM 0 HA PRO A 77 -11.494 1.416 7.079 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -12.672 -0.872 8.404 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -13.220 -0.200 6.882 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -12.049 -2.722 7.213 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -12.258 -1.893 5.684 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -9.792 -2.121 7.382 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -9.927 -2.041 5.637 1.00 0.00 H new ATOM 1212 N VAL A 78 -9.500 0.339 9.168 1.00 0.00 N ATOM 1213 CA VAL A 78 -8.980 0.416 10.525 1.00 0.00 C ATOM 1214 C VAL A 78 -8.002 1.581 10.678 1.00 0.00 C ATOM 1215 O VAL A 78 -6.990 1.649 9.976 1.00 0.00 O ATOM 1216 CB VAL A 78 -8.276 -0.896 10.919 1.00 0.00 C ATOM 1217 CG1 VAL A 78 -7.902 -0.884 12.393 1.00 0.00 C ATOM 1218 CG2 VAL A 78 -9.160 -2.093 10.592 1.00 0.00 C ATOM 0 H VAL A 78 -8.821 0.030 8.472 1.00 0.00 H new ATOM 0 HA VAL A 78 -9.830 0.580 11.188 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.357 -0.982 10.340 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.406 -1.820 12.650 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.228 -0.050 12.591 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -8.803 -0.773 12.996 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -8.648 -3.012 10.877 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -10.097 -2.014 11.143 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -9.368 -2.110 9.522 1.00 0.00 H new ATOM 1228 N ASN A 79 -8.326 2.490 11.598 1.00 0.00 N ATOM 1229 CA ASN A 79 -7.497 3.663 11.897 1.00 0.00 C ATOM 1230 C ASN A 79 -7.227 4.502 10.656 1.00 0.00 C ATOM 1231 O ASN A 79 -6.077 4.782 10.318 1.00 0.00 O ATOM 1232 CB ASN A 79 -6.172 3.279 12.572 1.00 0.00 C ATOM 1233 CG ASN A 79 -6.343 2.922 14.036 1.00 0.00 C ATOM 1234 OD1 ASN A 79 -6.356 1.633 14.332 1.00 0.00 O flip ATOM 1235 ND2 ASN A 79 -6.431 3.801 14.896 1.00 0.00 N flip ATOM 0 H ASN A 79 -9.175 2.435 12.161 1.00 0.00 H new ATOM 0 HA ASN A 79 -8.072 4.267 12.599 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -5.732 2.432 12.045 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -5.470 4.108 12.484 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -6.417 4.784 14.624 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -6.518 3.545 15.880 1.00 0.00 H new ATOM 1242 N GLN A 80 -8.299 4.933 10.004 1.00 0.00 N ATOM 1243 CA GLN A 80 -8.200 5.785 8.823 1.00 0.00 C ATOM 1244 C GLN A 80 -7.737 7.186 9.207 1.00 0.00 C ATOM 1245 O GLN A 80 -7.473 8.023 8.347 1.00 0.00 O ATOM 1246 CB GLN A 80 -9.534 5.849 8.084 1.00 0.00 C ATOM 1247 CG GLN A 80 -9.994 4.502 7.556 1.00 0.00 C ATOM 1248 CD GLN A 80 -11.201 4.605 6.646 1.00 0.00 C ATOM 1249 OE1 GLN A 80 -12.038 5.495 6.795 1.00 0.00 O ATOM 1250 NE2 GLN A 80 -11.294 3.695 5.691 1.00 0.00 N ATOM 0 H GLN A 80 -9.255 4.705 10.275 1.00 0.00 H new ATOM 0 HA GLN A 80 -7.459 5.347 8.154 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -10.295 6.247 8.756 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -9.447 6.547 7.251 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -9.175 4.032 7.012 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -10.234 3.851 8.397 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -10.578 2.974 5.602 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -12.082 3.714 5.043 1.00 0.00 H new ATOM 1259 N ASP A 81 -7.660 7.433 10.510 1.00 0.00 N ATOM 1260 CA ASP A 81 -7.229 8.724 11.036 1.00 0.00 C ATOM 1261 C ASP A 81 -5.740 8.920 10.796 1.00 0.00 C ATOM 1262 O ASP A 81 -5.202 10.006 10.997 1.00 0.00 O ATOM 1263 CB ASP A 81 -7.503 8.805 12.541 1.00 0.00 C ATOM 1264 CG ASP A 81 -8.919 8.420 12.903 1.00 0.00 C ATOM 1265 OD1 ASP A 81 -9.800 9.300 12.895 1.00 0.00 O ATOM 1266 OD2 ASP A 81 -9.161 7.228 13.195 1.00 0.00 O ATOM 0 H ASP A 81 -7.893 6.748 11.229 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.789 9.504 10.521 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -6.808 8.151 13.067 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -7.308 9.820 12.886 1.00 0.00 H new ATOM 1271 N ARG A 82 -5.081 7.855 10.369 1.00 0.00 N ATOM 1272 CA ARG A 82 -3.642 7.858 10.196 1.00 0.00 C ATOM 1273 C ARG A 82 -3.271 7.752 8.724 1.00 0.00 C ATOM 1274 O ARG A 82 -3.792 6.900 8.003 1.00 0.00 O ATOM 1275 CB ARG A 82 -3.039 6.695 10.974 1.00 0.00 C ATOM 1276 CG ARG A 82 -3.324 6.752 12.463 1.00 0.00 C ATOM 1277 CD ARG A 82 -2.526 7.854 13.143 1.00 0.00 C ATOM 1278 NE ARG A 82 -2.689 7.828 14.596 1.00 0.00 N ATOM 1279 CZ ARG A 82 -1.789 8.302 15.459 1.00 0.00 C ATOM 1280 NH1 ARG A 82 -0.699 8.929 15.025 1.00 0.00 N ATOM 1281 NH2 ARG A 82 -1.985 8.169 16.764 1.00 0.00 N ATOM 0 H ARG A 82 -5.528 6.969 10.134 1.00 0.00 H new ATOM 0 HA ARG A 82 -3.244 8.799 10.576 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.428 5.759 10.573 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -1.960 6.684 10.819 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -4.389 6.920 12.624 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.081 5.792 12.918 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -1.470 7.744 12.894 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -2.845 8.823 12.759 1.00 0.00 H new ATOM 0 HE ARG A 82 -3.545 7.422 14.973 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -0.545 9.051 14.024 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -0.017 9.288 15.693 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -2.825 7.704 17.109 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -1.296 8.532 17.423 1.00 0.00 H new ATOM 1295 N GLY A 83 -2.377 8.624 8.285 1.00 0.00 N ATOM 1296 CA GLY A 83 -1.919 8.590 6.913 1.00 0.00 C ATOM 1297 C GLY A 83 -0.618 7.828 6.773 1.00 0.00 C ATOM 1298 O GLY A 83 0.396 8.211 7.355 1.00 0.00 O ATOM 0 H GLY A 83 -1.959 9.358 8.857 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.681 8.126 6.287 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -1.784 9.609 6.549 1.00 0.00 H new ATOM 1302 N PHE A 84 -0.650 6.741 6.018 1.00 0.00 N ATOM 1303 CA PHE A 84 0.530 5.917 5.812 1.00 0.00 C ATOM 1304 C PHE A 84 1.131 6.192 4.440 1.00 0.00 C ATOM 1305 O PHE A 84 0.438 6.113 3.424 1.00 0.00 O ATOM 1306 CB PHE A 84 0.169 4.433 5.936 1.00 0.00 C ATOM 1307 CG PHE A 84 -0.292 4.029 7.311 1.00 0.00 C ATOM 1308 CD1 PHE A 84 -1.590 4.282 7.729 1.00 0.00 C ATOM 1309 CD2 PHE A 84 0.575 3.395 8.186 1.00 0.00 C ATOM 1310 CE1 PHE A 84 -2.012 3.910 8.992 1.00 0.00 C ATOM 1311 CE2 PHE A 84 0.157 3.022 9.450 1.00 0.00 C ATOM 1312 CZ PHE A 84 -1.137 3.280 9.853 1.00 0.00 C ATOM 0 H PHE A 84 -1.485 6.408 5.536 1.00 0.00 H new ATOM 0 HA PHE A 84 1.266 6.166 6.577 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -0.616 4.199 5.217 1.00 0.00 H new ATOM 0 HB3 PHE A 84 1.038 3.834 5.665 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -2.279 4.775 7.060 1.00 0.00 H new ATOM 0 HD2 PHE A 84 1.589 3.190 7.877 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -3.026 4.112 9.304 1.00 0.00 H new ATOM 0 HE2 PHE A 84 0.844 2.529 10.122 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.464 2.989 10.840 1.00 0.00 H new ATOM 1322 N ILE A 85 2.414 6.520 4.412 1.00 0.00 N ATOM 1323 CA ILE A 85 3.100 6.792 3.159 1.00 0.00 C ATOM 1324 C ILE A 85 4.256 5.823 2.962 1.00 0.00 C ATOM 1325 O ILE A 85 5.282 5.909 3.641 1.00 0.00 O ATOM 1326 CB ILE A 85 3.642 8.243 3.072 1.00 0.00 C ATOM 1327 CG1 ILE A 85 2.516 9.278 3.195 1.00 0.00 C ATOM 1328 CG2 ILE A 85 4.392 8.452 1.762 1.00 0.00 C ATOM 1329 CD1 ILE A 85 2.070 9.552 4.618 1.00 0.00 C ATOM 0 H ILE A 85 3.000 6.604 5.242 1.00 0.00 H new ATOM 0 HA ILE A 85 2.357 6.662 2.372 1.00 0.00 H new ATOM 0 HB ILE A 85 4.326 8.386 3.909 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.848 10.213 2.745 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.658 8.934 2.618 1.00 0.00 H new ATOM 0 HG21 ILE A 85 4.766 9.475 1.716 1.00 0.00 H new ATOM 0 HG22 ILE A 85 5.230 7.757 1.707 1.00 0.00 H new ATOM 0 HG23 ILE A 85 3.718 8.274 0.924 1.00 0.00 H new ATOM 0 HD11 ILE A 85 1.272 10.295 4.613 1.00 0.00 H new ATOM 0 HD12 ILE A 85 1.704 8.629 5.069 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.913 9.929 5.197 1.00 0.00 H new ATOM 1341 N VAL A 86 4.081 4.898 2.037 1.00 0.00 N ATOM 1342 CA VAL A 86 5.124 3.945 1.702 1.00 0.00 C ATOM 1343 C VAL A 86 5.957 4.505 0.558 1.00 0.00 C ATOM 1344 O VAL A 86 5.430 4.795 -0.511 1.00 0.00 O ATOM 1345 CB VAL A 86 4.542 2.577 1.284 1.00 0.00 C ATOM 1346 CG1 VAL A 86 5.641 1.524 1.212 1.00 0.00 C ATOM 1347 CG2 VAL A 86 3.441 2.136 2.239 1.00 0.00 C ATOM 0 H VAL A 86 3.221 4.786 1.501 1.00 0.00 H new ATOM 0 HA VAL A 86 5.738 3.790 2.589 1.00 0.00 H new ATOM 0 HB VAL A 86 4.104 2.688 0.292 1.00 0.00 H new ATOM 0 HG11 VAL A 86 5.210 0.568 0.916 1.00 0.00 H new ATOM 0 HG12 VAL A 86 6.388 1.828 0.479 1.00 0.00 H new ATOM 0 HG13 VAL A 86 6.112 1.422 2.190 1.00 0.00 H new ATOM 0 HG21 VAL A 86 3.049 1.170 1.921 1.00 0.00 H new ATOM 0 HG22 VAL A 86 3.847 2.049 3.247 1.00 0.00 H new ATOM 0 HG23 VAL A 86 2.638 2.873 2.234 1.00 0.00 H new ATOM 1357 N HIS A 87 7.249 4.677 0.782 1.00 0.00 N ATOM 1358 CA HIS A 87 8.110 5.282 -0.226 1.00 0.00 C ATOM 1359 C HIS A 87 9.408 4.510 -0.383 1.00 0.00 C ATOM 1360 O HIS A 87 9.816 3.775 0.518 1.00 0.00 O ATOM 1361 CB HIS A 87 8.413 6.749 0.116 1.00 0.00 C ATOM 1362 CG HIS A 87 9.009 6.962 1.478 1.00 0.00 C ATOM 1363 ND1 HIS A 87 10.369 6.971 1.724 1.00 0.00 N ATOM 1364 CD2 HIS A 87 8.414 7.204 2.670 1.00 0.00 C ATOM 1365 CE1 HIS A 87 10.579 7.211 3.009 1.00 0.00 C ATOM 1366 NE2 HIS A 87 9.408 7.354 3.602 1.00 0.00 N ATOM 0 H HIS A 87 7.724 4.410 1.644 1.00 0.00 H new ATOM 0 HA HIS A 87 7.571 5.246 -1.173 1.00 0.00 H new ATOM 0 HB2 HIS A 87 9.097 7.149 -0.632 1.00 0.00 H new ATOM 0 HB3 HIS A 87 7.490 7.324 0.044 1.00 0.00 H new ATOM 0 HD1 HIS A 87 11.096 6.817 1.026 1.00 0.00 H new ATOM 0 HD2 HIS A 87 7.351 7.267 2.853 1.00 0.00 H new ATOM 0 HE1 HIS A 87 11.544 7.278 3.490 1.00 0.00 H new ATOM 0 HE2 HIS A 87 9.266 7.545 4.594 1.00 0.00 H new ATOM 1375 N SER A 88 10.051 4.690 -1.528 1.00 0.00 N ATOM 1376 CA SER A 88 11.325 4.047 -1.800 1.00 0.00 C ATOM 1377 C SER A 88 12.448 4.760 -1.042 1.00 0.00 C ATOM 1378 O SER A 88 12.246 5.854 -0.494 1.00 0.00 O ATOM 1379 CB SER A 88 11.591 4.054 -3.311 1.00 0.00 C ATOM 1380 OG SER A 88 12.771 3.342 -3.650 1.00 0.00 O ATOM 0 H SER A 88 9.708 5.280 -2.286 1.00 0.00 H new ATOM 0 HA SER A 88 11.291 3.013 -1.457 1.00 0.00 H new ATOM 0 HB2 SER A 88 10.740 3.613 -3.830 1.00 0.00 H new ATOM 0 HB3 SER A 88 11.677 5.084 -3.658 1.00 0.00 H new ATOM 0 HG SER A 88 12.820 2.519 -3.121 1.00 0.00 H new ATOM 1386 N LYS A 89 13.612 4.128 -1.004 1.00 0.00 N ATOM 1387 CA LYS A 89 14.778 4.670 -0.322 1.00 0.00 C ATOM 1388 C LYS A 89 15.418 5.784 -1.144 1.00 0.00 C ATOM 1389 O LYS A 89 15.919 5.550 -2.247 1.00 0.00 O ATOM 1390 CB LYS A 89 15.782 3.534 -0.065 1.00 0.00 C ATOM 1391 CG LYS A 89 17.046 3.917 0.700 1.00 0.00 C ATOM 1392 CD LYS A 89 18.085 4.574 -0.194 1.00 0.00 C ATOM 1393 CE LYS A 89 19.448 4.606 0.469 1.00 0.00 C ATOM 1394 NZ LYS A 89 20.037 3.247 0.592 1.00 0.00 N ATOM 0 H LYS A 89 13.775 3.223 -1.446 1.00 0.00 H new ATOM 0 HA LYS A 89 14.470 5.102 0.630 1.00 0.00 H new ATOM 0 HB2 LYS A 89 15.273 2.744 0.487 1.00 0.00 H new ATOM 0 HB3 LYS A 89 16.077 3.112 -1.026 1.00 0.00 H new ATOM 0 HG2 LYS A 89 16.785 4.597 1.511 1.00 0.00 H new ATOM 0 HG3 LYS A 89 17.475 3.026 1.158 1.00 0.00 H new ATOM 0 HD2 LYS A 89 18.151 4.031 -1.137 1.00 0.00 H new ATOM 0 HD3 LYS A 89 17.771 5.590 -0.432 1.00 0.00 H new ATOM 0 HE2 LYS A 89 20.118 5.241 -0.110 1.00 0.00 H new ATOM 0 HE3 LYS A 89 19.360 5.054 1.