USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 759 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 70 MET CE :methyl 173:sc= 0 (180deg=-0.0232) USER MOD Set 1.2: A 74 ASN : amide:sc= -0.0833 K(o=-0.083,f=-0.66) USER MOD Set 2.1: A 66 ASN : amide:sc= 1.05 K(o=2,f=-5.1!) USER MOD Set 2.2: A 78 LYS NZ :NH3+ 164:sc= 0.924 (180deg=0) USER MOD Set 3.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc=-0.00237 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= 0.59 K(o=0.59,f=-4.6!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0.154 K(o=0.15,f=-0.74) USER MOD Single : A 102 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 107 HIS : no HD1:sc= -0.0588 X(o=-0.059,f=-0.15) USER MOD Single : A 108 MET CE :methyl 145:sc= -0.238 (180deg=-0.434) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 5:sc= 0.816 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot -2:sc= 1.23 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= 0.511 K(o=0.51,f=-2.8!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 140:sc= 0.241 USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 0.318 -6.534 9.199 1.00 0.00 N ATOM 49 CA THR A 36 -0.966 -6.298 8.521 1.00 0.00 C ATOM 50 C THR A 36 -0.847 -5.257 7.410 1.00 0.00 C ATOM 51 O THR A 36 0.084 -4.444 7.390 1.00 0.00 O ATOM 52 CB THR A 36 -2.075 -5.966 9.536 1.00 0.00 C ATOM 53 OG1 THR A 36 -3.327 -6.020 8.888 1.00 0.00 O ATOM 54 CG2 THR A 36 -1.919 -4.591 10.187 1.00 0.00 C ATOM 0 HA THR A 36 -1.256 -7.225 8.027 1.00 0.00 H new ATOM 0 HB THR A 36 -2.000 -6.707 10.332 1.00 0.00 H new ATOM 0 HG1 THR A 36 -4.037 -5.811 9.530 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.736 -4.426 10.890 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.968 -4.546 10.718 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.942 -3.819 9.417 1.00 0.00 H new ATOM 62 N PHE A 37 -1.799 -5.314 6.477 1.00 0.00 N ATOM 63 CA PHE A 37 -1.982 -4.382 5.366 1.00 0.00 C ATOM 64 C PHE A 37 -3.489 -4.223 5.106 1.00 0.00 C ATOM 65 O PHE A 37 -4.168 -5.194 4.766 1.00 0.00 O ATOM 66 CB PHE A 37 -1.218 -4.881 4.129 1.00 0.00 C ATOM 67 CG PHE A 37 -1.109 -3.882 2.990 1.00 0.00 C ATOM 68 CD1 PHE A 37 -0.525 -2.624 3.222 1.00 0.00 C ATOM 69 CD2 PHE A 37 -1.540 -4.212 1.691 1.00 0.00 C ATOM 70 CE1 PHE A 37 -0.368 -1.701 2.174 1.00 0.00 C ATOM 71 CE2 PHE A 37 -1.393 -3.286 0.640 1.00 0.00 C ATOM 72 CZ PHE A 37 -0.808 -2.031 0.881 1.00 0.00 C ATOM 0 H PHE A 37 -2.502 -6.054 6.478 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.573 -3.401 5.610 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.213 -5.170 4.435 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.709 -5.780 3.757 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -0.193 -2.364 4.217 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.984 -5.178 1.500 1.00 0.00 H new ATOM 0 HE1 PHE A 37 0.089 -0.741 2.362 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -1.731 -3.541 -0.354 1.00 0.00 H new ATOM 0 HZ PHE A 37 -0.697 -1.322 0.074 1.00 0.00 H new ATOM 82 N SER A 38 -4.031 -3.022 5.314 1.00 0.00 N ATOM 83 CA SER A 38 -5.483 -2.766 5.342 1.00 0.00 C ATOM 84 C SER A 38 -5.901 -1.435 4.667 1.00 0.00 C ATOM 85 O SER A 38 -5.064 -0.533 4.529 1.00 0.00 O ATOM 86 CB SER A 38 -5.964 -2.815 6.806 1.00 0.00 C ATOM 87 OG SER A 38 -5.374 -1.796 7.604 1.00 0.00 O ATOM 0 H SER A 38 -3.471 -2.184 5.471 1.00 0.00 H new ATOM 0 HA SER A 38 -5.964 -3.546 4.751 1.00 0.00 H new ATOM 0 HB2 SER A 38 -7.049 -2.712 6.833 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.726 -3.790 7.232 1.00 0.00 H new ATOM 0 HG SER A 38 -5.709 -1.865 8.522 1.00 0.00 H new ATOM 93 N PRO A 39 -7.179 -1.272 4.249 1.00 0.00 N ATOM 94 CA PRO A 39 -8.251 -2.274 4.240 1.00 0.00 C ATOM 95 C PRO A 39 -7.998 -3.361 3.191 1.00 0.00 C ATOM 96 O PRO A 39 -7.232 -3.151 2.255 1.00 0.00 O ATOM 97 CB PRO A 39 -9.531 -1.499 3.904 1.00 0.00 C ATOM 98 CG PRO A 39 -9.021 -0.355 3.033 1.00 0.00 C ATOM 99 CD PRO A 39 -7.663 -0.031 3.653 1.00 0.00 C ATOM 0 HA PRO A 39 -8.316 -2.786 5.200 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.251 -2.121 3.372 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -10.028 -1.132 4.802 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.927 -0.653 1.989 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.692 0.503 3.060 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.968 0.335 2.897 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.756 0.752 4.406 1.00 0.00 H new ATOM 107 N ALA A 40 -8.669 -4.512 3.322 1.00 0.00 N ATOM 108 CA ALA A 40 -8.584 -5.603 2.343 1.00 0.00 C ATOM 109 C ALA A 40 -9.129 -5.214 0.952 1.00 0.00 C ATOM 110 O ALA A 40 -8.698 -5.779 -0.055 1.00 0.00 O ATOM 111 CB ALA A 40 -9.321 -6.822 2.910 1.00 0.00 C ATOM 0 H ALA A 40 -9.286 -4.713 4.109 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.532 -5.839 2.183 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.269 -7.644 2.196 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.855 -7.126 3.847 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.365 -6.565 3.091 1.00 0.00 H new ATOM 117 N LEU A 41 -10.027 -4.223 0.890 1.00 0.00 N ATOM 118 CA LEU A 41 -10.500 -3.575 -0.336 1.00 0.00 C ATOM 119 C LEU A 41 -10.656 -2.074 -0.072 1.00 0.00 C ATOM 120 O LEU A 41 -11.433 -1.668 0.796 1.00 0.00 O ATOM 121 CB LEU A 41 -11.822 -4.228 -0.793 1.00 0.00 C ATOM 122 CG LEU A 41 -12.543 -3.499 -1.952 1.00 0.00 C ATOM 123 CD1 LEU A 41 -11.708 -3.433 -3.241 1.00 0.00 C ATOM 124 CD2 LEU A 41 -13.876 -4.201 -2.251 1.00 0.00 C ATOM 0 H LEU A 41 -10.461 -3.836 1.728 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.780 -3.705 -1.144 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.616 -5.253 -1.100 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.498 -4.280 0.060 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.707 -2.473 -1.623 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.272 -2.909 -4.013 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.778 -2.899 -3.045 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.481 -4.444 -3.580 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.383 -3.687 -3.067 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.686 -5.236 -2.536 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.506 -4.179 -1.362 1.00 0.00 H new ATOM 136 N LEU A 42 -9.942 -1.254 -0.844 1.00 0.00 N ATOM 137 CA LEU A 42 -10.072 0.202 -0.875 1.00 0.00 C ATOM 138 C LEU A 42 -10.765 0.616 -2.180 1.00 0.00 C ATOM 139 O LEU A 42 -10.285 0.273 -3.259 1.00 0.00 O ATOM 140 CB LEU A 42 -8.661 0.809 -0.765 1.00 0.00 C ATOM 141 CG LEU A 42 -8.611 2.348 -0.783 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.414 2.985 0.360 1.00 0.00 C ATOM 143 CD2 LEU A 42 -7.149 2.795 -0.676 1.00 0.00 C ATOM 0 H LEU A 42 -9.231 -1.599 -1.489 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.678 0.565 -0.045 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.201 0.456 0.158 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.054 0.431 -1.588 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.062 2.680 -1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.341 4.071 0.295 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.459 2.686 0.281 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.012 2.651 1.317 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -7.100 3.884 -0.688 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.722 2.422 0.255 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.584 2.397 -1.519 1.00 0.00 H new ATOM 155 N VAL A 43 -11.859 1.374 -2.088 1.00 0.00 N ATOM 156 CA VAL A 43 -12.556 1.963 -3.246 1.00 0.00 C ATOM 157 C VAL A 43 -12.333 3.476 -3.235 1.00 0.00 C ATOM 158 O VAL A 43 -12.655 4.142 -2.252 1.00 0.00 O ATOM 159 CB VAL A 43 -14.070 1.638 -3.272 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.700 2.102 -4.598 