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 21.063 3.326 0.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 19.606 2.754 1.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 19.854 2.709 -0.279 1.00 0.00 H new ATOM 1408 N THR A 90 15.382 6.995 -0.610 1.00 0.00 N ATOM 1409 CA THR A 90 16.079 8.113 -1.206 1.00 0.00 C ATOM 1410 C THR A 90 17.171 8.638 -0.274 1.00 0.00 C ATOM 1411 O THR A 90 17.917 9.550 -0.628 1.00 0.00 O ATOM 1412 CB THR A 90 15.095 9.239 -1.543 1.00 0.00 C ATOM 1413 OG1 THR A 90 14.079 9.327 -0.532 1.00 0.00 O ATOM 1414 CG2 THR A 90 14.458 9.010 -2.906 1.00 0.00 C ATOM 0 H THR A 90 14.871 7.225 0.243 1.00 0.00 H new ATOM 0 HA THR A 90 16.549 7.763 -2.125 1.00 0.00 H new ATOM 0 HB THR A 90 15.647 10.178 -1.575 1.00 0.00 H new ATOM 0 HG1 THR A 90 13.921 10.268 -0.308 1.00 0.00 H new ATOM 0 HG21 THR A 90 13.763 9.821 -3.124 1.00 0.00 H new ATOM 0 HG22 THR A 90 15.235 8.982 -3.670 1.00 0.00 H new ATOM 0 HG23 THR A 90 13.919 8.063 -2.901 1.00 0.00 H new ATOM 1422 N ASP A 91 17.255 8.042 0.914 1.00 0.00 N ATOM 1423 CA ASP A 91 18.246 8.419 1.924 1.00 0.00 C ATOM 1424 C ASP A 91 18.119 7.457 3.110 1.00 0.00 C ATOM 1425 O ASP A 91 17.813 6.279 2.919 1.00 0.00 O ATOM 1426 CB ASP A 91 18.032 9.880 2.372 1.00 0.00 C ATOM 1427 CG ASP A 91 19.191 10.438 3.187 1.00 0.00 C ATOM 1428 OD1 ASP A 91 20.223 10.818 2.600 1.00 0.00 O ATOM 1429 OD2 ASP A 91 19.077 10.481 4.431 1.00 0.00 O ATOM 0 H ASP A 91 16.638 7.284 1.205 1.00 0.00 H new ATOM 0 HA ASP A 91 19.250 8.350 1.505 1.00 0.00 H new ATOM 0 HB2 ASP A 91 17.883 10.504 1.491 1.00 0.00 H new ATOM 0 HB3 ASP A 91 17.119 9.941 2.964 1.00 0.00 H new ATOM 1434 N HIS A 92 18.349 7.950 4.317 1.00 0.00 N ATOM 1435 CA HIS A 92 18.216 7.150 5.525 1.00 0.00 C ATOM 1436 C HIS A 92 16.779 7.236 6.019 1.00 0.00 C ATOM 1437 O HIS A 92 15.875 7.578 5.256 1.00 0.00 O ATOM 1438 CB HIS A 92 19.161 7.671 6.617 1.00 0.00 C ATOM 1439 CG HIS A 92 20.583 7.838 6.177 1.00 0.00 C ATOM 1440 ND1 HIS A 92 21.037 8.957 5.508 1.00 0.00 N ATOM 1441 CD2 HIS A 92 21.658 7.027 6.320 1.00 0.00 C ATOM 1442 CE1 HIS A 92 22.326 8.828 5.261 1.00 0.00 C ATOM 1443 NE2 HIS A 92 22.725 7.667 5.742 1.00 0.00 N ATOM 0 H HIS A 92 18.633 8.915 4.487 1.00 0.00 H new ATOM 0 HA HIS A 92 18.475 6.116 5.300 1.00 0.00 H new ATOM 0 HB2 HIS A 92 18.789 8.631 6.975 1.00 0.00 H new ATOM 0 HB3 HIS A 92 19.133 6.984 7.462 1.00 0.00 H new ATOM 0 HD1 HIS A 92 20.464 9.759 5.245 1.00 0.00 H new ATOM 0 HD2 HIS A 92 21.673 6.059 6.799 1.00 0.00 H new ATOM 0 HE1 HIS A 92 22.948 9.549 4.752 1.00 0.00 H new ATOM 1452 N GLU A 93 16.563 6.932 7.288 1.00 0.00 N ATOM 1453 CA GLU A 93 15.256 7.128 7.887 1.00 0.00 C ATOM 1454 C GLU A 93 15.045 8.612 8.170 1.00 0.00 C ATOM 1455 O GLU A 93 15.980 9.414 8.079 1.00 0.00 O ATOM 1456 CB GLU A 93 15.094 6.328 9.187 1.00 0.00 C ATOM 1457 CG GLU A 93 15.299 4.825 9.042 1.00 0.00 C ATOM 1458 CD GLU A 93 16.755 4.434 8.884 1.00 0.00 C ATOM 1459 OE1 GLU A 93 17.504 4.513 9.876 1.00 0.00 O ATOM 1460 OE2 GLU A 93 17.157 4.041 7.770 1.00 0.00 O ATOM 0 H GLU A 93 17.270 6.552 7.918 1.00 0.00 H new ATOM 0 HA GLU A 93 14.508 6.767 7.181 1.00 0.00 H new ATOM 0 HB2 GLU A 93 15.804 6.708 9.922 1.00 0.00 H new ATOM 0 HB3 GLU A 93 14.096 6.508 9.586 1.00 0.00 H new ATOM 0 HG2 GLU A 93 14.887 4.322 9.917 1.00 0.00 H new ATOM 0 HG3 GLU A 93 14.738 4.470 8.177 1.00 0.00 H new ATOM 1467 N PHE A 94 13.831 8.973 8.523 1.00 0.00 N ATOM 1468 CA PHE A 94 13.499 10.361 8.800 1.00 0.00 C ATOM 1469 C PHE A 94 13.061 10.510 10.252 1.00 0.00 C ATOM 1470 O PHE A 94 13.356 9.643 11.078 1.00 0.00 O ATOM 1471 CB PHE A 94 12.415 10.851 7.839 1.00 0.00 C ATOM 1472 CG PHE A 94 12.865 10.905 6.406 1.00 0.00 C ATOM 1473 CD1 PHE A 94 13.568 12.001 5.928 1.00 0.00 C ATOM 1474 CD2 PHE A 94 12.587 9.864 5.538 1.00 0.00 C ATOM 1475 CE1 PHE A 94 13.982 12.056 4.611 1.00 0.00 C ATOM 1476 CE2 PHE A 94 13.000 9.912 4.219 1.00 0.00 C ATOM 1477 CZ PHE A 94 13.699 11.009 3.755 1.00 0.00 C ATOM 0 H PHE A 94 13.051 8.324 8.627 1.00 0.00 H new ATOM 0 HA PHE A 94 14.383 10.979 8.646 1.00 0.00 H new ATOM 0 HB2 PHE A 94 11.549 10.194 7.915 1.00 0.00 H new ATOM 0 HB3 PHE A 94 12.089 11.845 8.147 1.00 0.00 H new ATOM 0 HD1 PHE A 94 13.794 12.821 6.593 1.00 0.00 H new ATOM 0 HD2 PHE A 94 12.041 9.003 5.895 1.00 0.00 H new ATOM 0 HE1 PHE A 94 14.526 12.917 4.251 1.00 0.00 H new ATOM 0 HE2 PHE A 94 12.776 9.092 3.552 1.00 0.00 H new ATOM 0 HZ PHE A 94 14.024 11.048 2.726 1.00 0.00 H new ATOM 1487 N THR A 95 12.367 11.600 10.562 1.00 0.00 N ATOM 1488 CA THR A 95 11.985 11.902 11.935 1.00 0.00 C ATOM 1489 C THR A 95 11.111 10.798 12.531 1.00 0.00 C ATOM 1490 O THR A 95 11.245 10.458 13.707 1.00 0.00 O ATOM 1491 CB THR A 95 11.254 13.258 12.024 1.00 0.00 C ATOM 1492 OG1 THR A 95 12.080 14.292 11.466 1.00 0.00 O ATOM 1493 CG2 THR A 95 10.920 13.608 13.464 1.00 0.00 C ATOM 0 H THR A 95 12.057 12.290 9.878 1.00 0.00 H new ATOM 0 HA THR A 95 12.905 11.961 12.517 1.00 0.00 H new ATOM 0 HB THR A 95 10.324 13.178 11.461 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.612 15.151 11.523 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.406 14.568 13.495 1.00 0.00 H new ATOM 0 HG22 THR A 95 10.275 12.837 13.886 1.00 0.00 H new ATOM 0 HG23 THR A 95 11.840 13.670 14.046 1.00 0.00 H new ATOM 1501 N HIS A 96 10.233 10.226 11.720 1.00 0.00 N ATOM 1502 CA HIS A 96 9.407 9.118 12.167 1.00 0.00 C ATOM 1503 C HIS A 96 9.017 8.238 10.986 1.00 0.00 C ATOM 1504 O HIS A 96 7.923 8.361 10.434 1.00 0.00 O ATOM 1505 CB HIS A 96 8.154 9.617 12.898 1.00 0.00 C ATOM 1506 CG HIS A 96 7.428 8.541 13.644 1.00 0.00 C ATOM 1507 ND1 HIS A 96 6.111 8.372 13.880 1.00 0.00 N flip ATOM 1508 CD2 HIS A 96 8.063 7.477 14.249 1.00 0.00 C flip ATOM 1509 CE1 HIS A 96 5.970 7.219 14.611 1.00 0.00 C flip ATOM 1510 NE2 HIS A 96 7.164 6.698 14.820 1.00 0.00 N flip ATOM 0 H HIS A 96 10.076 10.510 10.753 1.00 0.00 H new ATOM 0 HA HIS A 96 9.992 8.526 12.871 1.00 0.00 H new ATOM 0 HB2 HIS A 96 8.440 10.403 13.597 1.00 0.00 H new ATOM 0 HB3 HIS A 96 7.475 10.067 12.173 1.00 0.00 H new ATOM 0 HD2 HIS A 96 9.130 7.308 14.255 1.00 0.00 H new ATOM 0 HE1 HIS A 96 5.035 6.806 14.958 1.00 0.00 H new ATOM 0 HE2 HIS A 96 7.359 5.839 15.335 1.00 0.00 H new ATOM 1519 N SER A 97 9.928 7.365 10.590 1.00 0.00 N ATOM 1520 CA SER A 97 9.691 6.468 9.474 1.00 0.00 C ATOM 1521 C SER A 97 10.113 5.046 9.833 1.00 0.00 C ATOM 1522 O SER A 97 11.094 4.837 10.544 1.00 0.00 O ATOM 1523 CB SER A 97 10.447 6.951 8.235 1.00 0.00 C ATOM 1524 OG SER A 97 9.947 8.200 7.781 1.00 0.00 O ATOM 0 H SER A 97 10.843 7.259 11.028 1.00 0.00 H new ATOM 0 HA SER A 97 8.624 6.466 9.252 1.00 0.00 H new ATOM 0 HB2 SER A 97 11.508 7.044 8.467 1.00 0.00 H new ATOM 0 HB3 SER A 97 10.358 6.210 7.440 1.00 0.00 H new ATOM 0 HG SER A 97 9.973 8.849 8.515 1.00 0.00 H new ATOM 1530 N TYR A 98 9.358 4.082 9.335 1.00 0.00 N ATOM 1531 CA TYR A 98 9.595 2.674 9.617 1.00 0.00 C ATOM 1532 C TYR A 98 10.284 2.006 8.432 1.00 0.00 C ATOM 1533 O TYR A 98 9.828 2.118 7.296 1.00 0.00 O ATOM 1534 CB TYR A 98 8.257 1.985 9.912 1.00 0.00 C ATOM 1535 CG TYR A 98 8.350 0.496 10.178 1.00 0.00 C ATOM 1536 CD1 TYR A 98 8.546 0.013 11.466 1.00 0.00 C ATOM 1537 CD2 TYR A 98 8.221 -0.425 9.143 1.00 0.00 C ATOM 1538 CE1 TYR A 98 8.614 -1.344 11.714 1.00 0.00 C ATOM 1539 CE2 TYR A 98 8.282 -1.783 9.385 1.00 0.00 C ATOM 1540 CZ TYR A 98 8.482 -2.237 10.670 1.00 0.00 C ATOM 1541 OH TYR A 98 8.521 -3.589 10.921 1.00 0.00 O ATOM 0 H TYR A 98 8.561 4.253 8.722 1.00 0.00 H new ATOM 0 HA TYR A 98 10.246 2.585 10.486 1.00 0.00 H new ATOM 0 HB2 TYR A 98 7.801 2.466 10.777 1.00 0.00 H new ATOM 0 HB3 TYR A 98 7.588 2.147 9.067 1.00 0.00 H new ATOM 0 HD1 TYR A 98 8.647 0.709 12.286 1.00 0.00 H new ATOM 0 HD2 TYR A 98 8.071 -0.072 8.134 1.00 0.00 H new ATOM 0 HE1 TYR A 98 8.770 -1.705 12.720 1.00 0.00 H new ATOM 0 HE2 TYR A 98 8.174 -2.485 8.572 1.00 0.00 H new ATOM 0 HH TYR A 98 7.781 -3.833 11.516 1.00 0.00 H new ATOM 1551 N LYS A 99 11.384 1.319 8.698 1.00 0.00 N ATOM 1552 CA LYS A 99 12.126 0.639 7.651 1.00 0.00 C ATOM 1553 C LYS A 99 11.611 -0.789 7.500 1.00 0.00 C ATOM 1554 O LYS A 99 11.810 -1.616 8.385 1.00 0.00 O ATOM 1555 CB LYS A 99 13.617 0.623 7.991 1.00 0.00 C ATOM 1556 CG LYS A 99 14.526 0.931 6.813 1.00 0.00 C ATOM 1557 CD LYS A 99 14.404 2.385 6.389 1.00 0.00 C ATOM 1558 CE LYS A 99 15.390 2.730 5.284 1.00 0.00 C ATOM 1559 NZ LYS A 99 16.799 2.468 5.688 1.00 0.00 N ATOM 0 H LYS A 99 11.782 1.218 9.632 1.00 0.00 H new ATOM 0 HA LYS A 99 11.985 1.172 6.711 1.00 0.00 H new ATOM 0 HB2 LYS A 99 13.806 1.349 8.781 1.00 0.00 H new ATOM 0 HB3 LYS A 99 13.877 -0.357 8.390 1.00 0.00 H new ATOM 0 HG2 LYS A 99 15.560 0.714 7.082 1.00 0.00 H new ATOM 0 HG3 LYS A 99 14.271 0.283 5.975 1.00 0.00 H new ATOM 0 HD2 LYS A 99 13.388 2.580 6.045 1.00 0.00 H new ATOM 0 HD3 LYS A 99 14.579 3.031 7.249 1.00 0.00 H new ATOM 0 HE2 LYS A 99 15.154 2.147 4.394 1.00 0.00 H new ATOM 0 HE3 LYS A 99 15.280 3.781 5.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 17.444 2.971 5.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 16.949 2.803 6.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 16.990 1.447 5.640 1.00 0.00 H new ATOM 1573 N VAL A 100 10.941 -1.069 6.389 1.00 0.00 N ATOM 1574 CA VAL A 100 10.365 -2.390 6.167 1.00 0.00 C ATOM 1575 C VAL A 100 11.429 -3.357 5.660 1.00 0.00 C ATOM 1576 O VAL A 100 11.878 -4.241 6.384 1.00 0.00 O ATOM 1577 CB VAL A 100 9.190 -2.341 5.161 1.00 0.00 C ATOM 1578 CG1 VAL A 100 8.510 -3.702 5.052 1.00 0.00 C ATOM 1579 CG2 VAL A 100 8.187 -1.264 5.555 1.00 0.00 C ATOM 0 H VAL A 100 10.783 -0.404 5.632 1.00 0.00 H new ATOM 0 HA VAL A 100 9.980 -2.740 7.125 1.00 0.00 H new ATOM 0 HB VAL A 100 9.594 -2.087 4.181 1.00 0.00 H new ATOM 0 HG11 VAL A 100 7.688 -3.642 4.339 1.00 0.00 H new ATOM 0 HG12 VAL A 100 9.232 -4.443 4.711 1.00 0.00 H new ATOM 0 HG13 VAL A 100 8.123 -3.995 6.028 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.369 -1.247 4.834 1.00 0.00 H new ATOM 0 HG22 VAL A 100 7.792 -1.481 6.547 1.00 0.00 H new ATOM 0 HG23 VAL A 100 8.681 -0.293 5.566 1.00 0.00 H new ATOM 1589 N THR A 101 11.848 -3.176 4.419 1.00 0.00 N ATOM 1590 CA THR A 101 12.850 -4.049 3.835 1.00 0.00 C ATOM 1591 C THR A 101 13.968 -3.233 3.187 1.00 0.00 C ATOM 1592 O THR A 101 14.123 -3.211 1.966 1.00 0.00 O ATOM 1593 CB THR A 101 12.210 -5.051 2.836 1.00 0.00 C ATOM 1594 OG1 THR A 101 13.214 -5.856 2.198 1.00 0.00 O ATOM 1595 CG2 THR A 101 11.368 -4.339 1.785 1.00 0.00 C ATOM 0 H THR A 101 11.512 -2.438 3.801 1.00 0.00 H new ATOM 0 HA THR A 101 13.296 -4.639 4.635 1.00 0.00 H new ATOM 0 HB THR A 101 11.553 -5.701 3.414 1.00 0.00 H new ATOM 0 HG1 THR A 101 13.854 -5.275 1.736 1.00 0.00 H new ATOM 0 HG21 THR A 101 10.937 -5.074 1.105 1.00 0.00 H new ATOM 0 HG22 THR A 101 10.567 -3.785 2.275 1.00 0.00 H new ATOM 0 HG23 THR A 101 11.996 -3.648 1.222 1.00 0.00 H new ATOM 1603 N ASP A 102 14.720 -2.537 4.044 1.00 0.00 N ATOM 1604 CA ASP A 102 15.892 -1.746 3.647 1.00 0.00 C ATOM 1605 C ASP A 102 15.517 -0.542 2.782 1.00 0.00 C ATOM 1606 O ASP A 102 15.627 0.599 3.220 1.00 0.00 O ATOM 1607 CB ASP A 102 16.931 -2.604 2.920 1.00 0.00 C ATOM 1608 CG ASP A 102 18.191 -1.823 2.617 1.00 0.00 C ATOM 1609 OD1 ASP A 102 19.005 -1.628 3.542 1.00 0.00 O ATOM 1610 OD2 ASP A 102 18.368 -1.384 1.461 1.00 0.00 O ATOM 0 H ASP A 102 14.531 -2.505 5.046 1.00 0.00 H new ATOM 0 HA ASP A 102 16.330 -1.372 4.572 1.00 0.00 H new ATOM 0 HB2 ASP A 102 17.179 -3.471 3.532 1.00 0.00 H new ATOM 0 HB3 ASP A 102 16.505 -2.981 1.990 1.00 0.00 H new ATOM 1615 N ASP A 103 15.088 -0.796 1.557 1.00 0.00 N ATOM 1616 CA ASP A 103 14.720 0.275 0.639 1.00 0.00 C ATOM 1617 C ASP A 103 13.342 0.815 0.994 1.00 0.00 C ATOM 1618 O ASP A 103 13.170 2.008 1.251 1.00 0.00 O ATOM 1619 CB ASP A 103 14.722 -0.233 -0.806 1.00 0.00 C ATOM 1620 CG ASP A 103 14.592 0.883 -1.831 1.00 0.00 C ATOM 1621 OD1 ASP A 103 13.508 1.491 -1.935 1.00 0.00 O ATOM 1622 OD2 ASP A 103 15.583 1.154 -2.542 1.00 0.00 O ATOM 0 H ASP A 103 14.985 -1.735 1.172 1.00 0.00 H new ATOM 0 HA ASP A 103 15.454 1.076 0.730 1.00 0.00 H new ATOM 0 HB2 ASP A 103 15.645 -0.782 -0.991 1.00 0.00 H new ATOM 0 HB3 ASP A 103 13.901 -0.937 -0.938 1.00 0.00 H new ATOM 1627 N ILE A 104 12.370 -0.086 1.036 1.00 0.00 N ATOM 1628 CA ILE A 104 10.989 0.290 1.285 1.00 0.00 C ATOM 1629 C ILE A 104 10.838 0.863 2.689 1.00 0.00 C ATOM 1630 O ILE A 104 11.167 0.207 3.682 1.00 0.00 O ATOM 1631 CB ILE A 104 10.049 -0.922 1.116 1.00 0.00 C ATOM 1632 CG1 ILE A 104 10.316 -1.625 -0.222 1.00 0.00 C ATOM 1633 CG2 ILE A 104 8.595 -0.490 1.211 1.00 0.00 C ATOM 1634 CD1 ILE A 104 10.208 -0.718 -1.430 1.00 0.00 C ATOM 0 H ILE A 104 12.516 -1.086 0.900 1.00 0.00 H new ATOM 0 HA ILE A 104 10.713 1.051 0.555 1.00 0.00 H new ATOM 0 HB ILE A 104 10.249 -1.627 1.923 1.00 0.00 H new ATOM 0 HG12 ILE A 104 11.314 -2.062 -0.198 1.00 0.00 H new ATOM 0 HG13 ILE A 104 9.610 -2.448 -0.335 1.00 0.00 H new ATOM 0 HG21 ILE A 104 7.949 -1.359 1.089 1.00 0.00 H new ATOM 0 HG22 ILE A 104 8.413 -0.036 2.185 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.379 0.236 0.427 1.00 0.00 H new ATOM 0 HD11 ILE A 104 10.411 -1.291 -2.335 1.00 0.00 H new ATOM 0 HD12 ILE A 104 9.203 -0.300 -1.483 1.00 0.00 H new ATOM 0 HD13 ILE A 104 10.933 0.091 -1.343 1.00 0.00 H new ATOM 1646 N THR A 105 10.336 2.086 2.760 1.00 0.00 N ATOM 1647 CA THR A 105 10.201 2.788 4.024 1.00 0.00 C ATOM 1648 C THR A 105 8.782 3.328 4.197 1.00 0.00 C ATOM 1649 O THR A 105 8.238 3.970 3.296 1.00 0.00 O ATOM 1650 CB THR A 105 11.208 3.952 4.101 1.00 0.00 C ATOM 1651 OG1 THR A 105 12.511 3.497 3.711 1.00 0.00 O ATOM 1652 CG2 THR A 105 11.278 4.529 5.509 1.00 0.00 C ATOM 0 H THR A 105 10.014 2.615 1.950 1.00 0.00 H new ATOM 0 HA THR A 105 10.408 2.079 4.826 1.00 0.00 H new ATOM 0 HB THR A 105 10.869 4.734 3.422 1.00 0.00 H new ATOM 0 HG1 THR A 105 12.481 3.172 2.787 1.00 0.00 H new ATOM 0 HG21 THR A 105 11.997 5.348 5.531 1.00 0.00 H new ATOM 0 HG22 THR A 105 10.295 4.901 5.799 1.00 0.00 H new ATOM 0 HG23 THR A 105 11.592 3.752 6.206 1.00 0.00 H new ATOM 1660 N LEU A 106 8.196 3.068 5.357 1.00 0.00 N ATOM 1661 CA LEU A 106 6.828 3.478 5.646 1.00 0.00 C ATOM 1662 C LEU A 106 6.800 4.632 6.645 1.00 0.00 C ATOM 1663 O LEU A 106 7.162 4.467 7.806 1.00 0.00 O ATOM 1664 CB LEU A 106 6.036 2.287 6.199 1.00 0.00 C ATOM 1665 CG LEU A 106 4.630 2.608 6.717 1.00 0.00 C ATOM 1666 CD1 LEU A 106 3.752 3.151 5.602 1.00 0.00 C ATOM 1667 CD2 LEU A 106 3.999 1.370 7.336 1.00 0.00 C ATOM 0 H LEU A 106 8.652 2.570 6.121 1.00 0.00 H new ATOM 0 HA LEU A 106 6.369 3.821 4.719 1.00 0.00 H new ATOM 0 HB2 LEU A 106 5.952 1.535 5.415 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.609 1.838 7.011 1.00 0.00 H new ATOM 0 HG LEU A 106 4.717 3.377 7.485 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.759 3.371 5.995 1.00 0.00 H new ATOM 0 HD12 LEU A 106 4.194 4.063 5.202 1.00 0.00 H new ATOM 0 HD13 LEU A 106 3.671 2.409 4.808 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.001 1.614 7.699 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.930 0.583 6.585 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.614 1.025 8.167 1.00 0.00 H new ATOM 1679 N THR A 107 6.375 5.797 6.189 1.00 0.00 N ATOM 1680 CA THR A 107 6.226 6.947 7.064 1.00 0.00 C ATOM 1681 C THR A 107 4.772 7.059 7.520 1.00 0.00 C ATOM 1682 O THR A 107 3.860 7.105 6.697 1.00 0.00 O ATOM 1683 CB THR A 107 6.669 8.243 6.354 1.00 0.00 C ATOM 1684 OG1 THR A 107 8.015 8.094 5.871 1.00 0.00 O ATOM 1685 CG2 THR A 107 6.599 9.433 7.297 1.00 0.00 C ATOM 0 H THR A 107 6.126 5.972 5.215 1.00 0.00 H new ATOM 0 HA THR A 107 6.866 6.808 7.935 1.00 0.00 H new ATOM 0 HB THR A 107 5.993 8.423 5.519 1.00 0.00 H new ATOM 0 HG1 THR A 107 8.645 8.241 6.607 1.00 0.00 H new ATOM 0 HG21 THR A 107 6.917 10.333 6.771 1.00 0.00 H new ATOM 0 HG22 THR A 107 5.575 9.560 7.647 1.00 0.00 H new ATOM 0 HG23 THR A 107 7.256 9.261 8.150 1.00 0.00 H new ATOM 1693 N THR A 108 4.564 7.092 8.830 1.00 0.00 N ATOM 1694 CA THR A 108 3.220 7.040 9.396 1.00 0.00 C ATOM 1695 C THR A 108 2.784 8.390 9.962 1.00 0.00 C ATOM 1696 O THR A 108 1.836 8.469 10.746 1.00 0.00 O ATOM 1697 CB THR A 108 3.157 5.988 10.520 1.00 0.00 C ATOM 1698 OG1 THR A 108 4.142 6.284 11.519 1.00 0.00 O ATOM 1699 CG2 THR A 108 3.400 4.590 9.972 1.00 0.00 C ATOM 0 H THR A 108 5.310 7.155 9.523 1.00 0.00 H new ATOM 0 HA THR A 108 2.543 6.771 8.585 1.00 0.00 H new ATOM 0 HB THR A 108 2.161 6.022 10.961 1.00 0.00 H new ATOM 0 HG1 THR A 108 4.097 5.613 12.232 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.350 3.866 10.786 1.00 0.00 H new ATOM 0 HG22 THR A 108 2.639 4.353 9.229 1.00 0.00 H new ATOM 0 HG23 THR A 108 4.386 4.547 9.508 1.00 0.00 H new ATOM 1707 N SER A 109 3.472 9.452 9.571 1.00 0.00 N ATOM 1708 CA SER A 109 3.197 10.770 10.123 1.00 0.00 C ATOM 1709 C SER A 109 3.452 11.865 9.090 1.00 0.00 C ATOM 1710 O SER A 109 3.810 11.580 7.944 1.00 0.00 O ATOM 1711 CB SER A 109 4.069 10.999 11.360 1.00 0.00 C ATOM 1712 OG SER A 109 3.868 9.974 12.319 1.00 0.00 O ATOM 0 H SER A 109 4.220 9.428 8.878 1.00 0.00 H new ATOM 0 HA SER A 109 2.145 10.814 10.405 1.00 0.00 H new ATOM 0 HB2 SER A 109 5.119 11.029 11.069 1.00 0.00 H new ATOM 0 HB3 SER A 109 3.833 11.967 11.802 1.00 0.00 H new ATOM 0 HG SER A 109 4.736 9.630 12.617 1.00 0.00 H new ATOM 1718 N GLY A 110 3.285 13.120 9.514 1.00 0.00 N ATOM 1719 CA GLY A 110 3.531 14.262 8.642 1.00 0.00 C ATOM 1720 C GLY A 110 5.000 14.413 8.287 1.00 0.00 C ATOM 1721 O GLY A 110 5.376 15.291 7.514 1.00 0.00 O ATOM 0 H GLY A 110 2.981 13.367 10.456 1.00 0.00 H new ATOM 0 HA2 GLY A 110 2.949 14.150 7.727 1.00 0.00 H new ATOM 0 HA3 GLY A 110 3.183 15.171 9.132 1.00 0.00 H new ATOM 1725 N ASP A 111 5.813 13.539 8.866 1.00 0.00 N ATOM 1726 CA ASP A 111 7.241 13.433 8.572 1.00 0.00 C ATOM 1727 C ASP A 111 7.486 13.370 7.069 1.00 0.00 C ATOM 1728 O ASP A 111 8.492 13.864 6.559 1.00 0.00 O ATOM 1729 CB ASP A 111 7.759 12.161 9.231 1.00 0.00 C ATOM 1730 CG ASP A 111 9.263 12.011 9.178 1.00 0.00 C ATOM 1731 OD1 ASP A 111 9.976 13.034 9.227 1.00 0.00 O ATOM 1732 OD2 ASP A 111 9.737 10.855 9.126 1.00 0.00 O ATOM 0 H ASP A 111 5.495 12.870 9.567 1.00 0.00 H new ATOM 0 HA ASP A 111 7.761 14.310 8.957 1.00 0.00 H new ATOM 0 HB2 ASP A 111 7.439 12.147 10.273 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.301 11.300 8.745 1.00 0.00 H new ATOM 1737 N VAL A 112 6.536 12.760 6.376 1.00 0.00 N ATOM 1738 CA VAL A 112 6.573 12.638 4.921 1.00 0.00 C ATOM 1739 C VAL A 112 6.729 14.004 4.233 1.00 0.00 C ATOM 1740 O VAL A 112 7.402 14.114 3.210 1.00 0.00 O ATOM 1741 CB VAL A 112 5.308 11.924 4.386 1.00 0.00 C ATOM 1742 CG1 VAL A 112 4.048 12.704 4.731 1.00 0.00 C ATOM 1743 CG2 VAL A 112 5.411 11.701 2.884 1.00 0.00 C ATOM 0 H VAL A 112 5.715 12.334 6.805 1.00 0.00 H new ATOM 0 HA VAL A 112 7.448 12.035 4.681 1.00 0.00 H new ATOM 0 HB VAL A 112 5.241 10.951 4.873 1.00 0.00 H new ATOM 0 HG11 VAL A 112 3.176 12.178 4.342 1.00 0.00 H new ATOM 0 HG12 VAL A 112 3.963 12.797 5.814 1.00 0.00 H new ATOM 0 HG13 VAL A 112 4.101 13.697 4.285 1.00 0.00 H new ATOM 0 HG21 VAL A 112 4.512 11.198 2.528 1.00 0.00 H new ATOM 0 HG22 VAL A 112 5.513 12.662 2.380 1.00 0.00 H new ATOM 0 HG23 VAL A 112 6.282 11.083 2.667 1.00 0.00 H new ATOM 1753 N LEU A 113 6.133 15.046 4.810 1.00 0.00 N ATOM 1754 CA LEU A 113 6.217 16.388 4.238 1.00 0.00 C ATOM 1755 C LEU A 113 7.634 16.928 4.353 1.00 0.00 C ATOM 1756 O LEU A 113 8.138 17.592 3.448 1.00 0.00 O