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.338 0.131 -3.098 1.00 0.00 C ATOM 0 H VAL A 43 -12.297 1.603 -1.196 1.00 0.00 H new ATOM 0 HA VAL A 43 -12.138 1.520 -4.150 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.521 2.172 -2.436 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.764 1.865 -4.598 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.568 3.179 -4.707 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.215 1.591 -5.430 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.412 -0.053 -3.122 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.857 -0.420 -3.907 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.934 -0.202 -2.142 1.00 0.00 H new ATOM 171 N VAL A 44 -11.789 4.006 -4.331 1.00 0.00 N ATOM 172 CA VAL A 44 -11.639 5.457 -4.580 1.00 0.00 C ATOM 173 C VAL A 44 -12.231 5.857 -5.935 1.00 0.00 C ATOM 174 O VAL A 44 -12.448 5.001 -6.789 1.00 0.00 O ATOM 175 CB VAL A 44 -10.165 5.921 -4.516 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.583 5.718 -3.110 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.280 5.238 -5.573 1.00 0.00 C ATOM 0 H VAL A 44 -11.429 3.432 -5.094 1.00 0.00 H new ATOM 0 HA VAL A 44 -12.190 5.953 -3.781 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.167 6.987 -4.744 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.546 6.053 -3.094 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -10.162 6.296 -2.390 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.627 4.661 -2.847 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.257 5.602 -5.481 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.297 4.159 -5.419 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.659 5.468 -6.569 1.00 0.00 H new ATOM 187 N THR A 45 -12.451 7.160 -6.143 1.00 0.00 N ATOM 188 CA THR A 45 -12.846 7.738 -7.439 1.00 0.00 C ATOM 189 C THR A 45 -11.610 8.141 -8.243 1.00 0.00 C ATOM 190 O THR A 45 -10.583 8.516 -7.680 1.00 0.00 O ATOM 191 CB THR A 45 -13.794 8.921 -7.214 1.00 0.00 C ATOM 192 OG1 THR A 45 -14.975 8.418 -6.627 1.00 0.00 O ATOM 193 CG2 THR A 45 -14.198 9.614 -8.513 1.00 0.00 C ATOM 0 H THR A 45 -12.359 7.857 -5.404 1.00 0.00 H new ATOM 0 HA THR A 45 -13.380 6.988 -8.023 1.00 0.00 H new ATOM 0 HB THR A 45 -13.275 9.647 -6.588 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.602 9.155 -6.469 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.869 10.443 -8.290 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.308 9.993 -9.015 1.00 0.00 H new ATOM 0 HG23 THR A 45 -14.706 8.901 -9.163 1.00 0.00 H new ATOM 201 N GLU A 46 -11.710 8.077 -9.571 1.00 0.00 N ATOM 202 CA GLU A 46 -10.635 8.438 -10.492 1.00 0.00 C ATOM 203 C GLU A 46 -10.155 9.884 -10.273 1.00 0.00 C ATOM 204 O GLU A 46 -10.942 10.834 -10.314 1.00 0.00 O ATOM 205 CB GLU A 46 -11.067 8.186 -11.951 1.00 0.00 C ATOM 206 CG GLU A 46 -9.858 7.745 -12.774 1.00 0.00 C ATOM 207 CD GLU A 46 -10.149 7.488 -14.251 1.00 0.00 C ATOM 208 OE1 GLU A 46 -10.959 8.203 -14.880 1.00 0.00 O ATOM 209 OE2 GLU A 46 -9.565 6.521 -14.788 1.00 0.00 O1- ATOM 0 H GLU A 46 -12.558 7.766 -10.045 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.780 7.796 -10.282 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.842 7.420 -11.984 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.497 9.093 -12.375 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.086 8.510 -12.698 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.449 6.835 -12.335 1.00 0.00 H new ATOM 216 N GLY A 47 -8.853 10.041 -10.018 1.00 0.00 N ATOM 217 CA GLY A 47 -8.184 11.301 -9.691 1.00 0.00 C ATOM 218 C GLY A 47 -8.175 11.648 -8.203 1.00 0.00 C ATOM 219 O GLY A 47 -7.675 12.717 -7.860 1.00 0.00 O ATOM 0 H GLY A 47 -8.206 9.253 -10.035 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.155 11.254 -10.046 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.672 12.109 -10.236 1.00 0.00 H new ATOM 223 N ASP A 48 -8.690 10.783 -7.322 1.00 0.00 N ATOM 224 CA ASP A 48 -8.560 10.919 -5.864 1.00 0.00 C ATOM 225 C ASP A 48 -7.326 10.163 -5.332 1.00 0.00 C ATOM 226 O ASP A 48 -6.822 9.228 -5.961 1.00 0.00 O ATOM 227 CB ASP A 48 -9.856 10.435 -5.186 1.00 0.00 C ATOM 228 CG ASP A 48 -9.950 10.775 -3.687 1.00 0.00 C ATOM 229 OD1 ASP A 48 -9.384 11.808 -3.255 1.00 0.00 O1- ATOM 230 OD2 ASP A 48 -10.623 10.015 -2.953 1.00 0.00 O ATOM 0 H ASP A 48 -9.217 9.956 -7.604 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.408 11.971 -5.622 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.709 10.877 -5.701 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.935 9.355 -5.308 1.00 0.00 H new ATOM 235 N ASN A 49 -6.835 10.563 -4.158 1.00 0.00 N ATOM 236 CA ASN A 49 -5.704 9.931 -3.483 1.00 0.00 C ATOM 237 C ASN A 49 -6.165 8.690 -2.699 1.00 0.00 C ATOM 238 O ASN A 49 -7.121 8.751 -1.921 1.00 0.00 O ATOM 239 CB ASN A 49 -5.007 10.947 -2.563 1.00 0.00 C ATOM 240 CG ASN A 49 -4.444 12.159 -3.307 1.00 0.00 C ATOM 241 OD1 ASN A 49 -4.077 12.099 -4.475 1.00 0.00 O ATOM 242 ND2 ASN A 49 -4.360 13.302 -2.650 1.00 0.00 N ATOM 0 H ASN A 49 -7.222 11.352 -3.640 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.985 9.599 -4.232 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -5.717 11.290 -1.811 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -4.196 10.448 -2.032 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -3.991 14.131 -3.115 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -4.665 13.355 -1.678 1.00 0.00 H new ATOM 249 N ALA A 50 -5.471 7.566 -2.892 1.00 0.00 N ATOM 250 CA ALA A 50 -5.781 6.272 -2.269 1.00 0.00 C ATOM 251 C ALA A 50 -4.685 5.860 -1.276 1.00 0.00 C ATOM 252 O ALA A 50 -3.527 5.776 -1.684 1.00 0.00 O ATOM 253 CB ALA A 50 -5.924 5.231 -3.389 1.00 0.00 C ATOM 0 H ALA A 50 -4.655 7.527 -3.502 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.710 6.345 -1.703 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.155 4.258 -2.954 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.729 5.528 -4.061 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.990 5.167 -3.947 1.00 0.00 H new ATOM 259 N THR A 51 -5.023 5.577 -0.009 1.00 0.00 N ATOM 260 CA THR A 51 -4.031 5.247 1.033 1.00 0.00 C ATOM 261 C THR A 51 -4.392 3.971 1.784 1.00 0.00 C ATOM 262 O THR A 51 -5.476 3.868 2.358 1.00 0.00 O ATOM 263 CB THR A 51 -3.834 6.416 2.007 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.552 7.581 1.257 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.658 6.172 2.961 1.00 0.00 C ATOM 0 H THR A 51 -5.987 5.570 0.324 1.00 0.00 H new ATOM 0 HA THR A 51 -3.085 5.067 0.522 1.00 0.00 H new ATOM 0 HB THR A 51 -4.744 6.521 2.597 1.00 0.00 H new ATOM 0 HG1 THR A 51 -3.425 8.339 1.865 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.553 7.023 3.634 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.843 5.270 3.544 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.741 6.050 2.384 1.00 0.00 H new ATOM 273 N PHE A 52 -3.449 3.027 1.810 1.00 0.00 N ATOM 274 CA PHE A 52 -3.472 1.819 2.637 1.00 0.00 C ATOM 275 C PHE A 52 -2.583 1.996 3.879 1.00 0.00 C ATOM 276 O PHE A 52 -1.572 2.704 3.832 1.00 0.00 O ATOM 277 CB PHE A 52 -2.969 0.619 1.821 1.00 0.00 C ATOM 278 CG PHE A 52 -3.836 0.224 0.642 1.00 0.00 C ATOM 279 CD1 PHE A 52 -4.891 -0.692 0.822 1.00 0.00 C ATOM 280 CD2 PHE A 52 -3.569 0.743 -0.639 1.00 0.00 C ATOM 281 CE1 PHE A 52 -5.676 -1.085 -0.275 1.00 0.00 C ATOM 282 CE2 PHE A 52 -4.351 0.346 -1.738 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.403 -0.570 -1.554 1.00 0.00 C ATOM 0 H PHE A 52 -2.612 3.086 1.230 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.498 1.642 2.958 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.968 0.845 1.454 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.878 -0.239 2.487 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -5.097 -1.092 1.804 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.762 1.447 -0.778 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -6.489 -1.782 -0.136 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.145 0.743 -2.721 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.002 -0.878 -2.398 1.00 0.00 H new ATOM 293 N THR A 53 -2.930 1.305 4.969 1.00 0.00 N ATOM 294 CA THR A 53 -2.148 1.230 6.212 1.00 0.00 C ATOM 295 C THR A 53 -1.360 -0.075 6.228 1.00 0.00 C ATOM 296 O THR A 53 -1.938 -1.137 6.006 1.00 0.00 O ATOM 297 CB THR A 53 -3.076 1.310 7.430 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.850 2.491 7.343 1.00 0.00 O ATOM 299 CG2 THR A 53 -2.291 1.363 8.742 1.00 0.00 C ATOM 0 H THR A 53 -3.793 0.763 5.014 1.00 0.00 H new ATOM 0 HA THR A 53 -1.456 2.071 6.257 1.00 0.00 H new ATOM 0 HB THR A 53 -3.700 0.417 7.428 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.447 2.548 8.118 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.986 1.419 9.580 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.680 0.465 8.837 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.647 2.242 8.745 1.00 0.00 H new ATOM 307 N CYS A 54 -0.059 -0.007 6.508 1.00 0.00 N ATOM 308 CA CYS A 54 0.867 -1.143 6.616 1.00 0.00 C ATOM 309 C CYS A 54 1.596 -1.149 7.970 1.00 0.00 C ATOM 310 O CYS A 54 2.004 -0.094 8.458 1.00 0.00 O ATOM 311 CB CYS A 54 1.926 -1.022 5.508 1.00 0.00 C ATOM 312 SG CYS A 54 3.225 -2.290 5.544 1.00 0.00 S ATOM 0 H CYS A 54 0.405 0.886 6.675 1.00 0.00 H new ATOM 0 HA CYS A 54 0.289 -2.063 6.522 1.00 0.00 H new ATOM 0 HB2 CYS A 54 1.425 -1.065 4.541 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.395 -0.041 5.581 1.00 0.00 H new ATOM 317 N SER A 55 1.851 -2.321 8.552 1.00 0.00 N ATOM 318 CA SER A 55 2.747 -2.448 9.712 1.00 0.00 C ATOM 319 C SER A 55 3.393 -3.839 9.827 1.00 0.00 C ATOM 320 O SER A 55 2.880 -4.831 9.302 1.00 0.00 O ATOM 321 CB SER A 55 2.051 -2.035 11.023 1.00 0.00 C ATOM 322 OG SER A 55 0.999 -2.918 11.386 1.00 0.00 O ATOM 0 H SER A 55 1.449 -3.205 8.240 1.00 0.00 H new ATOM 0 HA SER A 55 3.563 -1.747 9.537 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.787 -2.004 11.826 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.653 -1.026 10.916 1.00 0.00 H new ATOM 0 HG SER A 55 0.591 -2.614 12.224 1.00 0.00 H new ATOM 328 N PHE A 56 4.539 -3.889 10.522 1.00 0.00 N ATOM 329 CA PHE A 56 5.342 -5.081 10.808 1.00 0.00 C ATOM 330 C PHE A 56 5.960 -5.012 12.212 1.00 0.00 C ATOM 331 O PHE A 56 6.211 -3.930 12.744 1.00 0.00 O ATOM 332 CB PHE A 56 6.514 -5.168 9.816 1.00 0.00 C ATOM 333 CG PHE A 56 6.162 -5.585 8.409 1.00 0.00 C ATOM 334 CD1 PHE A 56 6.076 -6.952 8.087 1.00 0.00 C ATOM 335 CD2 PHE A 56 5.975 -4.613 7.412 1.00 0.00 C ATOM 336 CE1 PHE A 56 5.796 -7.348 6.771 1.00 0.00 C ATOM 337 CE2 PHE A 56 5.704 -5.010 6.092 1.00 0.00 C ATOM 338 CZ PHE A 56 5.620 -6.375 5.774 1.00 0.00 C ATOM 0 H PHE A 56 4.952 -3.047 10.922 1.00 0.00 H new ATOM 0 HA PHE A 56 4.679 -5.943 10.728 1.00 0.00 H new ATOM 0 HB2 PHE A 56 7.001 -4.194 9.774 1.00 0.00 H new ATOM 0 HB3 PHE A 56 7.246 -5.873 10.210 1.00 0.00 H new ATOM 0 HD1 PHE A 56 6.226 -7.697 8.854 1.00 0.00 H new ATOM 0 HD2 PHE A 56 6.039 -3.564 7.660 1.00 0.00 H new ATOM 0 HE1 PHE A 56 5.716 -8.397 6.526 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.560 -4.266 5.322 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.419 -6.678 4.757 1.00 0.00 H new ATOM 424 N PHE A 63 15.587 -0.107 9.486 1.00 0.00 N ATOM 425 CA PHE A 63 14.990 -0.943 8.432 1.00 0.00 C ATOM 426 C PHE A 63 14.460 -0.094 7.257 1.00 0.00 C ATOM 427 O PHE A 63 14.271 1.116 7.391 1.00 0.00 O ATOM 428 CB PHE A 63 13.884 -1.845 9.030 1.00 0.00 C ATOM 429 CG PHE A 63 12.811 -1.112 9.814 1.00 0.00 C ATOM 430 CD1 PHE A 63 11.727 -0.514 9.143 1.00 0.00 C ATOM 431 CD2 PHE A 63 12.902 -1.020 11.217 1.00 0.00 C ATOM 432 CE1 PHE A 63 10.754 0.189 9.873 1.00 0.00 C ATOM 433 CE2 PHE A 63 11.922 -0.323 11.945 1.00 0.00 C ATOM 434 CZ PHE A 63 10.850 0.288 11.271 1.00 0.00 C ATOM 0 HA PHE A 63 15.771 -1.584 8.023 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.408 -2.396 8.219 1.00 0.00 H new ATOM 0 HB3 PHE A 63 14.351 -2.581 9.684 1.00 0.00 H new ATOM 0 HD1 PHE A 63 11.644 -0.596 8.069 1.00 0.00 H new ATOM 0 HD2 PHE A 63 13.727 -1.486 11.735 1.00 0.00 H new ATOM 0 HE1 PHE A 63 9.928 0.656 9.357 1.00 0.00 H new ATOM 0 HE2 PHE A 63 11.992 -0.257 13.021 1.00 0.00 H new ATOM 0 HZ PHE A 63 10.101 0.833 11.827 1.00 0.00 H new ATOM 444 N VAL A 64 14.196 -0.743 6.118 1.00 0.00 N ATOM 445 CA VAL A 64 13.491 -0.185 4.950 1.00 0.00 C ATOM 446 C VAL A 64 12.094 -0.810 4.864 1.00 0.00 C ATOM 447 O VAL A 64 11.960 -2.030 4.974 1.00 0.00 O ATOM 448 CB VAL A 64 14.237 -0.452 3.614 1.00 0.00 C ATOM 449 CG1 VAL A 64 13.584 0.315 2.450 1.00 0.00 C ATOM 450 CG2 VAL A 64 15.719 -0.054 3.678 1.00 0.00 C ATOM 0 H VAL A 64 14.478 -1.713 5.975 1.00 0.00 H new ATOM 0 HA VAL A 64 13.438 0.895 5.090 1.00 0.00 H new ATOM 0 HB VAL A 64 14.167 -1.527 3.446 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.128 0.109 1.528 1.00 0.00 H new ATOM 0 HG12 VAL A 64 12.548 -0.005 2.340 1.00 0.00 H new ATOM 0 HG13 VAL A 64 13.614 1.385 2.657 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.193 -0.261 2.719 1.00 0.00 H new ATOM 0 HG22 VAL A 64 15.801 1.010 3.901 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.216 -0.628 4.460 1.00 0.00 H new ATOM 460 N LEU A 65 11.070 0.018 4.640 1.00 0.00 N ATOM 461 CA LEU A 65 9.712 -0.411 4.291 1.00 0.00 C ATOM 462 C LEU A 65 9.472 -0.166 2.797 1.00 0.00 C ATOM 463 O LEU A 65 9.907 0.849 2.262 1.00 0.00 O ATOM 464 CB LEU A 65 8.671 0.351 5.143 1.00 0.00 C ATOM 465 CG LEU A 65 7.671 -0.544 5.899 1.00 0.00 C ATOM 466 CD1 LEU A 65 6.969 -1.577 5.008 1.00 0.00 C ATOM 467 CD2 LEU A 65 8.357 -1.239 7.082 1.00 0.00 C ATOM 0 H LEU A 65 11.165 1.032 4.698 1.00 0.00 H new ATOM 0 HA LEU A 65 9.604 -1.475 4.500 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.200 0.972 5.866 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.113 1.025 4.492 1.00 0.00 H new ATOM 0 HG LEU A 65 6.890 0.122 6.266 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.281 -2.170 5.611 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.414 -1.063 4.223 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.713 -2.233 4.556 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.635 -1.867 7.604 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.177 -1.857 6.715 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.748 -0.488 7.769 1.00 0.00 H new ATOM 479 N ASN A 66 8.779 -1.082 2.124 1.00 0.00 N ATOM 480 CA ASN A 66 8.610 -1.121 0.668 1.00 0.00 C ATOM 481 C ASN A 66 7.162 -1.468 0.286 1.00 0.00 C ATOM 482 O ASN A 66 6.435 -2.094 1.064 1.00 0.00 O ATOM 483 CB ASN A 66 9.555 -2.171 0.051 1.00 0.00 C ATOM 484 CG ASN A 66 11.006 -2.068 0.507 1.00 0.00 C ATOM 485 OD1 ASN A 66 11.831 -1.426 -0.128 1.00 0.00 O ATOM 486 ND2 ASN A 66 11.359 -2.723 1.600 1.00 0.00 N ATOM 0 H ASN A 66 8.299 -1.849 2.595 1.00 0.00 H new ATOM 0 HA ASN A 66 8.850 -0.131 0.281 1.00 0.00 H new ATOM 0 HB2 ASN A 66 9.181 -3.165 0.296 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.522 -2.077 -1.034 1.00 0.00 H new ATOM 0 HD21 ASN A 66 12.327 -2.696 1.921 1.00 0.00 H new ATOM 0 HD22 ASN A 66 10.663 -3.255 2.123 1.00 0.00 H new ATOM 493 N TRP A 67 6.757 -1.106 -0.933 1.00 0.00 N ATOM 494 CA TRP A 67 5.412 -1.341 -1.462 1.00 0.00 C ATOM 495 C TRP A 67 5.441 -2.017 -2.842 1.00 0.00 C ATOM 496 O TRP A 67 6.246 -1.652 -3.704 1.00 0.00 O ATOM 497 CB TRP A 67 4.696 0.011 -1.517 1.00 0.00 C ATOM 498 CG TRP A 67 3.222 0.003 -1.787 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.371 -1.045 -1.693 1.00 0.00 C ATOM 500 CD2 TRP A 67 2.390 1.145 -2.139 1.00 0.00 C ATOM 501 NE1 TRP A 67 1.094 -0.645 -2.022 1.00 0.00 N ATOM 502 CE2 TRP A 67 1.040 0.704 -2.278 1.00 0.00 C ATOM 503 CE3 TRP A 67 2.643 2.523 -2.299 1.00 0.00 C ATOM 504 CZ2 TRP A 67 -0.013 1.586 -2.549 1.00 0.00 C ATOM 505 CZ3 TRP A 67 1.591 3.418 -2.554 1.00 0.00 C ATOM 506 CH2 TRP A 67 0.269 2.956 -2.662 1.00 0.00 C ATOM 0 H TRP A 67 7.370 -0.630 -1.595 1.00 0.00 H new ATOM 0 HA TRP A 67 4.876 -2.030 -0.809 1.00 0.00 H new ATOM 0 HB2 TRP A 67 4.861 0.518 -0.566 1.00 0.00 H new ATOM 0 HB3 TRP A 67 5.176 0.615 -2.287 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.651 -2.047 -1.403 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.290 -1.271 -2.070 1.00 0.00 H new ATOM 0 HE3 TRP A 67 3.655 2.894 -2.225 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -1.022 1.219 -2.