ATOM 1757 CB LEU A 113 5.254 17.338 4.946 1.00 0.00 C ATOM 1758 CG LEU A 113 3.772 17.048 4.726 1.00 0.00 C ATOM 1759 CD1 LEU A 113 2.923 18.004 5.545 1.00 0.00 C ATOM 1760 CD2 LEU A 113 3.428 17.151 3.247 1.00 0.00 C ATOM 0 H LEU A 113 5.588 14.987 5.670 1.00 0.00 H new ATOM 0 HA LEU A 113 5.942 16.321 3.185 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.459 17.305 6.016 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.462 18.355 4.612 1.00 0.00 H new ATOM 0 HG LEU A 113 3.559 16.031 5.056 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.868 17.787 5.379 1.00 0.00 H new ATOM 0 HD12 LEU A 113 3.157 17.883 6.603 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.134 19.029 5.242 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.368 16.942 3.105 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.650 18.157 2.891 1.00 0.00 H new ATOM 0 HD23 LEU A 113 4.019 16.428 2.685 1.00 0.00 H new ATOM 1772 N ASP A 114 8.272 16.616 5.470 1.00 0.00 N ATOM 1773 CA ASP A 114 9.640 17.043 5.730 1.00 0.00 C ATOM 1774 C ASP A 114 10.593 16.309 4.798 1.00 0.00 C ATOM 1775 O ASP A 114 11.695 16.773 4.509 1.00 0.00 O ATOM 1776 CB ASP A 114 9.997 16.759 7.186 1.00 0.00 C ATOM 1777 CG ASP A 114 11.266 17.455 7.632 1.00 0.00 C ATOM 1778 OD1 ASP A 114 11.432 18.657 7.332 1.00 0.00 O ATOM 1779 OD2 ASP A 114 12.104 16.799 8.290 1.00 0.00 O ATOM 0 H ASP A 114 7.859 16.062 6.220 1.00 0.00 H new ATOM 0 HA ASP A 114 9.728 18.114 5.548 1.00 0.00 H new ATOM 0 HB2 ASP A 114 9.172 17.075 7.825 1.00 0.00 H new ATOM 0 HB3 ASP A 114 10.112 15.684 7.323 1.00 0.00 H new ATOM 1784 N SER A 115 10.145 15.150 4.336 1.00 0.00 N ATOM 1785 CA SER A 115 10.888 14.365 3.359 1.00 0.00 C ATOM 1786 C SER A 115 10.843 15.019 1.971 1.00 0.00 C ATOM 1787 O SER A 115 11.661 14.711 1.107 1.00 0.00 O ATOM 1788 CB SER A 115 10.318 12.947 3.282 1.00 0.00 C ATOM 1789 OG SER A 115 10.242 12.353 4.568 1.00 0.00 O ATOM 0 H SER A 115 9.262 14.729 4.625 1.00 0.00 H new ATOM 0 HA SER A 115 11.928 14.321 3.683 1.00 0.00 H new ATOM 0 HB2 SER A 115 9.325 12.975 2.833 1.00 0.00 H new ATOM 0 HB3 SER A 115 10.944 12.335 2.633 1.00 0.00 H new ATOM 0 HG SER A 115 9.580 12.831 5.110 1.00 0.00 H new ATOM 1795 N PHE A 116 9.886 15.921 1.764 1.00 0.00 N ATOM 1796 CA PHE A 116 9.738 16.601 0.481 1.00 0.00 C ATOM 1797 C PHE A 116 10.416 17.964 0.511 1.00 0.00 C ATOM 1798 O PHE A 116 10.426 18.639 1.538 1.00 0.00 O ATOM 1799 CB PHE A 116 8.261 16.777 0.118 1.00 0.00 C ATOM 1800 CG PHE A 116 7.542 15.490 -0.160 1.00 0.00 C ATOM 1801 CD1 PHE A 116 8.041 14.587 -1.087 1.00 0.00 C ATOM 1802 CD2 PHE A 116 6.359 15.189 0.494 1.00 0.00 C ATOM 1803 CE1 PHE A 116 7.374 13.407 -1.352 1.00 0.00 C ATOM 1804 CE2 PHE A 116 5.689 14.010 0.233 1.00 0.00 C ATOM 1805 CZ PHE A 116 6.197 13.118 -0.691 1.00 0.00 C ATOM 0 H PHE A 116 9.202 16.197 2.469 1.00 0.00 H new ATOM 0 HA PHE A 116 10.216 15.979 -0.276 1.00 0.00 H new ATOM 0 HB2 PHE A 116 7.756 17.294 0.934 1.00 0.00 H new ATOM 0 HB3 PHE A 116 8.187 17.419 -0.760 1.00 0.00 H new ATOM 0 HD1 PHE A 116 8.961 14.809 -1.607 1.00 0.00 H new ATOM 0 HD2 PHE A 116 5.956 15.884 1.216 1.00 0.00 H new ATOM 0 HE1 PHE A 116 7.773 12.711 -2.075 1.00 0.00 H new ATOM 0 HE2 PHE A 116 4.768 13.786 0.751 1.00 0.00 H new ATOM 0 HZ PHE A 116 5.674 12.196 -0.896 1.00 0.00 H new ATOM 1815 N GLY A 117 10.989 18.357 -0.621 1.00 0.00 N ATOM 1816 CA GLY A 117 11.631 19.658 -0.727 1.00 0.00 C ATOM 1817 C GLY A 117 13.052 19.657 -0.200 1.00 0.00 C ATOM 1818 O GLY A 117 13.844 20.538 -0.531 1.00 0.00 O ATOM 0 H GLY A 117 11.021 17.796 -1.472 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.636 19.972 -1.771 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.045 20.393 -0.176 1.00 0.00 H new ATOM 1822 N THR A 118 13.383 18.646 0.588 1.00 0.00 N ATOM 1823 CA THR A 118 14.675 18.572 1.249 1.00 0.00 C ATOM 1824 C THR A 118 15.692 17.805 0.412 1.00 0.00 C ATOM 1825 O THR A 118 16.644 17.238 0.951 1.00 0.00 O ATOM 1826 CB THR A 118 14.527 17.895 2.618 1.00 0.00 C ATOM 1827 OG1 THR A 118 13.598 16.808 2.516 1.00 0.00 O ATOM 1828 CG2 THR A 118 14.047 18.884 3.665 1.00 0.00 C ATOM 0 H THR A 118 12.767 17.858 0.786 1.00 0.00 H new ATOM 0 HA THR A 118 15.038 19.592 1.377 1.00 0.00 H new ATOM 0 HB THR A 118 15.503 17.519 2.926 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.984 16.829 3.280 1.00 0.00 H new ATOM 0 HG21 THR A 118 13.950 18.378 4.626 1.00 0.00 H new ATOM 0 HG22 THR A 118 14.767 19.698 3.754 1.00 0.00 H new ATOM 0 HG23 THR A 118 13.079 19.287 3.368 1.00 0.00 H new ATOM 1836 N GLN A 119 15.475 17.801 -0.909 1.00 0.00 N ATOM 1837 CA GLN A 119 16.338 17.104 -1.873 1.00 0.00 C ATOM 1838 C GLN A 119 16.128 15.588 -1.815 1.00 0.00 C ATOM 1839 O GLN A 119 16.089 14.920 -2.849 1.00 0.00 O ATOM 1840 CB GLN A 119 17.817 17.445 -1.639 1.00 0.00 C ATOM 1841 CG GLN A 119 18.765 16.835 -2.659 1.00 0.00 C ATOM 1842 CD GLN A 119 20.217 16.955 -2.244 1.00 0.00 C ATOM 1843 OE1 GLN A 119 20.606 17.891 -1.548 1.00 0.00 O ATOM 1844 NE2 GLN A 119 21.031 16.013 -2.682 1.00 0.00 N ATOM 0 H GLN A 119 14.689 18.285 -1.343 1.00 0.00 H new ATOM 0 HA GLN A 119 16.057 17.449 -2.868 1.00 0.00 H new ATOM 0 HB2 GLN A 119 17.935 18.529 -1.652 1.00 0.00 H new ATOM 0 HB3 GLN A 119 18.104 17.105 -0.644 1.00 0.00 H new ATOM 0 HG2 GLN A 119 18.516 15.783 -2.799 1.00 0.00 H new ATOM 0 HG3 GLN A 119 18.624 17.326 -3.622 1.00 0.00 H new ATOM 0 HE21 GLN A 119 20.669 15.253 -3.257 1.00 0.00 H new ATOM 0 HE22 GLN A 119 22.023 16.045 -2.445 1.00 0.00 H new ATOM 1853 N THR A 120 15.968 15.060 -0.609 1.00 0.00 N ATOM 1854 CA THR A 120 15.792 13.629 -0.400 1.00 0.00 C ATOM 1855 C THR A 120 14.352 13.182 -0.648 1.00 0.00 C ATOM 1856 O THR A 120 13.943 12.107 -0.203 1.00 0.00 O ATOM 1857 CB THR A 120 16.206 13.244 1.027 1.00 0.00 C ATOM 1858 OG1 THR A 120 15.565 14.113 1.972 1.00 0.00 O ATOM 1859 CG2 THR A 120 17.715 13.329 1.191 1.00 0.00 C ATOM 0 H THR A 120 15.957 15.610 0.250 1.00 0.00 H new ATOM 0 HA THR A 120 16.431 13.121 -1.122 1.00 0.00 H new ATOM 0 HB THR A 120 15.895 12.216 1.211 1.00 0.00 H new ATOM 0 HG1 THR A 120 15.832 13.862 2.881 1.00 0.00 H new ATOM 0 HG21 THR A 120 17.986 13.052 2.210 1.00 0.00 H new ATOM 0 HG22 THR A 120 18.196 12.648 0.489 1.00 0.00 H new ATOM 0 HG23 THR A 120 18.046 14.348 0.992 1.00 0.00 H new ATOM 1867 N ALA A 121 13.597 14.015 -1.356 1.00 0.00 N ATOM 1868 CA ALA A 121 12.219 13.701 -1.716 1.00 0.00 C ATOM 1869 C ALA A 121 12.152 12.406 -2.524 1.00 0.00 C ATOM 1870 O ALA A 121 12.802 12.278 -3.562 1.00 0.00 O ATOM 1871 CB ALA A 121 11.601 14.854 -2.503 1.00 0.00 C ATOM 0 H ALA A 121 13.920 14.921 -1.695 1.00 0.00 H new ATOM 0 HA ALA A 121 11.648 13.560 -0.798 1.00 0.00 H new ATOM 0 HB1 ALA A 121 10.573 14.606 -2.765 1.00 0.00 H new ATOM 0 HB2 ALA A 121 11.612 15.758 -1.894 1.00 0.00 H new ATOM 0 HB3 ALA A 121 12.177 15.023 -3.413 1.00 0.00 H new ATOM 1877 N PRO A 122 11.368 11.429 -2.050 1.00 0.00 N ATOM 1878 CA PRO A 122 11.251 10.124 -2.703 1.00 0.00 C ATOM 1879 C PRO A 122 10.632 10.211 -4.095 1.00 0.00 C ATOM 1880 O PRO A 122 9.650 10.924 -4.310 1.00 0.00 O ATOM 1881 CB PRO A 122 10.343 9.323 -1.762 1.00 0.00 C ATOM 1882 CG PRO A 122 9.610 10.346 -0.963 1.00 0.00 C ATOM 1883 CD PRO A 122 10.542 11.518 -0.834 1.00 0.00 C ATOM 0 HA PRO A 122 12.229 9.670 -2.860 1.00 0.00 H new ATOM 0 HB2 PRO A 122 9.653 8.692 -2.323 1.00 0.00 H new ATOM 0 HB3 PRO A 122 10.926 8.664 -1.119 1.00 0.00 H new ATOM 0 HG2 PRO A 122 8.684 10.637 -1.458 1.00 0.00 H new ATOM 0 HG3 PRO A 122 9.338 9.954 0.017 1.00 0.00 H new ATOM 0 HD2 PRO A 122 9.998 12.461 -0.785 1.00 0.00 H new ATOM 0 HD3 PRO A 122 11.148 11.453 0.070 1.00 0.00 H new ATOM 1891 N GLU A 123 11.220 9.485 -5.042 1.00 0.00 N ATOM 1892 CA GLU A 123 10.708 9.444 -6.404 1.00 0.00 C ATOM 1893 C GLU A 123 9.351 8.762 -6.459 1.00 0.00 C ATOM 1894 O GLU A 123 8.412 9.264 -7.073 1.00 0.00 O ATOM 1895 CB GLU A 123 11.669 8.692 -7.323 1.00 0.00 C ATOM 1896 CG GLU A 123 13.036 9.332 -7.457 1.00 0.00 C ATOM 1897 CD GLU A 123 13.857 8.676 -8.543 1.00 0.00 C ATOM 1898 OE1 GLU A 123 13.748 9.102 -9.712 1.00 0.00 O ATOM 1899 OE2 GLU A 123 14.595 7.716 -8.243 1.00 0.00 O ATOM 0 H GLU A 123 12.053 8.917 -4.888 1.00 0.00 H new ATOM 0 HA GLU A 123 10.609 10.476 -6.741 1.00 0.00 H new ATOM 0 HB2 GLU A 123 11.792 7.676 -6.947 1.00 0.00 H new ATOM 0 HB3 GLU A 123 11.219 8.613 -8.313 1.00 0.00 H new ATOM 0 HG2 GLU A 123 12.921 10.393 -7.679 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.566 9.261 -6.507 1.00 0.00 H new ATOM 1906 N LYS A 124 9.257 7.611 -5.811 1.00 0.00 N ATOM 1907 CA LYS A 124 8.060 6.799 -5.878 1.00 0.00 C ATOM 1908 C LYS A 124 7.536 6.525 -4.484 1.00 0.00 C ATOM 1909 O LYS A 124 8.283 6.085 -3.604 1.00 0.00 O ATOM 1910 CB LYS A 124 8.358 5.495 -6.623 1.00 0.00 C ATOM 1911 CG LYS A 124 8.593 5.701 -8.112 1.00 0.00 C ATOM 1912 CD LYS A 124 9.273 4.503 -8.752 1.00 0.00 C ATOM 1913 CE LYS A 124 10.726 4.391 -8.315 1.00 0.00 C ATOM 1914 NZ LYS A 124 11.395 3.217 -8.931 1.00 0.00 N ATOM 0 H LYS A 124 10.000 7.220 -5.232 1.00 0.00 H new ATOM 0 HA LYS A 124 7.288 7.338 -6.427 1.00 0.00 H new ATOM 0 HB2 LYS A 124 9.238 5.025 -6.184 1.00 0.00 H new ATOM 0 HB3 LYS A 124 7.525 4.805 -6.484 1.00 0.00 H new ATOM 0 HG2 LYS A 124 7.640 5.884 -8.608 1.00 0.00 H new ATOM 0 HG3 LYS A 124 9.206 6.589 -8.263 1.00 0.00 H new ATOM 0 HD2 LYS A 124 8.739 3.592 -8.482 1.00 0.00 H new ATOM 0 HD3 LYS A 124 9.224 4.591 -9.837 1.00 0.00 H new ATOM 0 HE2 LYS A 124 11.260 5.300 -8.590 1.00 0.00 H new ATOM 0 HE3 LYS A 124 10.774 4.309 -7.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 12.408 3.419 -9.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 11.280 2.388 -8.