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 1.801 4.471 -2.668 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -0.534 3.658 -2.833 1.00 0.00 H new ATOM 517 N TYR A 68 4.552 -2.993 -3.051 1.00 0.00 N ATOM 518 CA TYR A 68 4.472 -3.818 -4.256 1.00 0.00 C ATOM 519 C TYR A 68 3.045 -3.915 -4.824 1.00 0.00 C ATOM 520 O TYR A 68 2.067 -4.057 -4.086 1.00 0.00 O ATOM 521 CB TYR A 68 4.997 -5.228 -3.943 1.00 0.00 C ATOM 522 CG TYR A 68 6.395 -5.260 -3.357 1.00 0.00 C ATOM 523 CD1 TYR A 68 7.517 -5.328 -4.206 1.00 0.00 C ATOM 524 CD2 TYR A 68 6.573 -5.196 -1.961 1.00 0.00 C ATOM 525 CE1 TYR A 68 8.815 -5.325 -3.661 1.00 0.00 C ATOM 526 CE2 TYR A 68 7.869 -5.185 -1.411 1.00 0.00 C ATOM 527 CZ TYR A 68 8.996 -5.242 -2.263 1.00 0.00 C ATOM 528 OH TYR A 68 10.255 -5.214 -1.744 1.00 0.00 O ATOM 0 H TYR A 68 3.843 -3.237 -2.359 1.00 0.00 H new ATOM 0 HA TYR A 68 5.086 -3.337 -5.017 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.313 -5.711 -3.245 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.987 -5.818 -4.859 1.00 0.00 H new ATOM 0 HD1 TYR A 68 7.381 -5.382 -5.276 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.712 -5.155 -1.310 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.674 -5.386 -4.313 1.00 0.00 H new ATOM 0 HE2 TYR A 68 8.002 -5.133 -0.340 1.00 0.00 H new ATOM 0 HH TYR A 68 10.205 -5.154 -0.767 1.00 0.00 H new ATOM 538 N ARG A 69 2.952 -3.896 -6.155 1.00 0.00 N ATOM 539 CA ARG A 69 1.758 -4.191 -6.962 1.00 0.00 C ATOM 540 C ARG A 69 1.875 -5.612 -7.509 1.00 0.00 C ATOM 541 O ARG A 69 2.979 -6.035 -7.846 1.00 0.00 O ATOM 542 CB ARG A 69 1.707 -3.170 -8.105 1.00 0.00 C ATOM 543 CG ARG A 69 0.601 -3.376 -9.148 1.00 0.00 C ATOM 544 CD ARG A 69 0.482 -2.137 -10.048 1.00 0.00 C ATOM 545 NE ARG A 69 1.750 -1.813 -10.734 1.00 0.00 N ATOM 546 CZ ARG A 69 2.082 -0.639 -11.260 1.00 0.00 C ATOM 547 NH1 ARG A 69 1.227 0.360 -11.336 1.00 0.00 N1+ ATOM 548 NH2 ARG A 69 3.300 -0.456 -11.721 1.00 0.00 N ATOM 0 H ARG A 69 3.755 -3.660 -6.737 1.00 0.00 H new ATOM 0 HA ARG A 69 0.846 -4.123 -6.370 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.589 -2.177 -7.672 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.669 -3.182 -8.618 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.822 -4.255 -9.754 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.349 -3.564 -8.648 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.297 -2.305 -10.792 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.169 -1.283 -9.446 1.00 0.00 H new ATOM 0 HE ARG A 69 2.437 -2.563 -10.811 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.276 0.245 -10.985 1.00 0.00 H new ATOM 0 HH12 ARG A 69 1.516 1.248 -11.746 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.982 -1.213 -11.673 1.00 0.00 H new ATOM 0 HH22 ARG A 69 3.562 0.443 -12.126 1.00 0.00 H new ATOM 562 N MET A 70 0.774 -6.353 -7.613 1.00 0.00 N ATOM 563 CA MET A 70 0.781 -7.722 -8.150 1.00 0.00 C ATOM 564 C MET A 70 0.475 -7.762 -9.651 1.00 0.00 C ATOM 565 O MET A 70 -0.380 -7.028 -10.149 1.00 0.00 O ATOM 566 CB MET A 70 -0.195 -8.616 -7.380 1.00 0.00 C ATOM 567 CG MET A 70 0.097 -8.601 -5.872 1.00 0.00 C ATOM 568 SD MET A 70 -0.544 -10.029 -4.973 1.00 0.00 S ATOM 569 CE MET A 70 0.719 -11.244 -5.438 1.00 0.00 C ATOM 0 H MET A 70 -0.150 -6.027 -7.329 1.00 0.00 H new ATOM 0 HA MET A 70 1.792 -8.107 -8.016 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.216 -8.279 -7.557 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.127 -9.637 -7.755 1.00 0.00 H new ATOM 0 HG2 MET A 70 1.176 -8.548 -5.724 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.329 -7.695 -5.441 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.562 -12.165 -4.876 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.647 -11.453 -6.505 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.708 -10.845 -5.213 1.00 0.00 H new ATOM 579 N SER A 71 1.156 -8.648 -10.369 1.00 0.00 N ATOM 580 CA SER A 71 0.941 -8.914 -11.800 1.00 0.00 C ATOM 581 C SER A 71 -0.068 -10.068 -12.023 1.00 0.00 C ATOM 582 O SER A 71 -0.226 -10.909 -11.128 1.00 0.00 O ATOM 583 CB SER A 71 2.283 -9.264 -12.468 1.00 0.00 C ATOM 584 OG SER A 71 3.220 -8.203 -12.330 1.00 0.00 O ATOM 0 H SER A 71 1.897 -9.222 -9.966 1.00 0.00 H new ATOM 0 HA SER A 71 0.524 -8.013 -12.249 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.689 -10.171 -12.021 1.00 0.00 H new ATOM 0 HB3 SER A 71 2.122 -9.475 -13.525 1.00 0.00 H new ATOM 0 HG SER A 71 4.063 -8.453 -12.762 1.00 0.00 H new ATOM 590 N PRO A 72 -0.716 -10.169 -13.208 1.00 0.00 N ATOM 591 CA PRO A 72 -1.649 -11.253 -13.543 1.00 0.00 C ATOM 592 C PRO A 72 -1.053 -12.662 -13.404 1.00 0.00 C ATOM 593 O PRO A 72 -1.754 -13.593 -13.015 1.00 0.00 O ATOM 594 CB PRO A 72 -2.085 -10.995 -14.991 1.00 0.00 C ATOM 595 CG PRO A 72 -1.906 -9.489 -15.155 1.00 0.00 C ATOM 596 CD PRO A 72 -0.673 -9.203 -14.300 1.00 0.00 C ATOM 0 HA PRO A 72 -2.481 -11.241 -12.839 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -1.472 -11.551 -15.700 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.119 -11.297 -15.158 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.750 -9.211 -16.197 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.778 -8.937 -14.805 1.00 0.00 H new ATOM 0 HD2 PRO A 72 0.241 -9.312 -14.883 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -0.689 -8.182 -13.920 1.00 0.00 H new ATOM 604 N SER A 73 0.246 -12.824 -13.681 1.00 0.00 N ATOM 605 CA SER A 73 0.994 -14.088 -13.542 1.00 0.00 C ATOM 606 C SER A 73 1.366 -14.437 -12.080 1.00 0.00 C ATOM 607 O SER A 73 2.160 -15.350 -11.843 1.00 0.00 O ATOM 608 CB SER A 73 2.272 -14.011 -14.401 1.00 0.00 C ATOM 609 OG SER A 73 2.008 -13.574 -15.734 1.00 0.00 O ATOM 0 H SER A 73 0.828 -12.057 -14.019 1.00 0.00 H new ATOM 0 HA SER A 73 0.336 -14.886 -13.885 1.00 0.00 H new ATOM 0 HB2 SER A 73 2.981 -13.329 -13.932 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.746 -14.992 -14.431 1.00 0.00 H new ATOM 0 HG SER A 73 2.847 -13.539 -16.239 1.00 0.00 H new ATOM 615 N ASN A 74 0.847 -13.685 -11.097 1.00 0.00 N ATOM 616 CA ASN A 74 1.092 -13.815 -9.649 1.00 0.00 C ATOM 617 C ASN A 74 2.520 -13.398 -9.232 1.00 0.00 C ATOM 618 O ASN A 74 3.032 -13.813 -8.188 1.00 0.00 O ATOM 619 CB ASN A 74 0.660 -15.208 -9.139 1.00 0.00 C ATOM 620 CG ASN A 74 0.471 -15.263 -7.622 1.00 0.00 C ATOM 621 OD1 ASN A 74 -0.030 -14.336 -6.995 1.00 0.00 O ATOM 622 ND2 ASN A 74 0.852 -16.360 -6.988 1.00 0.00 N ATOM 0 H ASN A 74 0.204 -12.921 -11.304 1.00 0.00 H new ATOM 0 HA ASN A 74 0.455 -13.091 -9.140 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -0.273 -15.492 -9.625 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.409 -15.943 -9.432 1.00 0.00 H new ATOM 0 HD21 ASN A 74 0.729 -16.434 -5.978 1.00 0.00 H new ATOM 0 HD22 ASN A 74 1.269 -17.131 -7.509 1.00 0.00 H new ATOM 629 N GLN A 75 3.168 -12.567 -10.055 1.00 0.00 N ATOM 630 CA GLN A 75 4.431 -11.898 -9.731 1.00 0.00 C ATOM 631 C GLN A 75 4.160 -10.533 -9.064 1.00 0.00 C ATOM 632 O GLN A 75 3.003 -10.176 -8.823 1.00 0.00 O ATOM 633 CB GLN A 75 5.296 -11.780 -11.003 1.00 0.00 C ATOM 634 CG GLN A 75 5.656 -13.149 -11.609 1.00 0.00 C ATOM 635 CD GLN A 75 6.545 -13.012 -12.848 1.00 0.00 C ATOM 636 OE1 GLN A 75 6.088 -13.063 -13.984 1.00 0.00 O ATOM 637 NE2 GLN A 75 7.839 -12.816 -12.689 1.00 0.00 N ATOM 0 H GLN A 75 2.821 -12.336 -10.986 1.00 0.00 H new ATOM 0 HA GLN A 75 4.992 -12.492 -9.009 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.762 -11.188 -11.746 1.00 0.00 H new ATOM 0 HB3 GLN A 75 6.213 -11.241 -10.765 1.00 0.00 H new ATOM 0 HG2 GLN A 75 6.168 -13.753 -10.860 1.00 0.00 H new ATOM 0 HG3 GLN A 75 4.742 -13.679 -11.876 1.00 0.00 H new ATOM 0 HE21 GLN A 75 8.236 -12.771 -11.751 1.00 0.00 H new ATOM 0 HE22 GLN A 75 8.443 -12.710 -13.504 1.00 0.00 H new ATOM 646 N THR A 76 5.216 -9.762 -8.765 1.00 0.00 N ATOM 647 CA THR A 76 5.162 -8.482 -8.044 1.00 0.00 C ATOM 648 C THR A 76 6.093 -7.456 -8.675 1.00 0.00 C ATOM 649 O THR A 76 7.111 -7.794 -9.281 1.00 0.00 O ATOM 650 CB THR A 76 5.501 -8.631 -6.550 1.00 0.00 C ATOM 651 OG1 THR A 76 6.576 -9.532 -6.367 1.00 0.00 O ATOM 652 CG2 THR A 76 4.295 -9.116 -5.745 1.00 0.00 C ATOM 0 H THR A 76 6.166 -10.023 -9.029 1.00 0.00 H new ATOM 0 HA THR A 76 4.132 -8.134 -8.122 1.00 0.00 H new ATOM 0 HB THR A 76 5.788 -7.644 -6.188 1.00 0.00 H new ATOM 0 HG1 THR A 76 6.777 -9.612 -5.411 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.572 -9.209 -4.695 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.480 -8.399 -5.843 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.972 -10.086 -6.123 1.00 0.00 H new ATOM 660 N ASP A 77 5.728 -6.188 -8.514 1.00 0.00 N ATOM 661 CA ASP A 77 6.395 -5.014 -9.072 1.00 0.00 C ATOM 662 C ASP A 77 6.583 -3.949 -7.988 1.00 0.00 C ATOM 663 O ASP A 77 5.642 -3.596 -7.277 1.00 0.00 O ATOM 664 CB ASP A 77 5.509 -4.469 -10.193 1.00 0.00 C ATOM 665 CG ASP A 77 6.119 -3.302 -10.979 1.00 0.00 C ATOM 666 OD1 ASP A 77 7.336 -3.339 -11.283 1.00 0.00 O ATOM 667 OD2 ASP A 77 5.355 -2.363 -11.311 1.00 0.00 O1- ATOM 0 H ASP A 77 4.911 -5.936 -7.958 1.00 0.00 H new ATOM 0 HA ASP A 77 7.379 -5.282 -9.457 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.284 -5.279 -10.887 1.00 0.00 H new ATOM 0 HB3 ASP A 77 4.561 -4.145 -9.764 1.00 0.00 H new ATOM 672 N LYS A 78 7.807 -3.444 -7.854 1.00 0.00 N ATOM 673 CA LYS A 78 8.218 -2.554 -6.759 1.00 0.00 C ATOM 674 C LYS A 78 7.893 -1.086 -7.082 1.00 0.00 C ATOM 675 O LYS A 78 8.359 -0.537 -8.082 1.00 0.00 O ATOM 676 CB LYS A 78 9.706 -2.803 -6.450 1.00 0.00 C ATOM 677 CG LYS A 78 10.113 -2.275 -5.067 1.00 0.00 C ATOM 678 CD LYS A 78 11.535 -2.745 -4.721 1.00 0.00 C ATOM 679 CE LYS A 78 11.853 -2.526 -3.238 1.00 0.00 C ATOM 680 NZ LYS A 78 12.222 -1.124 -2.933 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.559 -3.643 -8.514 1.00 0.00 H new ATOM 0 HA LYS A 78 7.649 -2.778 -5.856 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.911 -3.872 -6.502 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.318 -2.323 -7.214 1.00 0.00 H new ATOM 0 HG2 LYS A 78 10.069 -1.186 -5.057 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.411 -2.629 -4.312 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.639 -3.802 -4.964 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.257 -2.204 -5.333 1.00 0.00 H new ATOM 0 HE2 LYS A 78 10.987 -2.808 -2.639 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.671 -3.185 -2.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 12.163 -0.965 -1.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.194 -0.943 -3.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 11.569 -0.479 -3.422 1.00 0.00 H new ATOM 694 N LEU A 79 7.089 -0.453 -6.224 1.00 0.00 N ATOM 695 CA LEU A 79 6.471 0.857 -6.462 1.00 0.00 C ATOM 696 C LEU A 79 7.242 2.011 -5.818 1.00 0.00 C ATOM 697 O LEU A 79 7.519 3.009 -6.481 1.00 0.00 O ATOM 698 CB LEU A 79 5.047 0.812 -5.883 1.00 0.00 C ATOM 699 CG LEU A 79 4.135 -0.266 -6.492 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.897 -0.369 -5.599 1.00 0.00 C ATOM 701 CD2 LEU A 79 3.761 0.073 -7.942 1.00 0.00 C ATOM 0 H LEU A 79 6.842 -0.848 -5.317 1.00 0.00 H new ATOM 0 HA LEU A 79 6.472 1.044 -7.536 1.00 0.00 H new ATOM 0 HB2 LEU A 79 5.113 0.647 -4.808 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.580 1.786 -6.028 1.00 0.00 H new ATOM 0 HG LEU A 79 4.651 -1.225 -6.532 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.222 -1.126 -5.998 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.199 -0.648 -4.589 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.387 0.594 -5.572 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.116 -0.708 -8.344 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.235 1.027 -7.968 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.667 0.141 -8.545 1.00 0.00 H new ATOM 713 N ALA A 80 7.588 1.857 -4.537 1.00 0.00 N ATOM 714 CA ALA A 80 8.189 2.881 -3.682 1.00 0.00 C ATOM 715 C ALA A 80 8.659 2.278 -2.349 1.00 0.00 C ATOM 716 O ALA A 80 8.375 1.114 -2.044 1.00 0.00 O ATOM 717 CB ALA A 80 7.171 4.019 -3.471 1.00 0.00 C ATOM 0 H ALA A 80 7.450 0.974 -4.046 1.00 0.00 H new ATOM 0 HA ALA A 80 9.075 3.291 -4.168 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.611 4.787 -2.835 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.907 4.454 -4.435 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.275 3.622 -2.994 1.00 0.00 H new ATOM 723 N ALA A 81 9.360 3.085 -1.548 1.00 0.00 N ATOM 724 CA ALA A 81 9.942 2.694 -0.266 1.00 0.00 C ATOM 725 C ALA A 81 10.242 3.901 0.641 1.00 0.00 C ATOM 726 O ALA A 81 10.284 5.044 0.178 1.00 0.00 O ATOM 727 CB ALA A 81 11.211 1.875 -0.545 1.00 0.00 C ATOM 0 H ALA A 81 9.543 4.060 -1.784 1.00 0.00 H new ATOM 0 HA ALA A 81 9.217 2.091 0.281 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.663 1.572 0.399 1.00 0.00 H new ATOM 0 HB2 ALA A 81 10.952 0.989 -1.124 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.920 2.482 -1.108 1.00 0.00 H new ATOM 733 N PHE A 82 10.488 3.626 1.924 1.00 0.00 N ATOM 734 CA PHE A 82 10.991 4.573 2.918 1.00 0.00 C ATOM 735 C PHE A 82 12.015 3.871 3.840 1.00 0.00 C ATOM 736 O PHE A 82 11.637 2.902 4.506 1.00 0.00 O ATOM 737 CB PHE A 82 9.818 5.143 3.725 1.00 0.00 C ATOM 738 CG PHE A 82 10.221 6.263 4.665 1.00 0.00 C ATOM 739 CD1 PHE A 82 10.702 5.975 5.957 1.00 0.00 C ATOM 740 CD2 PHE A 82 10.142 7.601 4.233 1.00 0.00 C ATOM 741 CE1 PHE A 82 11.088 7.019 6.816 1.00 0.00 C ATOM 742 CE2 PHE A 82 10.521 8.645 5.096 1.00 0.00 C ATOM 743 CZ PHE A 82 10.992 8.355 6.387 1.00 0.00 C ATOM 0 H PHE A 82 10.335 2.696 2.314 1.00 0.00 H new ATOM 0 HA PHE A 82 11.496 5.399 2.417 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.058 5.513 3.036 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.360 4.340 4.303 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.775 4.950 6.289 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.790 7.826 3.237 1.00 0.00 H new ATOM 0 HE1 PHE A 82 11.458 6.795 7.805 1.00 0.00 H new ATOM 0 HE2 PHE A 82 10.450 9.671 4.766 1.00 0.00 H new ATOM 0 HZ PHE A 82 11.280 9.157 7.050 1.00 0.00 H new ATOM 753 N PRO A 83 13.280 4.338 3.926 1.00 0.00 N ATOM 754 CA PRO A 83 13.912 5.365 3.091 1.00 0.00 C ATOM 755 C PRO A 83 13.817 5.058 1.589 1.00 0.00 C ATOM 756 O PRO A 83 13.680 3.899 1.198 1.00 0.00 O ATOM 757 CB PRO A 83 15.376 5.430 3.547 1.00 0.00 C ATOM 758 CG PRO A 83 15.328 4.914 4.983 1.00 0.00 C ATOM 759 CD PRO A 83 14.233 3.852 4.914 1.00 0.00 C ATOM 0 HA PRO A 83 13.399 6.319 3.215 1.00 0.00 H new ATOM 0 HB2 PRO A 83 16.019 4.812 2.920 1.00 0.00 H new ATOM 0 HB3 PRO A 83 15.766 6.447 3.499 1.00 0.00 H new ATOM 0 HG2 PRO A 83 16.283 4.492 5.295 1.00 0.00 H new ATOM 0 HG3 PRO A 83 15.082 5.705 5.691 1.00 0.00 H new ATOM 0 HD2 PRO A 83 14.642 2.885 4.622 1.00 0.00 H new ATOM 0 HD3 PRO A 83 13.757 3.716 5.885 1.00 0.00 H new ATOM 907 N ARG A 94 4.365 8.673 -8.143 1.00 0.00 N ATOM 908 CA ARG A 94 2.907 8.591 -7.930 1.00 0.00 C ATOM 909 C ARG A 94 2.553 7.734 -6.713 1.00 0.00 C ATOM 910 O ARG A 94 1.600 8.046 -5.998 1.00 0.00 O ATOM 911 CB ARG A 94 