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 10.967 3.020 -9.858 1.00 0.00 H new ATOM 1928 N PHE A 125 6.261 6.815 -4.288 1.00 0.00 N ATOM 1929 CA PHE A 125 5.625 6.659 -2.995 1.00 0.00 C ATOM 1930 C PHE A 125 4.122 6.480 -3.158 1.00 0.00 C ATOM 1931 O PHE A 125 3.531 6.942 -4.136 1.00 0.00 O ATOM 1932 CB PHE A 125 5.922 7.871 -2.101 1.00 0.00 C ATOM 1933 CG PHE A 125 5.581 9.201 -2.725 1.00 0.00 C ATOM 1934 CD1 PHE A 125 6.510 9.875 -3.505 1.00 0.00 C ATOM 1935 CD2 PHE A 125 4.335 9.778 -2.529 1.00 0.00 C ATOM 1936 CE1 PHE A 125 6.202 11.094 -4.077 1.00 0.00 C ATOM 1937 CE2 PHE A 125 4.023 10.999 -3.099 1.00 0.00 C ATOM 1938 CZ PHE A 125 4.958 11.656 -3.875 1.00 0.00 C ATOM 0 H PHE A 125 5.641 7.164 -5.019 1.00 0.00 H new ATOM 0 HA PHE A 125 6.031 5.767 -2.518 1.00 0.00 H new ATOM 0 HB2 PHE A 125 5.365 7.766 -1.170 1.00 0.00 H new ATOM 0 HB3 PHE A 125 6.981 7.865 -1.841 1.00 0.00 H new ATOM 0 HD1 PHE A 125 7.486 9.441 -3.667 1.00 0.00 H new ATOM 0 HD2 PHE A 125 3.600 9.268 -1.924 1.00 0.00 H new ATOM 0 HE1 PHE A 125 6.935 11.607 -4.682 1.00 0.00 H new ATOM 0 HE2 PHE A 125 3.050 11.438 -2.938 1.00 0.00 H new ATOM 0 HZ PHE A 125 4.716 12.608 -4.323 1.00 0.00 H new ATOM 1948 N ILE A 126 3.518 5.791 -2.206 1.00 0.00 N ATOM 1949 CA ILE A 126 2.078 5.606 -2.184 1.00 0.00 C ATOM 1950 C ILE A 126 1.523 5.974 -0.816 1.00 0.00 C ATOM 1951 O ILE A 126 2.055 5.562 0.215 1.00 0.00 O ATOM 1952 CB ILE A 126 1.670 4.156 -2.534 1.00 0.00 C ATOM 1953 CG1 ILE A 126 2.426 3.151 -1.658 1.00 0.00 C ATOM 1954 CG2 ILE A 126 1.916 3.881 -4.012 1.00 0.00 C ATOM 1955 CD1 ILE A 126 2.022 1.711 -1.892 1.00 0.00 C ATOM 0 H ILE A 126 4.009 5.346 -1.430 1.00 0.00 H new ATOM 0 HA ILE A 126 1.658 6.264 -2.945 1.00 0.00 H new ATOM 0 HB ILE A 126 0.605 4.038 -2.334 1.00 0.00 H new ATOM 0 HG12 ILE A 126 3.495 3.253 -1.844 1.00 0.00 H new ATOM 0 HG13 ILE A 126 2.260 3.400 -0.610 1.00 0.00 H new ATOM 0 HG21 ILE A 126 1.625 2.857 -4.245 1.00 0.00 H new ATOM 0 HG22 ILE A 126 1.326 4.572 -4.614 1.00 0.00 H new ATOM 0 HG23 ILE A 126 2.974 4.017 -4.236 1.00 0.00 H new ATOM 0 HD11 ILE A 126 2.600 1.060 -1.236 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.960 1.592 -1.678 1.00 0.00 H new ATOM 0 HD13 ILE A 126 2.215 1.443 -2.931 1.00 0.00 H new ATOM 1967 N VAL A 127 0.462 6.761 -0.816 1.00 0.00 N ATOM 1968 CA VAL A 127 -0.166 7.191 0.419 1.00 0.00 C ATOM 1969 C VAL A 127 -1.547 6.561 0.554 1.00 0.00 C ATOM 1970 O VAL A 127 -2.315 6.509 -0.410 1.00 0.00 O ATOM 1971 CB VAL A 127 -0.272 8.735 0.496 1.00 0.00 C ATOM 1972 CG1 VAL A 127 -1.012 9.293 -0.713 1.00 0.00 C ATOM 1973 CG2 VAL A 127 -0.944 9.170 1.794 1.00 0.00 C ATOM 0 H VAL A 127 0.016 7.116 -1.662 1.00 0.00 H new ATOM 0 HA VAL A 127 0.462 6.859 1.246 1.00 0.00 H new ATOM 0 HB VAL A 127 0.739 9.141 0.487 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -1.072 10.378 -0.634 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -0.476 9.025 -1.623 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -2.018 8.875 -0.748 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -1.007 10.258 1.824 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -1.947 8.747 1.844 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -0.359 8.816 2.643 1.00 0.00 H new ATOM 1983 N CYS A 128 -1.839 6.051 1.736 1.00 0.00 N ATOM 1984 CA CYS A 128 -3.133 5.454 2.013 1.00 0.00 C ATOM 1985 C CYS A 128 -3.594 5.833 3.413 1.00 0.00 C ATOM 1986 O CYS A 128 -2.793 5.887 4.348 1.00 0.00 O ATOM 1987 CB CYS A 128 -3.057 3.932 1.868 1.00 0.00 C ATOM 1988 SG CYS A 128 -2.565 3.380 0.218 1.00 0.00 S ATOM 0 H CYS A 128 -1.193 6.038 2.525 1.00 0.00 H new ATOM 0 HA CYS A 128 -3.858 5.833 1.293 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -2.348 3.542 2.598 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -4.030 3.504 2.109 1.00 0.00 H new ATOM 0 HG CYS A 128 -2.484 4.406 -0.577 1.00 0.00 H new ATOM 1994 N LEU A 129 -4.878 6.124 3.548 1.00 0.00 N ATOM 1995 CA LEU A 129 -5.447 6.464 4.843 1.00 0.00 C ATOM 1996 C LEU A 129 -5.934 5.206 5.542 1.00 0.00 C ATOM 1997 O LEU A 129 -6.812 4.500 5.034 1.00 0.00 O ATOM 1998 CB LEU A 129 -6.591 7.474 4.690 1.00 0.00 C ATOM 1999 CG LEU A 129 -6.182 8.952 4.756 1.00 0.00 C ATOM 2000 CD1 LEU A 129 -5.665 9.305 6.140 1.00 0.00 C ATOM 2001 CD2 LEU A 129 -5.131 9.276 3.714 1.00 0.00 C ATOM 0 H LEU A 129 -5.546 6.132 2.777 1.00 0.00 H new ATOM 0 HA LEU A 129 -4.671 6.927 5.452 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.085 7.294 3.735 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.327 7.284 5.471 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.070 9.549 4.547 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.381 10.357 6.165 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -6.446 9.123 6.878 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -4.796 8.689 6.372 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -4.861 10.330 3.785 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -4.247 8.663 3.886 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -5.528 9.069 2.720 1.00 0.00 H new ATOM 2013 N GLY A 130 -5.346 4.924 6.695 1.00 0.00 N ATOM 2014 CA GLY A 130 -5.673 3.718 7.424 1.00 0.00 C ATOM 2015 C GLY A 130 -5.033 2.494 6.812 1.00 0.00 C ATOM 2016 O GLY A 130 -4.344 2.587 5.796 1.00 0.00 O ATOM 0 H GLY A 130 -4.643 5.514 7.141 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -5.345 3.820 8.458 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -6.755 3.589 7.444 1.00 0.00 H new ATOM 2020 N CYS A 131 -5.239 1.351 7.436 1.00 0.00 N ATOM 2021 CA CYS A 131 -4.748 0.096 6.900 1.00 0.00 C ATOM 2022 C CYS A 131 -5.718 -1.020 7.221 1.00 0.00 C ATOM 2023 O CYS A 131 -6.680 -0.828 7.971 1.00 0.00 O ATOM 2024 CB CYS A 131 -3.369 -0.245 7.461 1.00 0.00 C ATOM 2025 SG CYS A 131 -2.075 0.938 7.023 1.00 0.00 S ATOM 0 H CYS A 131 -5.745 1.265 8.318 1.00 0.00 H new ATOM 0 HA CYS A 131 -4.661 0.205 5.819 1.00 0.00 H new ATOM 0 HB2 CYS A 131 -3.436 -0.306 8.547 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -3.078 -1.233 7.103 1.00 0.00 H new ATOM 0 HG CYS A 131 -2.231 2.027 7.715 1.00 0.00 H new ATOM 2031 N SER A 132 -5.474 -2.176 6.643 1.00 0.00 N ATOM 2032 CA SER A 132 -6.288 -3.336 6.911 1.00 0.00 C ATOM 2033 C SER A 132 -5.567 -4.225 7.911 1.00 0.00 C ATOM 2034 O SER A 132 -4.478 -4.734 7.631 1.00 0.00 O ATOM 2035 CB SER A 132 -6.561 -4.091 5.610 1.00 0.00 C ATOM 2036 OG SER A 132 -7.111 -3.225 4.628 1.00 0.00 O ATOM 0 H SER A 132 -4.714 -2.335 5.982 1.00 0.00 H new ATOM 0 HA SER A 132 -7.246 -3.030 7.333 1.00 0.00 H new ATOM 0 HB2 SER A 132 -5.635 -4.528 5.237 1.00 0.00 H new ATOM 0 HB3 SER A 132 -7.249 -4.915 5.800 1.00 0.00 H new ATOM 0 HG SER A 132 -6.460 -2.527 4.406 1.00 0.00 H new ATOM 2042 N THR A 133 -6.155 -4.379 9.084 1.00 0.00 N ATOM 2043 CA THR A 133 -5.548 -5.176 10.129 1.00 0.00 C ATOM 2044 C THR A 133 -6.306 -6.477 10.323 1.00 0.00 C ATOM 2045 O THR A 133 -7.536 -6.488 10.365 1.00 0.00 O ATOM 2046 CB THR A 133 -5.497 -4.411 11.465 1.00 0.00 C ATOM 2047 OG1 THR A 133 -6.812 -3.961 11.819 1.00 0.00 O ATOM 2048 CG2 THR A 133 -4.553 -3.221 11.372 1.00 0.00 C ATOM 0 H THR A 133 -7.052 -3.962 9.334 1.00 0.00 H new ATOM 0 HA THR A 133 -4.528 -5.395 9.814 1.00 0.00 H new ATOM 0 HB THR A 133 -5.125 -5.087 12.235 1.00 0.00 H new ATOM 0 HG1 THR A 133 -6.883 -3.892 12.794 1.00 0.00 H new ATOM 0 HG21 THR A 133 -4.534 -2.696 12.327 1.00 0.00 H new ATOM 0 HG22 THR A 133 -3.549 -3.571 11.130 1.00 0.00 H new ATOM 0 HG23 THR A 133 -4.899 -2.542 10.592 1.00 0.00 H new ATOM 2056 N TRP A 134 -5.574 -7.568 10.430 1.00 0.00 N ATOM 2057 CA TRP A 134 -6.176 -8.866 10.672 1.00 0.00 C ATOM 2058 C TRP A 134 -5.660 -9.451 11.964 1.00 0.00 C ATOM 2059 O TRP A 134 -4.655 -8.999 12.515 1.00 0.00 O ATOM 2060 CB TRP A 134 -5.880 -9.844 9.536 1.00 0.00 C ATOM 2061 CG TRP A 134 -7.000 -9.995 8.551 1.00 0.00 C ATOM 2062 CD1 TRP A 134 -7.950 -10.977 8.524 1.00 0.00 C ATOM 2063 CD2 TRP A 134 -7.276 -9.141 7.448 1.00 0.00 C ATOM 2064 NE1 TRP A 134 -8.788 -10.789 7.451 1.00 0.00 N ATOM 2065 CE2 TRP A 134 -8.400 -9.661 6.780 1.00 0.00 C ATOM 2066 CE3 TRP A 134 -6.677 -7.986 6.965 1.00 0.00 C ATOM 2067 CZ2 TRP A 134 -8.932 -9.057 5.644 1.00 0.00 C ATOM 2068 CZ3 TRP A 134 -7.203 -7.383 5.839 1.00 0.00 C ATOM 2069 CH2 TRP A 134 -8.323 -7.919 5.188 1.00 0.00 C ATOM 0 H TRP A 134 -4.557 -7.582 10.353 1.00 0.00 H new ATOM 0 HA TRP A 134 -7.254 -8.715 10.733 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -4.988 -9.510 9.007 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -5.651 -10.821 9.962 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -8.030 -11.782 9.240 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -9.571 -11.391 7.196 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -5.814 -7.566 7.461 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -9.793 -9.471 5.141 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -6.744 -6.484 5.454 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -8.713 -7.425 4.310 1.00 0.00 H new ATOM 2080 N LYS A 135 -6.350 -10.460 12.434 1.00 0.00 N ATOM 2081 CA LYS A 135 -5.910 -11.198 13.596 1.00 0.00 C ATOM 2082 C LYS A 135 -5.055 -12.374 13.131 1.00 0.00 C ATOM 2083 O LYS A 135 -5.358 -12.996 12.109 1.00 0.00 O ATOM 2084 CB LYS A 135 -7.106 -11.677 14.429 1.00 0.00 C ATOM 2085 CG LYS A 135 -7.834 -10.570 15.188 1.00 0.00 C ATOM 2086 CD LYS A 135 -8.699 -9.709 14.275 1.00 0.00 C ATOM 2087 CE LYS A 135 -9.383 -8.587 15.047 1.00 0.00 C ATOM 2088 NZ LYS A 135 -10.311 -7.800 14.189 1.00 0.00 N ATOM 0 H LYS A 135 -7.225 -10.792 12.028 1.00 0.00 H new ATOM 0 HA LYS A 135 -5.315 -10.549 14.238 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -7.816 -12.175 13.769 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -6.759 -12.423 15.144 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -8.459 -11.015 15.962 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -7.103 -9.938 15.693 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -8.082 -9.284 13.483 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -9.452 -10.332 13.793 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -9.936 -9.010 15.886 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -8.627 -7.923 15.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -10.754 -7.048 14.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -9.780 -7.374 13.