2.179 7.997 -9.144 1.00 0.00 C ATOM 912 CG ARG A 94 2.236 8.882 -10.398 1.00 0.00 C ATOM 913 CD ARG A 94 1.400 8.280 -11.537 1.00 0.00 C ATOM 914 NE ARG A 94 -0.029 8.190 -11.166 1.00 0.00 N ATOM 915 CZ ARG A 94 -0.778 7.095 -11.080 1.00 0.00 C ATOM 916 NH1 ARG A 94 -0.348 5.898 -11.422 1.00 0.00 N1+ ATOM 917 NH2 ARG A 94 -2.006 7.183 -10.632 1.00 0.00 N ATOM 0 HA ARG A 94 2.581 9.619 -7.769 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.615 7.025 -9.377 1.00 0.00 H new ATOM 0 HB3 ARG A 94 1.136 7.824 -8.881 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.867 9.880 -10.160 1.00 0.00 H new ATOM 0 HG3 ARG A 94 3.271 8.993 -10.722 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.507 8.892 -12.432 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.777 7.287 -11.782 1.00 0.00 H new ATOM 0 HE ARG A 94 -0.495 9.072 -10.951 1.00 0.00 H new ATOM 0 HH11 ARG A 94 0.602 5.778 -11.773 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -0.965 5.091 -11.336 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -2.383 8.088 -10.351 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.585 6.346 -10.564 1.00 0.00 H new ATOM 931 N PHE A 95 3.307 6.658 -6.488 1.00 0.00 N ATOM 932 CA PHE A 95 3.212 5.801 -5.310 1.00 0.00 C ATOM 933 C PHE A 95 4.205 6.307 -4.257 1.00 0.00 C ATOM 934 O PHE A 95 5.368 6.551 -4.575 1.00 0.00 O ATOM 935 CB PHE A 95 3.502 4.351 -5.724 1.00 0.00 C ATOM 936 CG PHE A 95 2.512 3.788 -6.731 1.00 0.00 C ATOM 937 CD1 PHE A 95 2.724 3.961 -8.113 1.00 0.00 C ATOM 938 CD2 PHE A 95 1.363 3.103 -6.292 1.00 0.00 C ATOM 939 CE1 PHE A 95 1.791 3.471 -9.043 1.00 0.00 C ATOM 940 CE2 PHE A 95 0.432 2.607 -7.222 1.00 0.00 C ATOM 941 CZ PHE A 95 0.642 2.794 -8.598 1.00 0.00 C ATOM 0 H PHE A 95 4.025 6.350 -7.144 1.00 0.00 H new ATOM 0 HA PHE A 95 2.212 5.831 -4.878 1.00 0.00 H new ATOM 0 HB2 PHE A 95 4.505 4.298 -6.147 1.00 0.00 H new ATOM 0 HB3 PHE A 95 3.498 3.722 -4.834 1.00 0.00 H new ATOM 0 HD1 PHE A 95 3.609 4.473 -8.460 1.00 0.00 H new ATOM 0 HD2 PHE A 95 1.196 2.958 -5.235 1.00 0.00 H new ATOM 0 HE1 PHE A 95 1.957 3.615 -10.100 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -0.446 2.081 -6.877 1.00 0.00 H new ATOM 0 HZ PHE A 95 -0.077 2.419 -9.312 1.00 0.00 H new ATOM 951 N ARG A 96 3.751 6.491 -3.014 1.00 0.00 N ATOM 952 CA ARG A 96 4.543 7.023 -1.895 1.00 0.00 C ATOM 953 C ARG A 96 4.405 6.147 -0.648 1.00 0.00 C ATOM 954 O ARG A 96 3.376 5.508 -0.437 1.00 0.00 O ATOM 955 CB ARG A 96 4.086 8.456 -1.560 1.00 0.00 C ATOM 956 CG ARG A 96 4.284 9.501 -2.671 1.00 0.00 C ATOM 957 CD ARG A 96 5.734 9.949 -2.902 1.00 0.00 C ATOM 958 NE ARG A 96 6.526 8.947 -3.633 1.00 0.00 N ATOM 959 CZ ARG A 96 7.844 8.809 -3.631 1.00 0.00 C ATOM 960 NH1 ARG A 96 8.623 9.595 -2.920 1.00 0.00 N ATOM 961 NH2 ARG A 96 8.398 7.864 -4.357 1.00 0.00 N1+ ATOM 0 H ARG A 96 2.792 6.268 -2.748 1.00 0.00 H new ATOM 0 HA ARG A 96 5.589 7.028 -2.202 1.00 0.00 H new ATOM 0 HB2 ARG A 96 3.028 8.428 -1.299 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.624 8.790 -0.673 1.00 0.00 H new ATOM 0 HG2 ARG A 96 3.895 9.093 -3.604 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.684 10.379 -2.432 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.737 10.886 -3.459 1.00 0.00 H new ATOM 0 HD3 ARG A 96 6.206 10.149 -1.940 1.00 0.00 H new ATOM 0 HE ARG A 96 6.002 8.285 -4.205 1.00 0.00 H new ATOM 0 HH11 ARG A 96 8.216 10.336 -2.349 1.00 0.00 H new ATOM 0 HH12 ARG A 96 9.634 9.464 -2.939 1.00 0.00 H new ATOM 0 HH21 ARG A 96 7.814 7.243 -4.917 1.00 0.00 H new ATOM 0 HH22 ARG A 96 9.412 7.752 -4.360 1.00 0.00 H new ATOM 975 N VAL A 97 5.442 6.158 0.188 1.00 0.00 N ATOM 976 CA VAL A 97 5.503 5.462 1.489 1.00 0.00 C ATOM 977 C VAL A 97 5.892 6.473 2.575 1.00 0.00 C ATOM 978 O VAL A 97 6.935 7.117 2.455 1.00 0.00 O ATOM 979 CB VAL A 97 6.501 4.278 1.457 1.00 0.00 C ATOM 980 CG1 VAL A 97 6.595 3.579 2.823 1.00 0.00 C ATOM 981 CG2 VAL A 97 6.102 3.236 0.397 1.00 0.00 C ATOM 0 H VAL A 97 6.299 6.669 -0.023 1.00 0.00 H new ATOM 0 HA VAL A 97 4.522 5.043 1.711 1.00 0.00 H new ATOM 0 HB VAL A 97 7.473 4.702 1.203 1.00 0.00 H new ATOM 0 HG11 VAL A 97 7.305 2.754 2.761 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.933 4.293 3.574 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.614 3.194 3.103 1.00 0.00 H new ATOM 0 HG21 VAL A 97 6.823 2.419 0.401 1.00 0.00 H new ATOM 0 HG22 VAL A 97 5.110 2.846 0.625 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.090 3.704 -0.587 1.00 0.00 H new ATOM 991 N THR A 98 5.059 6.614 3.617 1.00 0.00 N ATOM 992 CA THR A 98 5.259 7.576 4.718 1.00 0.00 C ATOM 993 C THR A 98 5.302 6.857 6.065 1.00 0.00 C ATOM 994 O THR A 98 4.370 6.131 6.398 1.00 0.00 O ATOM 995 CB THR A 98 4.135 8.622 4.710 1.00 0.00 C ATOM 996 OG1 THR A 98 4.162 9.311 3.478 1.00 0.00 O ATOM 997 CG2 THR A 98 4.289 9.672 5.812 1.00 0.00 C ATOM 0 H THR A 98 4.213 6.055 3.723 1.00 0.00 H new ATOM 0 HA THR A 98 6.215 8.079 4.569 1.00 0.00 H new ATOM 0 HB THR A 98 3.202 8.082 4.871 1.00 0.00 H new ATOM 0 HG1 THR A 98 3.447 9.981 3.462 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.465 10.383 5.755 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.278 9.182 6.786 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.234 10.200 5.682 1.00 0.00 H new ATOM 1005 N GLN A 99 6.356 7.097 6.848 1.00 0.00 N ATOM 1006 CA GLN A 99 6.511 6.645 8.239 1.00 0.00 C ATOM 1007 C GLN A 99 5.652 7.514 9.173 1.00 0.00 C ATOM 1008 O GLN A 99 5.677 8.746 9.081 1.00 0.00 O ATOM 1009 CB GLN A 99 8.009 6.748 8.602 1.00 0.00 C ATOM 1010 CG GLN A 99 8.388 6.580 10.085 1.00 0.00 C ATOM 1011 CD GLN A 99 8.276 5.151 10.625 1.00 0.00 C ATOM 1012 OE1 GLN A 99 7.206 4.638 10.920 1.00 0.00 O ATOM 1013 NE2 GLN A 99 9.384 4.464 10.813 1.00 0.00 N ATOM 0 H GLN A 99 7.159 7.633 6.520 1.00 0.00 H new ATOM 0 HA GLN A 99 6.175 5.614 8.353 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.548 5.994 8.028 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.371 7.721 8.269 1.00 0.00 H new ATOM 0 HG2 GLN A 99 9.413 6.925 10.224 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.749 7.229 10.683 1.00 0.00 H new ATOM 0 HE21 GLN A 99 10.286 4.875 10.573 1.00 0.00 H new ATOM 0 HE22 GLN A 99 9.340 3.521 11.199 1.00 0.00 H new ATOM 1022 N LEU A 100 4.924 6.885 10.103 1.00 0.00 N ATOM 1023 CA LEU A 100 4.117 7.573 11.121 1.00 0.00 C ATOM 1024 C LEU A 100 4.923 7.846 12.412 1.00 0.00 C ATOM 1025 O LEU A 100 5.952 7.197 12.636 1.00 0.00 O ATOM 1026 CB LEU A 100 2.849 6.741 11.418 1.00 0.00 C ATOM 1027 CG LEU A 100 1.957 6.433 10.199 1.00 0.00 C ATOM 1028 CD1 LEU A 100 0.633 5.821 10.675 1.00 0.00 C ATOM 1029 CD2 LEU A 100 1.655 7.659 9.323 1.00 0.00 C ATOM 0 H LEU A 100 4.877 5.868 10.172 1.00 0.00 H new ATOM 0 HA LEU A 100 3.824 8.547 10.728 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.153 5.798 11.872 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.252 7.273 12.158 1.00 0.00 H new ATOM 0 HG LEU A 100 2.518 5.734 9.579 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.002 5.603 9.813 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.834 4.899 11.220 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.121 6.526 11.330 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.023 7.362 8.486 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.139 8.413 9.918 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.589 8.073 8.943 1.00 0.00 H new ATOM 1041 N PRO A 101 4.440 8.738 13.308 1.00 0.00 N ATOM 1042 CA PRO A 101 5.021 8.958 14.638 1.00 0.00 C ATOM 1043 C PRO A 101 5.132 7.690 15.492 1.00 0.00 C ATOM 1044 O PRO A 101 5.936 7.650 16.422 1.00 0.00 O ATOM 1045 CB PRO A 101 4.100 9.960 15.340 1.00 0.00 C ATOM 1046 CG PRO A 101 3.408 10.685 14.196 1.00 0.00 C ATOM 1047 CD PRO A 101 3.300 9.623 13.112 1.00 0.00 C ATOM 0 HA PRO A 101 6.044 9.315 14.517 1.00 0.00 H new ATOM 0 HB2 PRO A 