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -11.049 -8.427 13.809 1.00 0.00 H new ATOM 2102 N PRO A 136 -3.969 -12.677 13.860 1.00 0.00 N ATOM 2103 CA PRO A 136 -2.978 -13.688 13.452 1.00 0.00 C ATOM 2104 C PRO A 136 -3.482 -15.121 13.599 1.00 0.00 C ATOM 2105 O PRO A 136 -2.908 -15.923 14.341 1.00 0.00 O ATOM 2106 CB PRO A 136 -1.821 -13.435 14.415 1.00 0.00 C ATOM 2107 CG PRO A 136 -2.466 -12.886 15.639 1.00 0.00 C ATOM 2108 CD PRO A 136 -3.621 -12.059 15.154 1.00 0.00 C ATOM 0 HA PRO A 136 -2.721 -13.597 12.397 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -1.277 -14.354 14.632 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -1.102 -12.731 13.995 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -2.806 -13.687 16.295 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -1.765 -12.280 16.213 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -4.458 -12.091 15.852 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -3.343 -11.012 15.037 1.00 0.00 H new ATOM 2116 N HIS A 137 -4.542 -15.443 12.879 1.00 0.00 N ATOM 2117 CA HIS A 137 -5.141 -16.764 12.948 1.00 0.00 C ATOM 2118 C HIS A 137 -6.135 -16.935 11.806 1.00 0.00 C ATOM 2119 O HIS A 137 -6.069 -17.900 11.051 1.00 0.00 O ATOM 2120 CB HIS A 137 -5.848 -16.935 14.297 1.00 0.00 C ATOM 2121 CG HIS A 137 -6.050 -18.356 14.722 1.00 0.00 C ATOM 2122 ND1 HIS A 137 -7.212 -19.058 14.501 1.00 0.00 N ATOM 2123 CD2 HIS A 137 -5.234 -19.192 15.402 1.00 0.00 C ATOM 2124 CE1 HIS A 137 -7.104 -20.261 15.034 1.00 0.00 C ATOM 2125 NE2 HIS A 137 -5.912 -20.370 15.587 1.00 0.00 N ATOM 0 H HIS A 137 -5.008 -14.803 12.236 1.00 0.00 H new ATOM 0 HA HIS A 137 -4.365 -17.523 12.856 1.00 0.00 H new ATOM 0 HB2 HIS A 137 -5.269 -16.420 15.063 1.00 0.00 H new ATOM 0 HB3 HIS A 137 -6.820 -16.443 14.247 1.00 0.00 H new ATOM 0 HD2 HIS A 137 -4.231 -18.973 15.738 1.00 0.00 H new ATOM 0 HE1 HIS A 137 -7.865 -21.028 15.019 1.00 0.00 H new ATOM 0 HE2 HIS A 137 -5.554 -21.193 16.072 1.00 0.00 H new ATOM 2134 N GLN A 138 -7.029 -15.962 11.678 1.00 0.00 N ATOM 2135 CA GLN A 138 -8.121 -16.016 10.712 1.00 0.00 C ATOM 2136 C GLN A 138 -7.621 -15.984 9.264 1.00 0.00 C ATOM 2137 O GLN A 138 -7.723 -16.979 8.552 1.00 0.00 O ATOM 2138 CB GLN A 138 -9.081 -14.847 10.961 1.00 0.00 C ATOM 2139 CG GLN A 138 -10.412 -14.992 10.248 1.00 0.00 C ATOM 2140 CD GLN A 138 -11.198 -16.194 10.733 1.00 0.00 C ATOM 2141 OE1 GLN A 138 -11.125 -16.569 11.908 1.00 0.00 O ATOM 2142 NE2 GLN A 138 -11.921 -16.829 9.829 1.00 0.00 N ATOM 0 H GLN A 138 -7.018 -15.112 12.242 1.00 0.00 H new ATOM 0 HA GLN A 138 -8.640 -16.965 10.851 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -9.260 -14.757 12.032 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -8.604 -13.921 10.638 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -11.003 -14.089 10.400 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -10.239 -15.083 9.176 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -11.954 -16.486 8.869 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -12.447 -17.663 10.090 1.00 0.00 H new ATOM 2151 N LEU A 139 -7.069 -14.843 8.846 1.00 0.00 N ATOM 2152 CA LEU A 139 -6.654 -14.635 7.452 1.00 0.00 C ATOM 2153 C LEU A 139 -5.740 -15.748 6.965 1.00 0.00 C ATOM 2154 O LEU A 139 -5.876 -16.231 5.841 1.00 0.00 O ATOM 2155 CB LEU A 139 -5.934 -13.291 7.314 1.00 0.00 C ATOM 2156 CG LEU A 139 -5.481 -12.929 5.895 1.00 0.00 C ATOM 2157 CD1 LEU A 139 -6.681 -12.742 4.980 1.00 0.00 C ATOM 2158 CD2 LEU A 139 -4.617 -11.675 5.912 1.00 0.00 C ATOM 0 H LEU A 139 -6.897 -14.043 9.455 1.00 0.00 H new ATOM 0 HA LEU A 139 -7.554 -14.640 6.838 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -6.596 -12.505 7.677 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -5.060 -13.298 7.965 1.00 0.00 H new ATOM 0 HG LEU A 139 -4.881 -13.752 5.507 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.338 -12.486 3.978 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -7.256 -13.667 4.941 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -7.310 -11.939 5.365 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -4.305 -11.434 4.896 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -5.190 -10.844 6.322 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -3.736 -11.848 6.530 1.00 0.00 H new ATOM 2170 N GLU A 140 -4.818 -16.148 7.823 1.00 0.00 N ATOM 2171 CA GLU A 140 -3.859 -17.187 7.494 1.00 0.00 C ATOM 2172 C GLU A 140 -4.565 -18.505 7.171 1.00 0.00 C ATOM 2173 O GLU A 140 -4.098 -19.280 6.335 1.00 0.00 O ATOM 2174 CB GLU A 140 -2.856 -17.345 8.637 1.00 0.00 C ATOM 2175 CG GLU A 140 -2.019 -16.092 8.860 1.00 0.00 C ATOM 2176 CD GLU A 140 -1.040 -16.221 10.009 1.00 0.00 C ATOM 2177 OE1 GLU A 140 -0.164 -17.110 9.953 1.00 0.00 O ATOM 2178 OE2 GLU A 140 -1.133 -15.426 10.967 1.00 0.00 O ATOM 0 H GLU A 140 -4.713 -15.764 8.762 1.00 0.00 H new ATOM 0 HA GLU A 140 -3.312 -16.894 6.598 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.392 -17.587 9.555 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -2.196 -18.185 8.422 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -1.469 -15.864 7.947 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -2.683 -15.249 9.051 1.00 0.00 H new ATOM 2185 N GLN A 141 -5.694 -18.751 7.829 1.00 0.00 N ATOM 2186 CA GLN A 141 -6.497 -19.929 7.542 1.00 0.00 C ATOM 2187 C GLN A 141 -7.210 -19.793 6.201 1.00 0.00 C ATOM 2188 O GLN A 141 -7.198 -20.728 5.404 1.00 0.00 O ATOM 2189 CB GLN A 141 -7.499 -20.197 8.654 1.00 0.00 C ATOM 2190 CG GLN A 141 -6.854 -20.736 9.920 1.00 0.00 C ATOM 2191 CD GLN A 141 -7.860 -21.081 11.000 1.00 0.00 C ATOM 2192 OE1 GLN A 141 -7.565 -20.988 12.188 1.00 0.00 O ATOM 2193 NE2 GLN A 141 -9.049 -21.497 10.601 1.00 0.00 N ATOM 0 H GLN A 141 -6.071 -18.150 8.562 1.00 0.00 H new ATOM 0 HA GLN A 141 -5.820 -20.781 7.484 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -8.029 -19.274 8.888 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -8.243 -20.911 8.300 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -6.274 -21.626 9.675 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.154 -19.996 10.307 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -9.259 -21.562 9.605 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -9.757 -21.753 11.289 1.00 0.00 H new ATOM 2202 N GLU A 142 -7.820 -18.632 5.942 1.00 0.00 N ATOM 2203 CA GLU A 142 -8.431 -18.369 4.646 1.00 0.00 C ATOM 2204 C GLU A 142 -7.433 -18.580 3.513 1.00 0.00 C ATOM 2205 O GLU A 142 -7.773 -19.143 2.469 1.00 0.00 O ATOM 2206 CB GLU A 142 -8.962 -16.943 4.586 1.00 0.00 C ATOM 2207 CG GLU A 142 -10.340 -16.758 5.191 1.00 0.00 C ATOM 2208 CD GLU A 142 -10.392 -16.973 6.684 1.00 0.00 C ATOM 2209 OE1 GLU A 142 -10.624 -18.116 7.122 1.00 0.00 O ATOM 2210 OE2 GLU A 142 -10.245 -15.981 7.421 1.00 0.00 O ATOM 0 H GLU A 142 -7.901 -17.867 6.612 1.00 0.00 H new ATOM 0 HA GLU A 142 -9.256 -19.071 4.524 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -8.262 -16.286 5.102 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -8.991 -16.623 3.544 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -10.691 -15.750 4.967 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -11.032 -17.450 4.711 1.00 0.00 H new ATOM 2217 N ILE A 143 -6.204 -18.116 3.721 1.00 0.00 N ATOM 2218 CA ILE A 143 -5.125 -18.334 2.759 1.00 0.00 C ATOM 2219 C ILE A 143 -4.930 -19.829 2.501 1.00 0.00 C ATOM 2220 O ILE A 143 -4.784 -20.265 1.357 1.00 0.00 O ATOM 2221 CB ILE A 143 -3.792 -17.716 3.248 1.00 0.00 C ATOM 2222 CG1 ILE A 143 -3.940 -16.202 3.425 1.00 0.00 C ATOM 2223 CG2 ILE A 143 -2.659 -18.030 2.276 1.00 0.00 C ATOM 2224 CD1 ILE A 143 -2.723 -15.535 4.031 1.00 0.00 C ATOM 0 H ILE A 143 -5.929 -17.586 4.548 1.00 0.00 H new ATOM 0 HA ILE A 143 -5.413 -17.840 1.831 1.00 0.00 H new ATOM 0 HB ILE A 143 -3.545 -18.158 4.213 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -4.144 -15.751 2.454 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -4.805 -16.003 4.058 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -1.733 -17.586 2.641 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -2.536 -19.110 2.197 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -2.897 -17.619 1.295 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -2.904 -14.464 4.125 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -2.529 -15.958 5.017 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -1.859 -15.702 3.388 1.00 0.00 H new ATOM 2236 N ALA A 144 -4.973 -20.615 3.571 1.00 0.00 N ATOM 2237 CA ALA A 144 -4.770 -22.057 3.479 1.00 0.00 C ATOM 2238 C ALA A 144 -5.938 -22.748 2.770 1.00 0.00 C ATOM 2239 O ALA A 144 -5.796 -23.863 2.267 1.00 0.00 O ATOM 2240 CB ALA A 144 -4.566 -22.647 4.867 1.00 0.00 C ATOM 0 H ALA A 144 -5.148 -20.276 4.517 1.00 0.00 H new ATOM 0 HA ALA A 144 -3.875 -22.231 2.882 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -4.416 -23.724 4.786 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -3.691 -22.192 5.331 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -5.445 -22.449 5.480 1.00 0.00 H new ATOM 2246 N GLN A 145 -7.088 -22.082 2.733 1.00 0.00 N ATOM 2247 CA GLN A 145 -8.273 -22.625 2.072 1.00 0.00 C ATOM 2248 C GLN A 145 -8.303 -22.233 0.596 1.00 0.00 C ATOM 2249 O GLN A 145 -9.288 -22.494 -0.095 1.00 0.00 O ATOM 2250 CB GLN A 145 -9.546 -22.122 2.761 1.00 0.00 C ATOM 2251 CG GLN A 145 -9.533 -22.303 4.267 1.00 0.00 C ATOM 2252 CD GLN A 145 -10.831 -21.869 4.918 1.00 0.00 C ATOM 2253 OE1 GLN A 145 -11.010 -20.700 5.245 1.00 0.00 O ATOM 2254 NE2 GLN A 145 -11.736 -22.809 5.130 1.00 0.00 N ATOM 0 H GLN A 145 -7.226 -21.163 3.154 1.00 0.00 H new ATOM 0 HA GLN A 145 -8.228 -23.712 2.145 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -9.680 -21.065 2.532 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -10.406 -22.649 2.347 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -9.346 -23.351 4.502 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -8.709 -21.729 4.691 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -11.550 -23.770 4.843 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -12.620 -22.573 5.580 1.00 0.00 H new ATOM 2263 N ASN A 146 -7.221 -21.601 0.131 1.00 0.00 N ATOM 2264 CA ASN A 146 -7.108 -21.124 -1.250 1.00 0.00 C ATOM 2265 C ASN A 146 -8.053 -19.959 -1.510 1.00 0.00 C ATOM 2266 O ASN A 146 -8.271 -19.571 -2.656 1.00 0.00 O ATOM 2267 CB ASN A 146 -7.379 -22.241 -2.265 1.00 0.00 C ATOM 2268 CG ASN A 146 -6.228 -23.214 -2.415 1.00 0.00 C ATOM 2269 OD1 ASN A 146 -6.159 -24.230 -1.723 1.00 0.00 O ATOM 2270 ND2 ASN A 146 -5.322 -22.919 -3.334 1.00 0.00 N ATOM 0 H ASN A 146 -6.399 -21.406 0.702 1.00 0.00 H new ATOM 0 HA ASN A 146 -6.080 -20.785 -1.379 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -8.270 -22.789 -1.960 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -7.596 -21.794 -3.235 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -4.531 -23.544 -3.489 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -5.415 -22.067 -3.887 1.00 0.00 H new ATOM 2277 N TYR A 147 -8.601 -19.391 -0.444 1.00 0.00 N ATOM 2278 CA TYR A 147 -9.503 -18.256 -0.577 