101 3.381 9.457 15.987 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.665 10.650 15.967 1.00 0.00 H new ATOM 0 HG2 PRO A 101 2.427 11.057 14.492 1.00 0.00 H new ATOM 0 HG3 PRO A 101 3.986 11.545 13.858 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.361 9.075 13.194 1.00 0.00 H new ATOM 0 HD3 PRO A 101 3.321 10.074 12.120 1.00 0.00 H new ATOM 1055 N ASN A 102 4.341 6.654 15.179 1.00 0.00 N ATOM 1056 CA ASN A 102 4.399 5.357 15.871 1.00 0.00 C ATOM 1057 C ASN A 102 5.781 4.658 15.766 1.00 0.00 C ATOM 1058 O ASN A 102 6.157 3.894 16.659 1.00 0.00 O ATOM 1059 CB ASN A 102 3.299 4.462 15.277 1.00 0.00 C ATOM 1060 CG ASN A 102 3.253 3.086 15.939 1.00 0.00 C ATOM 1061 OD1 ASN A 102 3.909 2.149 15.501 1.00 0.00 O ATOM 1062 ND2 ASN A 102 2.507 2.935 17.018 1.00 0.00 N ATOM 0 H ASN A 102 3.641 6.691 14.438 1.00 0.00 H new ATOM 0 HA ASN A 102 4.243 5.531 16.936 1.00 0.00 H new ATOM 0 HB2 ASN A 102 2.332 4.952 15.394 1.00 0.00 H new ATOM 0 HB3 ASN A 102 3.469 4.343 14.207 1.00 0.00 H new ATOM 0 HD21 ASN A 102 2.474 2.033 17.493 1.00 0.00 H new ATOM 0 HD22 ASN A 102 1.964 3.720 17.376 1.00 0.00 H new ATOM 1069 N GLY A 103 6.559 4.943 14.713 1.00 0.00 N ATOM 1070 CA GLY A 103 7.943 4.471 14.522 1.00 0.00 C ATOM 1071 C GLY A 103 8.065 3.131 13.783 1.00 0.00 C ATOM 1072 O GLY A 103 9.136 2.827 13.259 1.00 0.00 O ATOM 0 H GLY A 103 6.234 5.528 13.943 1.00 0.00 H new ATOM 0 HA2 GLY A 103 8.498 5.228 13.968 1.00 0.00 H new ATOM 0 HA3 GLY A 103 8.419 4.377 15.498 1.00 0.00 H new ATOM 1076 N ARG A 104 6.976 2.358 13.698 1.00 0.00 N ATOM 1077 CA ARG A 104 6.850 1.165 12.849 1.00 0.00 C ATOM 1078 C ARG A 104 5.374 0.963 12.479 1.00 0.00 C ATOM 1079 O ARG A 104 4.693 0.036 12.918 1.00 0.00 O ATOM 1080 CB ARG A 104 7.525 -0.069 13.494 1.00 0.00 C ATOM 1081 CG ARG A 104 7.239 -0.281 14.992 1.00 0.00 C ATOM 1082 CD ARG A 104 8.009 -1.491 15.539 1.00 0.00 C ATOM 1083 NE ARG A 104 8.013 -1.475 17.015 1.00 0.00 N ATOM 1084 CZ ARG A 104 9.077 -1.491 17.813 1.00 0.00 C ATOM 1085 NH1 ARG A 104 10.289 -1.757 17.376 1.00 0.00 N ATOM 1086 NH2 ARG A 104 8.938 -1.232 19.093 1.00 0.00 N1+ ATOM 0 H ARG A 104 6.131 2.551 14.235 1.00 0.00 H new ATOM 0 HA ARG A 104 7.394 1.310 11.916 1.00 0.00 H new ATOM 0 HB2 ARG A 104 7.205 -0.959 12.953 1.00 0.00 H new ATOM 0 HB3 ARG A 104 8.603 0.017 13.358 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.519 0.613 15.548 1.00 0.00 H new ATOM 0 HG3 ARG A 104 6.170 -0.429 15.143 1.00 0.00 H new ATOM 0 HD2 ARG A 104 7.552 -2.413 15.180 1.00 0.00 H new ATOM 0 HD3 ARG A 104 9.033 -1.477 15.166 1.00 0.00 H new ATOM 0 HE ARG A 104 7.102 -1.449 17.472 1.00 0.00 H new ATOM 0 HH11 ARG A 104 10.442 -1.962 16.389 1.00 0.00 H new ATOM 0 HH12 ARG A 104 11.076 -1.758 18.025 1.00 0.00 H new ATOM 0 HH21 ARG A 104 8.016 -1.019 19.473 1.00 0.00 H new ATOM 0 HH22 ARG A 104 9.752 -1.244 19.707 1.00 0.00 H new ATOM 1100 N ASP A 105 4.927 1.836 11.581 1.00 0.00 N ATOM 1101 CA ASP A 105 3.579 1.950 11.017 1.00 0.00 C ATOM 1102 C ASP A 105 3.655 2.941 9.852 1.00 0.00 C ATOM 1103 O ASP A 105 4.344 3.961 9.946 1.00 0.00 O ATOM 1104 CB ASP A 105 2.563 2.417 12.068 1.00 0.00 C ATOM 1105 CG ASP A 105 1.138 1.918 11.779 1.00 0.00 C ATOM 1106 OD1 ASP A 105 0.556 2.314 10.745 1.00 0.00 O ATOM 1107 OD2 ASP A 105 0.600 1.144 12.606 1.00 0.00 O1- ATOM 0 H ASP A 105 5.550 2.545 11.194 1.00 0.00 H new ATOM 0 HA ASP A 105 3.236 0.975 10.672 1.00 0.00 H new ATOM 0 HB2 ASP A 105 2.875 2.064 13.051 1.00 0.00 H new ATOM 0 HB3 ASP A 105 2.561 3.506 12.107 1.00 0.00 H new ATOM 1112 N PHE A 106 2.986 2.617 8.750 1.00 0.00 N ATOM 1113 CA PHE A 106 3.178 3.302 7.472 1.00 0.00 C ATOM 1114 C PHE A 106 1.894 3.516 6.669 1.00 0.00 C ATOM 1115 O PHE A 106 1.009 2.662 6.628 1.00 0.00 O ATOM 1116 CB PHE A 106 4.190 2.510 6.625 1.00 0.00 C ATOM 1117 CG PHE A 106 5.621 2.563 7.127 1.00 0.00 C ATOM 1118 CD1 PHE A 106 6.043 1.738 8.189 1.00 0.00 C ATOM 1119 CD2 PHE A 106 6.537 3.446 6.527 1.00 0.00 C ATOM 1120 CE1 PHE A 106 7.361 1.822 8.667 1.00 0.00 C ATOM 1121 CE2 PHE A 106 7.863 3.507 6.986 1.00 0.00 C ATOM 1122 CZ PHE A 106 8.275 2.703 8.062 1.00 0.00 C ATOM 0 H PHE A 106 2.293 1.870 8.716 1.00 0.00 H new ATOM 0 HA PHE A 106 3.548 4.299 7.710 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.872 1.468 6.585 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.164 2.890 5.604 1.00 0.00 H new ATOM 0 HD1 PHE A 106 5.351 1.040 8.636 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.220 4.079 5.711 1.00 0.00 H new ATOM 0 HE1 PHE A 106 7.673 1.209 9.500 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.568 4.173 6.511 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.291 2.761 8.424 1.00 0.00 H new ATOM 1132 N HIS A 107 1.850 4.649 5.964 1.00 0.00 N ATOM 1133 CA HIS A 107 0.848 4.967 4.947 1.00 0.00 C ATOM 1134 C HIS A 107 1.434 4.778 3.534 1.00 0.00 C ATOM 1135 O HIS A 107 2.423 5.422 3.168 1.00 0.00 O ATOM 1136 CB HIS A 107 0.341 6.404 5.153 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.674 6.568 6.257 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.331 5.540 6.940 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -1.141 7.766 6.715 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.166 6.146 7.799 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -2.073 7.484 7.690 1.00 0.00 N ATOM 0 H HIS A 107 2.535 5.395 6.091 1.00 0.00 H new ATOM 0 HA HIS A 107 0.004 4.285 5.047 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.195 7.048 5.366 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -0.099 6.756 4.220 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -0.838 8.746 6.378 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -2.823 5.630 8.484 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -2.599 8.168 8.233 1.00 0.00 H new ATOM 1149 N MET A 108 0.807 3.904 2.746 1.00 0.00 N ATOM 1150 CA MET A 108 1.126 3.608 1.346 1.00 0.00 C ATOM 1151 C MET A 108 0.116 4.349 0.465 1.00 0.00 C ATOM 1152 O MET A 108 -1.041 3.940 0.372 1.00 0.00 O ATOM 1153 CB MET A 108 1.059 2.086 1.129 1.00 0.00 C ATOM 1154 CG MET A 108 2.375 1.371 1.461 1.00 0.00 C ATOM 1155 SD MET A 108 2.926 1.479 3.183 1.00 0.00 S ATOM 1156 CE MET A 108 4.491 0.583 3.049 1.00 0.00 C ATOM 0 H MET A 108 0.019 3.352 3.085 1.00 0.00 H new ATOM 0 HA MET A 108 2.131 3.939 1.085 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.262 1.672 1.747 1.00 0.00 H new ATOM 0 HB3 MET A 108 0.795 1.885 0.091 1.00 0.00 H new ATOM 0 HG2 MET A 108 2.269 0.318 1.200 1.00 0.00 H new ATOM 0 HG3 MET A 108 3.159 1.780 0.823 1.00 0.00 H new ATOM 0 HE1 MET A 108 5.224 1.028 3.723 1.00 0.00 H new ATOM 0 HE2 MET A 108 4.336 -0.462 3.319 1.00 0.00 H new ATOM 0 HE3 MET A 108 4.858 0.642 2.024 1.00 0.00 H new ATOM 1166 N SER A 109 0.533 5.452 -0.153 1.00 0.00 N ATOM 1167 CA SER A 109 -0.359 6.421 -0.812 1.00 0.00 C ATOM 1168 C SER A 109 -0.177 6.507 -2.343 1.00 0.00 C ATOM 1169 O SER A 109 0.906 6.848 -2.819 1.00 0.00 O ATOM 1170 CB SER A 109 -0.118 7.823 -0.223 1.00 0.00 C ATOM 1171 OG SER A 109 -0.167 7.835 1.199 1.00 0.00 O ATOM 0 H SER A 109 1.518 5.708 -0.214 1.00 0.00 H new ATOM 0 HA SER A 109 -1.373 6.066 -0.626 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.854 8.189 -0.552 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.867 8.511 -0.614 1.00 0.00 H new ATOM 0 HG SER A 109 -0.007 8.746 1.524 1.00 0.00 H new ATOM 1177 N VAL A 110 -1.237 6.259 -3.123 1.00 0.00 N ATOM 1178 CA VAL A 110 -1.307 6.533 -4.570 1.00 0.00 C ATOM 1179 C VAL A 110 -1.812 7.966 -4.743 1.00 0.00 C ATOM 1180 O VAL A 110 -2.938 8.275 -4.349 1.00 0.00 O ATOM 1181 CB VAL A 110 -2.262 5.593 -5.356 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -2.052 5.771 -6.873 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -2.106 4.109 -5.001 1.00 0.00 C ATOM 0 H VAL A 110 -2.097 5.850 -2.757 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.308 