1.00 0.00 C ATOM 2279 C TYR A 147 -8.679 -16.983 -0.737 1.00 0.00 C ATOM 2280 O TYR A 147 -9.150 -15.967 -1.250 1.00 0.00 O ATOM 2281 CB TYR A 147 -10.427 -18.162 0.640 1.00 0.00 C ATOM 2282 CG TYR A 147 -11.757 -17.512 0.335 1.00 0.00 C ATOM 2283 CD1 TYR A 147 -12.675 -18.147 -0.490 1.00 0.00 C ATOM 2284 CD2 TYR A 147 -12.093 -16.272 0.862 1.00 0.00 C ATOM 2285 CE1 TYR A 147 -13.892 -17.566 -0.784 1.00 0.00 C ATOM 2286 CE2 TYR A 147 -13.311 -15.684 0.574 1.00 0.00 C ATOM 2287 CZ TYR A 147 -14.205 -16.335 -0.250 1.00 0.00 C ATOM 2288 OH TYR A 147 -15.419 -15.754 -0.538 1.00 0.00 O ATOM 0 H TYR A 147 -8.438 -19.695 0.516 1.00 0.00 H new ATOM 0 HA TYR A 147 -10.131 -18.388 -1.458 1.00 0.00 H new ATOM 0 HB2 TYR A 147 -10.602 -19.164 1.032 1.00 0.00 H new ATOM 0 HB3 TYR A 147 -9.926 -17.596 1.425 1.00 0.00 H new ATOM 0 HD1 TYR A 147 -12.433 -19.112 -0.909 1.00 0.00 H new ATOM 0 HD2 TYR A 147 -11.393 -15.760 1.506 1.00 0.00 H new ATOM 0 HE1 TYR A 147 -14.595 -18.073 -1.429 1.00 0.00 H new ATOM 0 HE2 TYR A 147 -13.561 -14.720 0.992 1.00 0.00 H new ATOM 0 HH TYR A 147 -15.484 -14.889 -0.083 1.00 0.00 H new ATOM 2298 N TRP A 148 -7.438 -17.066 -0.283 1.00 0.00 N ATOM 2299 CA TRP A 148 -6.450 -16.021 -0.490 1.00 0.00 C ATOM 2300 C TRP A 148 -5.152 -16.658 -0.961 1.00 0.00 C ATOM 2301 O TRP A 148 -4.692 -17.633 -0.369 1.00 0.00 O ATOM 2302 CB TRP A 148 -6.181 -15.240 0.802 1.00 0.00 C ATOM 2303 CG TRP A 148 -7.328 -14.404 1.284 1.00 0.00 C ATOM 2304 CD1 TRP A 148 -8.238 -14.737 2.243 1.00 0.00 C ATOM 2305 CD2 TRP A 148 -7.675 -13.087 0.843 1.00 0.00 C ATOM 2306 NE1 TRP A 148 -9.127 -13.707 2.431 1.00 0.00 N ATOM 2307 CE2 TRP A 148 -8.807 -12.684 1.579 1.00 0.00 C ATOM 2308 CE3 TRP A 148 -7.143 -12.210 -0.105 1.00 0.00 C ATOM 2309 CZ2 TRP A 148 -9.407 -11.441 1.400 1.00 0.00 C ATOM 2310 CZ3 TRP A 148 -7.740 -10.978 -0.281 1.00 0.00 C ATOM 2311 CH2 TRP A 148 -8.864 -10.603 0.466 1.00 0.00 C ATOM 0 H TRP A 148 -7.087 -17.866 0.243 1.00 0.00 H new ATOM 0 HA TRP A 148 -6.836 -15.326 -1.236 1.00 0.00 H new ATOM 0 HB2 TRP A 148 -5.910 -15.946 1.587 1.00 0.00 H new ATOM 0 HB3 TRP A 148 -5.319 -14.592 0.645 1.00 0.00 H new ATOM 0 HD1 TRP A 148 -8.257 -15.675 2.778 1.00 0.00 H new ATOM 0 HE1 TRP A 148 -9.900 -13.705 3.097 1.00 0.00 H new ATOM 0 HE3 TRP A 148 -6.280 -12.491 -0.690 1.00 0.00 H new ATOM 0 HZ2 TRP A 148 -10.271 -11.149 1.978 1.00 0.00 H new ATOM 0 HZ3 TRP A 148 -7.333 -10.291 -1.008 1.00 0.00 H new ATOM 0 HH2 TRP A 148 -9.310 -9.633 0.301 1.00 0.00 H new ATOM 2322 N LEU A 149 -4.566 -16.132 -2.023 1.00 0.00 N ATOM 2323 CA LEU A 149 -3.287 -16.641 -2.493 1.00 0.00 C ATOM 2324 C LEU A 149 -2.165 -15.793 -1.926 1.00 0.00 C ATOM 2325 O LEU A 149 -2.372 -14.631 -1.591 1.00 0.00 O ATOM 2326 CB LEU A 149 -3.230 -16.656 -4.020 1.00 0.00 C ATOM 2327 CG LEU A 149 -4.169 -17.658 -4.687 1.00 0.00 C ATOM 2328 CD1 LEU A 149 -4.172 -17.464 -6.196 1.00 0.00 C ATOM 2329 CD2 LEU A 149 -3.766 -19.084 -4.334 1.00 0.00 C ATOM 0 H LEU A 149 -4.949 -15.362 -2.571 1.00 0.00 H new ATOM 0 HA LEU A 149 -3.170 -17.668 -2.148 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -3.466 -15.658 -4.388 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -2.208 -16.876 -4.329 1.00 0.00 H new ATOM 0 HG LEU A 149 -5.179 -17.483 -4.315 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -4.847 -18.187 -6.654 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -4.507 -16.454 -6.432 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -3.164 -17.612 -6.584 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -4.446 -19.785 -4.818 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -2.748 -19.270 -4.677 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -3.815 -19.219 -3.253 1.00 0.00 H new ATOM 2341 N LEU A 150 -0.986 -16.368 -1.822 1.00 0.00 N ATOM 2342 CA LEU A 150 0.133 -15.684 -1.189 1.00 0.00 C ATOM 2343 C LEU A 150 1.357 -15.684 -2.095 1.00 0.00 C ATOM 2344 O LEU A 150 1.696 -16.703 -2.695 1.00 0.00 O ATOM 2345 CB LEU A 150 0.466 -16.355 0.148 1.00 0.00 C ATOM 2346 CG LEU A 150 1.588 -15.694 0.956 1.00 0.00 C ATOM 2347 CD1 LEU A 150 1.193 -14.286 1.378 1.00 0.00 C ATOM 2348 CD2 LEU A 150 1.934 -16.541 2.173 1.00 0.00 C ATOM 0 H LEU A 150 -0.773 -17.305 -2.165 1.00 0.00 H new ATOM 0 HA LEU A 150 -0.155 -14.648 -1.010 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -0.436 -16.374 0.760 1.00 0.00 H new ATOM 0 HB3 LEU A 150 0.743 -17.392 -0.044 1.00 0.00 H new ATOM 0 HG LEU A 150 2.471 -15.622 0.321 1.00 0.00 H new ATOM 0 HD11 LEU A 150 2.005 -13.836 1.950 1.00 0.00 H new ATOM 0 HD12 LEU A 150 0.996 -13.682 0.492 1.00 0.00 H new ATOM 0 HD13 LEU A 150 0.295 -14.329 1.994 1.00 0.00 H new ATOM 0 HD21 LEU A 150 2.732 -16.059 2.737 1.00 0.00 H new ATOM 0 HD22 LEU A 150 1.053 -16.644 2.807 1.00 0.00 H new ATOM 0 HD23 LEU A 150 2.264 -17.527 1.848 1.00 0.00 H new ATOM 2360 N SER A 151 2.003 -14.534 -2.192 1.00 0.00 N ATOM 2361 CA SER A 151 3.234 -14.394 -2.951 1.00 0.00 C ATOM 2362 C SER A 151 4.182 -13.465 -2.193 1.00 0.00 C ATOM 2363 O SER A 151 3.819 -12.923 -1.147 1.00 0.00 O ATOM 2364 CB SER A 151 2.935 -13.849 -4.352 1.00 0.00 C ATOM 2365 OG SER A 151 4.094 -13.855 -5.171 1.00 0.00 O ATOM 0 H SER A 151 1.689 -13.672 -1.747 1.00 0.00 H new ATOM 0 HA SER A 151 3.708 -15.368 -3.068 1.00 0.00 H new ATOM 0 HB2 SER A 151 2.155 -14.451 -4.819 1.00 0.00 H new ATOM 0 HB3 SER A 151 2.549 -12.833 -4.273 1.00 0.00 H new ATOM 0 HG SER A 151 3.870 -13.503 -6.058 1.00 0.00 H new ATOM 2371 N GLU A 152 5.387 -13.273 -2.711 1.00 0.00 N ATOM 2372 CA GLU A 152 6.392 -12.479 -2.016 1.00 0.00 C ATOM 2373 C GLU A 152 6.920 -11.367 -2.912 1.00 0.00 C ATOM 2374 O GLU A 152 6.904 -11.489 -4.139 1.00 0.00 O ATOM 2375 CB GLU A 152 7.549 -13.374 -1.568 1.00 0.00 C ATOM 2376 CG GLU A 152 7.102 -14.598 -0.787 1.00 0.00 C ATOM 2377 CD GLU A 152 8.263 -15.424 -0.283 1.00 0.00 C ATOM 2378 OE1 GLU A 152 8.844 -16.193 -1.076 1.00 0.00 O ATOM 2379 OE2 GLU A 152 8.600 -15.307 0.910 1.00 0.00 O ATOM 0 H GLU A 152 5.692 -13.654 -3.606 1.00 0.00 H new ATOM 0 HA GLU A 152 5.924 -12.027 -1.142 1.00 0.00 H new ATOM 0 HB2 GLU A 152 8.108 -13.697 -2.446 1.00 0.00 H new ATOM 0 HB3 GLU A 152 8.232 -12.790 -0.952 1.00 0.00 H new ATOM 0 HG2 GLU A 152 6.492 -14.281 0.059 1.00 0.00 H new ATOM 0 HG3 GLU A 152 6.469 -15.218 -1.422 1.00 0.00 H new ATOM 2386 N ALA A 153 7.394 -10.295 -2.295 1.00 0.00 N ATOM 2387 CA ALA A 153 7.944 -9.165 -3.026 1.00 0.00 C ATOM 2388 C ALA A 153 9.186 -8.645 -2.320 1.00 0.00 C ATOM 2389 O ALA A 153 9.142 -8.302 -1.140 1.00 0.00 O ATOM 2390 CB ALA A 153 6.907 -8.061 -3.159 1.00 0.00 C ATOM 0 H ALA A 153 7.408 -10.185 -1.281 1.00 0.00 H new ATOM 0 HA ALA A 153 8.221 -9.496 -4.027 1.00 0.00 H new ATOM 0 HB1 ALA A 153 7.336 -7.223 -3.709 1.00 0.00 H new ATOM 0 HB2 ALA A 153 6.038 -8.441 -3.696 1.00 0.00 H new ATOM 0 HB3 ALA A 153 6.603 -7.726 -2.167 1.00 0.00 H new ATOM 2396 N ASN A 154 10.291 -8.587 -3.040 1.00 0.00 N ATOM 2397 CA ASN A 154 11.554 -8.190 -2.437 1.00 0.00 C ATOM 2398 C ASN A 154 11.748 -6.683 -2.514 1.00 0.00 C ATOM 2399 O ASN A 154 12.138 -6.050 -1.531 1.00 0.00 O ATOM 2400 CB ASN A 154 12.733 -8.906 -3.105 1.00 0.00 C ATOM 2401 CG ASN A 154 12.731 -10.406 -2.856 1.00 0.00 C ATOM 2402 OD1 ASN A 154 11.679 -11.035 -2.756 1.00 0.00 O ATOM 2403 ND2 ASN A 154 13.913 -10.988 -2.746 1.00 0.00 N ATOM 0 H ASN A 154 10.342 -8.807 -4.035 1.00 0.00 H new ATOM 0 HA ASN A 154 11.521 -8.482 -1.387 1.00 0.00 H new ATOM 0 HB2 ASN A 154 12.703 -8.721 -4.179 1.00 0.00 H new ATOM 0 HB3 ASN A 154 13.666 -8.482 -2.734 1.00 0.00 H new ATOM 0 HD21 ASN A 154 13.973 -11.991 -2.572 1.00 0.00 H new ATOM 0 HD22 ASN A 154 14.765 -10.434 -2.835 1.00 0.00 H new ATOM 2410 N ASN A 155 11.466 -6.109 -3.679 1.00 0.00 N ATOM 2411 CA ASN A 155 11.650 -4.675 -3.887 1.00 0.00 C ATOM 2412 C ASN A 155 11.086 -4.252 -5.237 1.00 0.00 C ATOM 2413 O ASN A 155 10.166 -3.437 -5.308 1.00 0.00 O ATOM 2414 CB ASN A 155 13.142 -4.319 -3.825 1.00 0.00 C ATOM 2415 CG ASN A 155 13.407 -2.826 -3.715 1.00 0.00 C ATOM 2416 OD1 ASN A 155 12.619 -1.999 -4.166 1.00 0.00 O ATOM 2417 ND2 ASN A 155 14.536 -2.475 -3.120 1.00 0.00 N ATOM 0 H ASN A 155 11.110 -6.612 -4.492 1.00 0.00 H new ATOM 0 HA ASN A 155 11.116 -4.145 -3.098 1.00 0.00 H new ATOM 0 HB2 ASN A 155 13.592 -4.823 -2.970 1.00 0.00 H new ATOM 0 HB3 ASN A 155 13.636 -4.702 -4.718 1.00 0.00 H new ATOM 0 HD21 ASN A 155 14.776 -1.488 -3.024 1.00 0.00 H new ATOM 0 HD22 ASN A 155 15.166 -3.191 -2.758 1.00 0.00 H new ATOM 2424 N GLN A 156 11.631 -4.838 -6.299 1.00 0.00 N ATOM 2425 CA GLN A 156 11.319 -4.423 -7.664 1.00 0.00 C ATOM 2426 C GLN A 156 9.821 -4.422 -7.941 1.00 0.00 C ATOM 2427 O GLN A 156 9.285 -3.442 -8.440 1.00 0.00 O ATOM 2428 CB GLN A 156 12.029 -5.324 -8.673 1.00 0.00 C ATOM 2429 CG GLN A 156 13.538 -5.343 -8.514 1.00 0.00 C ATOM 2430 CD GLN A 156 14.234 -6.076 -9.644 1.00 0.00 C ATOM 2431 OE1 GLN A 156 14.446 -7.290 -9.582 1.00 0.00 O ATOM 2432 NE2 GLN A 156 14.602 -5.343 -10.679 1.00 0.00 N ATOM 0 H GLN A 156 12.297 -5.608 -6.240 1.00 0.00 H new ATOM 0 HA GLN A 156 11.677 -3.399 -7.772 1.00 0.00 H new ATOM 0 HB2 GLN A 156 11.648 -6.340 -8.571 1.00 0.00 H new ATOM 0 HB3 GLN A 156 11.782 -4.991 -9.681 1.00 0.00 H new ATOM 0 HG2 GLN A 156 13.908 -4.319 -8.468 1.00 0.00 H new ATOM 0 HG3 GLN A 156 13.794 -5.817 -7.566 1.00 0.00 H new ATOM 0 HE21 GLN A 156 14.407 -4.342 -10.690 1.00 0.00 H new ATOM 0 HE22 GLN A 156 15.081 -5.778 -11.467 1.00 0.00 H new ATOM 2441 N THR A 157 9.153 -5.510 -7.591 1.00 0.00 N ATOM 2442 CA THR A 157 7.731 -5.674 -7.880 1.00 0.00 C ATOM 2443 C THR A 157 6.884 -4.568 -7.235 1.00 0.00 C ATOM 2444 O THR A 157 5.812 -4.225 -7.730 1.00 0.00 O ATOM 2445 CB THR A 157 7.244 -7.051 -7.395 1.00 0.00 C ATOM 2446 OG1 THR A 157 8.195 -8.055 -7.782 1.00 0.00 O ATOM 2447 CG2 THR A 157 5.882 -7.389 -7.983 1.00 0.00 C ATOM 0 H THR A 157 9.574 -6.300 -7.102 1.00 0.00 H new ATOM 0 HA THR A 157 7.609 -5.602 -8.961 1.00 0.00 H new ATOM 0 HB THR A 157 7.151 -7.021 -6.309 1.00 0.00 H new ATOM 0 HG1 THR A 157 7.888 -8.933 -7.473 1.00 0.00 H new ATOM 0 HG21 THR A 157 5.563 -8.367 -7.623 1.00 0.00 H new ATOM 0 HG22 THR A 157 5.156 -6.635 -7.677 1.00 0.00 H new ATOM 0 HG23 THR A 157 5.950 -7.407 -9.071 1.00 0.00 H new ATOM 2455 N LEU A 158 7.365 -4.028 -6.123 1.00 0.00 N ATOM 2456 CA LEU A 158 6.620 -3.020 -5.382 1.00 0.00 C ATOM 2457 C LEU A 158 6.932 -1.605 -5.866 1.00 0.00 C ATOM 2458 O LEU A 158 6.024 -0.843 -6.195 1.00 0.00 O ATOM 2459 CB LEU A 158 6.934 -3.126 -3.890 1.00 0.00 C ATOM 2460 CG LEU A 158 6.505 -4.432 -3.221 1.00 0.00 C ATOM 2461 CD1 LEU A 158 6.951 -4.456 -1.765 1.00 0.00 C ATOM 2462 CD2 LEU A 158 4.997 -4.609 -3.320 1.00 0.00 C ATOM 0 H LEU A 158 8.268 -4.271 -5.715 1.00 0.00 H new ATOM 0 HA LEU A 158 5.561 -3.209 -5.555 1.00 0.00 H new ATOM 0 HB2 LEU A 158 8.008 -3.003 -3.752 1.00 0.00 H new ATOM 0 HB3 LEU A 158 6.449 -2.297 -3.374 1.00 0.00 H new ATOM 0 HG LEU A 158 6.984 -5.261 -3.741 1.00 0.00 H new ATOM 0 HD11 LEU A 158 6.637 -5.393 -1.304 1.00 0.00 H new ATOM 0 HD12 LEU A 158 8.037 -4.373 -1.716 1.00 0.00 H new ATOM 0 HD13 LEU A 158 6.498 -3.620 -1.232 1.00 0.00 H new ATOM 0 HD21 LEU A 158 4.708 -5.543 -2.839 1.00 0.00 H new ATOM 0 HD22 LEU A 158 4.500 -3.776 -2.823 1.00 0.00 H new ATOM 0 HD23 LEU A 158 4.702 -4.634 -4.369 1.00 0.00 H new ATOM 2474 N PHE A 159 8.213 -1.242 -5.897 1.00 0.00 N ATOM 2475 CA PHE A 159 8.582 0.146 -6.154 1.00 0.00 C ATOM 2476 C PHE A 159 9.585 0.318 -7.288 1.00 0.00 C ATOM 2477 O PHE A 159 10.143 1.401 -7.457 1.00 0.00 O ATOM 2478 CB PHE A 159 9.123 0.796 -4.881 1.00 0.00 C ATOM 2479 CG PHE A 159 8.039 1.281 -3.962 1.00 0.00 C ATOM 2480 CD1 PHE A 159 7.416 0.416 -3.078 1.00 0.00 C ATOM 2481 CD2 PHE A 159 7.638 2.605 -3.990 1.00 0.00 C ATOM 2482 CE1 PHE A 159 6.415 0.862 -2.240 1.00 0.00 C ATOM 2483 CE2 PHE A 159 6.638 3.057 -3.154 1.00 0.00 C ATOM 2484 CZ PHE A 159 6.025 2.185 -2.279 1.00 0.00 C ATOM 0 H PHE A 159 8.998 -1.876 -5.750 1.00 0.00 H new ATOM 0 HA PHE A 159 7.667 0.644 -6.473 1.00 0.00 H new ATOM 0 HB2 PHE A 159 9.747 0.077 -4.350 1.00 0.00 H new ATOM 0 HB3 PHE A 159 9.764 1.635 -5.152 1.00 0.00 H new ATOM 0 HD1 PHE A 159 7.718 -0.621 -3.044 1.00 0.00 H new ATOM 0 HD2 PHE A 159 8.113 3.292 -4.674 1.00 0.00 H new ATOM 0 HE1 PHE A 159 5.938 0.177 -1.555 1.00 0.00 H new ATOM 0 HE2 PHE A 159 6.335 4.093 -3.185 1.00 0.00 H new ATOM 0 HZ PHE A 159 5.241 2.537 -1.625 1.00 0.00 H new ATOM 2494 N GLU A 160 9.817 -0.716 -8.076 1.00 0.00 N ATOM 2495 CA GLU A 160 10.612 -0.548 -9.286 1.00 0.00 C ATOM 2496 C GLU A 160 9.694 -0.686 -10.489 1.00 0.00 C ATOM 2497 O GLU A 160 9.667 0.169 -11.374 1.00 0.00 O ATOM 2498 CB GLU A 160 11.766 -1.553 -9.371 1.00 0.00 C ATOM 2499 CG GLU A 160 12.883 -1.093 -10.292 1.00 0.00 C ATOM 2500 CD GLU A 160 14.050 -2.050 -10.321 1.00 0.00 C ATOM 2501 OE1 GLU A 160 14.885 -2.017 -9.390 1.00 0.00 O ATOM 2502 OE2 GLU A 160 14.148 -2.833 -11.284 1.00 0.00 O ATOM 0 H GLU A 160 9.476 -1.663 -7.909 1.00 0.00 H new ATOM 0 HA GLU A 160 11.068 0.442 -9.267 1.00 0.00 H new ATOM 0 HB2 GLU A 160 12.170 -1.720 -8.373 1.00 0.00 H new ATOM 0 HB3 GLU A 160 11.382 -2.510 -9.723 1.00 0.00 H new ATOM 0 HG2 GLU A 160 12.490 -0.976 -11.302 1.00 0.00 H new ATOM 0 HG3 GLU A 160 13.232 -0.112 -9.970 1.00 0.00 H new ATOM 2509 N THR A 161 8.929 -1.763 -10.500 1.00 0.00 N ATOM 2510 CA THR A 161 7.874 -1.949 -11.470 1.00 0.00 C ATOM 2511 C THR A 161 6.545 -1.581 -10.823 1.00 0.00 C ATOM 2512 O THR A 161 6.350 -1.815 -9.632 1.00 0.00 O ATOM 2513 CB THR A 161 7.835 -3.404 -11.983 1.00 0.00 C ATOM 2514 OG1 THR A 161 7.903 -4.319 -10.882 1.00 0.00 O ATOM 2515 CG2 THR A 161 8.989 -3.677 -12.934 1.00 0.00 C ATOM 0 H THR A 161 9.025 -2.531 -9.835 1.00 0.00 H new ATOM 0 HA THR A 161 8.063 -1.305 -12.329 1.00 0.00 H new ATOM 0 HB THR A 161 6.896 -3.545 -12.519 1.00 0.00 H new ATOM 0 HG1 THR A 161 7.250 -5.038 -11.013 1.00 0.00 H new ATOM 0 HG21 THR A 161 8.938 -4.709 -13.281 1.00 0.00 H new ATOM 0 HG22 THR A 161 8.923 -3.003 -13.788 1.00 0.00 H new ATOM 0 HG23 THR A 161 9.934 -3.515 -12.416 1.00 0.00 H new ATOM 2634 N VAL A 168 0.239 -5.175 -13.202 1.00 0.00 N ATOM 2635 CA VAL A 168 -0.034 -6.233 -12.229 1.00 0.00 C ATOM 2636 C VAL A 168 0.759 -7.505 -12.546 1.00 0.00 C ATOM 2637 O VAL A 168 0.299 -8.381 -13.273 1.00 0.00 O ATOM 2638 CB VAL A 168 -1.544 -6.565 -12.139 1.00 0.00 C ATOM 2639 CG1 VAL A 168 -1.808 -7.616 -11.067 1.00 0.00 C ATOM 2640 CG2 VAL A 168 -2.355 -5.306 -11.860 1.00 0.00 C ATOM 0 HA VAL A 168 0.288 -5.850 -11.261 1.00 0.00 H new ATOM 0 HB VAL A 168 -1.857 -6.973 -13.100 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -2.876 -7.831 -11.024 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -1.263 -8.528 -11.310 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -1.474 -7.241 -10.100 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -3.413 -5.561 -11.800 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -2.033 -4.868 -10.915 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -2.199 -4.587 -12.665 1.00 0.00 H new ATOM 2650 N GLU A 169 1.962 -7.594 -11.996 1.00 0.00 N ATOM 2651 CA GLU A 169 2.818 -8.759 -12.199 1.00 0.00 C ATOM 2652 C GLU A 169 2.414 -9.914 -11.290 1.00 0.00 C ATOM 2653 O GLU A 169 3.007 -10.985 -11.353 1.00 0.00 O ATOM 2654 CB GLU A 169 4.281 -8.411 -11.939 1.00 0.00 C ATOM 2655 CG GLU A 169 4.854 -7.392 -12.904 1.00 0.00 C ATOM 2656 CD GLU A 169 6.322 -7.136 -12.653 1.00 0.00 C ATOM 2657 OE1 GLU A 169 6.640 -6.395 -11.708 1.00 0.00 O ATOM 2658 OE2 GLU A 169 7.166 -7.688 -13.394 1.00 0.00 O ATOM 0 H GLU A 169 2.370 -6.871 -11.403 1.00 0.00 H new ATOM 0 HA GLU A 169 2.695 -9.067 -13.237 1.00 0.00 H new ATOM 0 HB2 GLU A 169 4.378 -8.028 -10.923 1.00 0.00 H new ATOM 0 HB3 GLU A 169 4.876 -9.323 -11.994 1.00 0.00 H new ATOM 0 HG2 GLU A 169 4.717 -7.744 -13.926 1.00 0.00 H new ATOM 0 HG3 GLU A 169 4.302 -6.456 -12.813 1.00 0.00 H new ATOM 2665 N ALA A 170 1.415 -9.687 -10.446 1.00 0.00 N ATOM 2666 CA ALA A 170 1.031 -10.647 -9.411 1.00 0.00 C ATOM 2667 C ALA A 170 0.803 -12.054 -9.971 1.00 0.00 C ATOM 2668 O ALA A 170 1.198 -13.042 -9.354 1.00 0.00 O ATOM 2669 CB ALA A 170 -0.218 -10.163 -8.688 1.00 0.00 C ATOM 0 H ALA A 170 0.849 -8.838 -10.457 1.00 0.00 H new ATOM 0 HA ALA A 170 1.862 -10.712 -8.708 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -0.496 -10.884 -7.919 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -0.019 -9.197 -8.224 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -1.035 -10.061 -9.402 1.00 0.00 H new ATOM 2675 N ASN A 171 0.190 -12.145 -11.145 1.00 0.00 N ATOM 2676 CA ASN A 171 -0.089 -13.445 -11.751 1.00 0.00 C ATOM 2677 C ASN A 171 1.149 -13.999 -12.460 1.00 0.00 C ATOM 2678 O ASN A 171 1.420 -15.201 -12.411 1.00 0.00 O ATOM 2679 CB ASN A 171 -1.274 -13.352 -12.731 1.00 0.00 C ATOM 2680 CG ASN A 171 -1.012 -12.433 -13.917 1.00 0.00 C ATOM 2681 OD1 ASN A 171 -0.266 -11.461 -13.813 1.00 0.00 O ATOM 2682 ND2 ASN A 171 -1.632 -12.734 -15.049 1.00 0.00 N ATOM 0 H ASN A 171 -0.122 -11.344 -11.694 1.00 0.00 H new ATOM 0 HA ASN A 171 -0.359 -14.133 -10.950 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -1.509 -14.350 -13.100 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -2.153 -12.996 -12.193 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -1.498 -12.150 -15.875 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -2.243 -13.549 -15.095 1.00 0.00 H new ATOM 2689 N GLU A 172 1.911 -13.112 -13.087 1.00 0.00 N ATOM 2690 CA GLU A 172 3.074 -13.501 -13.877 1.00 0.00 C ATOM 2691 C GLU A 172 4.242 -13.890 -12.976 1.00 0.00 C ATOM 2692 O GLU A 172 4.968 -14.842 -13.256 1.00 0.00 O ATOM 2693 CB GLU A 172 3.469 -12.348 -14.808 1.00 0.00 C ATOM 2694 CG GLU A 172 3.679 -12.763 -16.257 1.00 0.00 C ATOM 2695 CD GLU A 172 4.911 -13.619 -16.455 1.00 0.00 C ATOM 2696 OE1 GLU A 172 6.012 -13.049 -16.607 1.00 0.00 O ATOM 2697 OE2 GLU A 172 4.784 -14.858 -16.474 1.00 0.00 O ATOM 0 H GLU A 172 1.742 -12.106 -13.063 1.00 0.00 H new ATOM 0 HA GLU A 172 2.816 -14.374 -14.477 1.00 0.00 H new ATOM 0 HB2 GLU A 172 2.694 -11.582 -14.769 1.00 0.00 H new ATOM 0 HB3 GLU A 172 4.386 -11.892 -14.435 1.00 0.00 H new ATOM 0 HG2 GLU A 172 2.803 -13.312 -16.602 1.00 0.00 H new ATOM 0 HG3 GLU A 172 3.761 -11.870 -16.877 1.00 0.00 H new ATOM 2704 N MET A 173 4.399 -13.164 -11.881 1.00 0.00 N ATOM 2705 CA MET A 173 5.447 -13.447 -10.907 1.00 0.00 C ATOM 2706 C MET A 173 5.224 -14.812 -10.272 1.00 0.00 C ATOM 2707 O MET A 173 6.167 -15.477 -9.835 1.00 0.00 O ATOM 2708 CB MET A 173 5.466 -12.369 -9.828 1.00 0.00 C ATOM 2709 CG MET A 173 6.673 -12.451 -8.911 1.00 0.00 C ATOM 2710 SD MET A 173 8.233 -12.249 -9.792 1.00 0.00 S ATOM 2711 CE MET A 173 9.404 -12.408 -8.447 1.00 0.00 C ATOM 0 H MET A 173 3.810 -12.367 -11.641 1.00 0.00 H new ATOM 0 HA MET A 173 6.408 -13.451 -11.422 1.00 0.00 H new ATOM 0 HB2 MET A 173 5.448 -11.389 -10.305 1.00 0.00 H new ATOM 0 HB3 MET A 173 4.559 -12.449 -9.229 1.00 0.00 H new ATOM 0 HG2 MET A 173 6.593 -11.682 -8.142 1.00 0.00 H new ATOM 0 HG3 MET A 173 6.671 -13.414 -8.400 1.00 0.00 H new ATOM 0 HE1 MET A 173 10.418 -12.306 -8.833 1.00 0.00 H new ATOM 0 HE2 MET A 173 9.217 -11.629 -7.708 1.00 0.00 H new ATOM 0 HE3 MET A 173 9.291 -13.386 -7.980 1.00 0.00 H new ATOM 2721 N LEU A 174 3.964 -15.217 -10.225 1.00 0.00 N ATOM 2722 CA LEU A 174 3.587 -16.489 -9.630 1.00 0.00 C ATOM 2723 C LEU A 174 3.857 -17.624 -10.606 1.00 0.00 C ATOM 2724 O LEU A 174 4.236 -18.727 -10.213 1.00 0.00 O ATOM 2725 CB LEU A 174 2.108 -16.477 -9.265 1.00 0.00 C ATOM 2726 CG LEU A 174 1.723 -17.431 -8.137 1.00 0.00 C ATOM 2727 CD1 LEU A 174 2.235 -16.912 -6.803 1.00 0.00 C ATOM 2728 CD2 LEU A 174 0.215 -17.636 -8.094 1.00 0.00 C ATOM 0 H LEU A 174 3.181 -14.678 -10.595 1.00 0.00 H new ATOM 0 HA LEU A 174 4.181 -16.641 -8.728 1.00 0.00 H new ATOM 0 HB2 LEU A 174 1.826 -15.464 -8.978 1.00 0.00 H new ATOM 0 HB3 LEU A 174 1.527 -16.730 -10.151 1.00 0.00 H new ATOM 0 HG LEU A 174 2.189 -18.397 -8.331 1.00 0.00 H new ATOM 0 HD11 LEU A 174 1.952 -17.604 -6.010 1.00 0.00 H new ATOM 0 HD12 LEU A 174 3.321 -16.826 -6.839 1.00 0.00 H new ATOM 0 HD13 LEU A 174 1.800 -15.933 -6.602 1.00 0.00 H new ATOM 0 HD21 LEU A 174 -0.036 -18.319 -7.283 1.00 0.00 H new ATOM 0 HD22 LEU A 174 -0.278 -16.678 -7.927 1.00 0.00 H new ATOM 0 HD23 LEU A 174 -0.122 -18.058 -9.041 1.00 0.00 H new ATOM 2740 N GLY A 175 3.653 -17.337 -11.881 1.00 0.00 N ATOM 2741 CA GLY A 175 3.861 -18.334 -12.913 1.00 0.00 C ATOM 2742 C GLY A 175 2.593 -18.626 -13.686 1.00 0.00 C ATOM 2743 O GLY A 175 2.555 -19.545 -14.504 1.00 0.00 O ATOM 0 H GLY A 175 3.345 -16.427 -12.223 1.00 0.00 H new ATOM 0 HA2 GLY A 175 4.633 -17.988 -13.601 1.00 0.00 H new ATOM 0 HA3 GLY A 175 4.228 -19.254 -12.459 1.00 0.00 H new