6.370 -4.973 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.271 5.885 -5.064 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.726 5.107 -7.414 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.260 6.804 -7.150 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.021 5.527 -7.129 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.806 3.518 -5.591 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.087 3.788 -5.219 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -2.313 3.965 -3.941 1.00 0.00 H new ATOM 1193 N VAL A 111 -0.995 8.827 -5.347 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.368 10.201 -5.719 1.00 0.00 C ATOM 1195 C VAL A 111 -2.199 10.167 -7.008 1.00 0.00 C ATOM 1196 O VAL A 111 -1.702 9.740 -8.051 1.00 0.00 O ATOM 1197 CB VAL A 111 -0.121 11.106 -5.880 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.506 12.533 -6.308 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.676 11.187 -4.565 1.00 0.00 C ATOM 0 H VAL A 111 -0.035 8.590 -5.599 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.967 10.632 -4.917 1.00 0.00 H new ATOM 0 HB VAL A 111 0.494 10.653 -6.658 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.395 13.138 -6.411 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.030 12.498 -7.263 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.156 12.976 -5.554 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.546 11.828 -4.706 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.043 11.602 -3.781 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.004 10.188 -4.276 1.00 0.00 H new ATOM 1209 N ARG A 112 -3.461 10.617 -6.920 1.00 0.00 N ATOM 1210 CA ARG A 112 -4.445 10.707 -8.015 1.00 0.00 C ATOM 1211 C ARG A 112 -4.524 9.407 -8.819 1.00 0.00 C ATOM 1212 O ARG A 112 -3.959 9.285 -9.912 1.00 0.00 O ATOM 1213 CB ARG A 112 -4.192 11.953 -8.881 1.00 0.00 C ATOM 1214 CG ARG A 112 -4.280 13.221 -8.018 1.00 0.00 C ATOM 1215 CD ARG A 112 -4.515 14.487 -8.849 1.00 0.00 C ATOM 1216 NE ARG A 112 -5.927 14.585 -9.260 1.00 0.00 N ATOM 1217 CZ ARG A 112 -6.435 15.355 -10.214 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -5.682 16.134 -10.963 1.00 0.00 N1+ ATOM 1219 NH2 ARG A 112 -7.733 15.350 -10.421 1.00 0.00 N ATOM 0 H ARG A 112 -3.845 10.947 -6.034 1.00 0.00 H new ATOM 0 HA ARG A 112 -5.435 10.834 -7.576 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -3.209 11.888 -9.347 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -4.924 12.000 -9.687 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -5.090 13.109 -7.297 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -3.358 13.332 -7.447 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -4.238 15.366 -8.267 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -3.874 14.473 -9.731 1.00 0.00 H new ATOM 0 HE ARG A 112 -6.588 13.995 -8.755 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -4.673 16.159 -10.819 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -6.108 16.712 -11.687 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -8.338 14.759 -9.851 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -8.135 15.938 -11.151 1.00 0.00 H new ATOM 1233 N ALA A 113 -5.196 8.412 -8.251 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.325 7.073 -8.819 1.00 0.00 C ATOM 1235 C ALA A 113 -6.213 7.066 -10.076 1.00 0.00 C ATOM 1236 O ALA A 113 -7.242 7.737 -10.117 1.00 0.00 O ATOM 1237 CB ALA A 113 -5.851 6.148 -7.717 1.00 0.00 C ATOM 0 H ALA A 113 -5.679 8.516 -7.359 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.354 6.713 -9.159 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -5.959 5.137 -8.111 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.149 6.140 -6.883 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.820 6.508 -7.372 1.00 0.00 H new ATOM 1243 N ARG A 114 -5.805 6.321 -11.103 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.511 6.141 -12.382 1.00 0.00 C ATOM 1245 C ARG A 114 -6.980 4.688 -12.528 1.00 0.00 C ATOM 1246 O ARG A 114 -6.445 3.802 -11.862 1.00 0.00 O ATOM 1247 CB ARG A 114 -5.588 6.574 -13.542 1.00 0.00 C ATOM 1248 CG ARG A 114 -6.006 7.910 -14.183 1.00 0.00 C ATOM 1249 CD ARG A 114 -6.105 9.109 -13.225 1.00 0.00 C ATOM 1250 NE ARG A 114 -4.816 9.487 -12.624 1.00 0.00 N ATOM 1251 CZ ARG A 114 -3.871 10.257 -13.150 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -3.906 10.673 -14.398 1.00 0.00 N1+ ATOM 1253 NH2 ARG A 114 -2.867 10.627 -12.387 1.00 0.00 N ATOM 0 H ARG A 114 -4.930 5.798 -11.069 1.00 0.00 H new ATOM 0 HA ARG A 114 -7.401 6.769 -12.408 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -4.566 6.660 -13.172 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.586 5.797 -14.306 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -5.291 8.154 -14.968 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -6.974 7.773 -14.665 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -6.509 9.964 -13.766 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -6.812 8.872 -12.430 1.00 0.00 H new ATOM 0 HE ARG A 114 -4.626 9.114 -11.694 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -4.682 10.405 -15.003 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -3.157 11.264 -14.760 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -2.826 10.323 -11.414 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -2.128 11.219 -12.768 1.00 0.00 H new ATOM 1267 N ARG A 115 -7.947 4.404 -13.409 1.00 0.00 N ATOM 1268 CA ARG A 115 -8.492 3.042 -13.603 1.00 0.00 C ATOM 1269 C ARG A 115 -7.435 1.979 -13.971 1.00 0.00 C ATOM 1270 O ARG A 115 -7.622 0.801 -13.666 1.00 0.00 O ATOM 1271 CB ARG A 115 -9.641 3.088 -14.625 1.00 0.00 C ATOM 1272 CG ARG A 115 -10.933 3.581 -13.948 1.00 0.00 C ATOM 1273 CD ARG A 115 -12.062 3.842 -14.949 1.00 0.00 C ATOM 1274 NE ARG A 115 -11.846 5.112 -15.655 1.00 0.00 N ATOM 1275 CZ ARG A 115 -12.581 5.650 -16.616 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -13.544 4.989 -17.226 1.00 0.00 N1+ ATOM 1277 NH2 ARG A 115 -12.341 6.894 -16.956 1.00 0.00 N ATOM 0 H ARG A 115 -8.378 5.107 -14.010 1.00 0.00 H new ATOM 0 HA ARG A 115 -8.875 2.714 -12.637 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.378 3.750 -15.450 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -9.800 2.097 -15.050 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -11.263 2.840 -13.220 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -10.723 4.497 -13.397 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -12.113 3.025 -15.668 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -13.019 3.868 -14.427 1.00 0.00 H new ATOM 0 HE ARG A 115 -11.026 5.647 -15.369 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -13.747 4.025 -16.962 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -14.087 5.442 -17.962 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -11.605 7.419 -16.484 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -12.890 7.336 -17.693 1.00 0.00 H new ATOM 1291 N ASN A 116 -6.292 2.389 -14.531 1.00 0.00 N ATOM 1292 CA ASN A 116 -5.121 1.531 -14.761 1.00 0.00 C ATOM 1293 C ASN A 116 -4.446 1.009 -13.465 1.00 0.00 C ATOM 1294 O ASN A 116 -3.785 -0.029 -13.503 1.00 0.00 O ATOM 1295 CB ASN A 116 -4.126 2.330 -15.620 1.00 0.00 C ATOM 1296 CG ASN A 116 -2.922 1.499 -16.061 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -1.810 1.674 -15.573 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -3.103 0.578 -16.992 1.00 0.00 N ATOM 0 H ASN A 116 -6.150 3.349 -14.845 1.00 0.00 H new ATOM 0 HA ASN A 116 -5.457 0.628 -15.271 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -4.640 2.712 -16.502 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -3.777 3.194 -15.054 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -2.317 0.010 -17.307 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -4.029 0.436 -17.395 1.00 0.00 H new ATOM 1305 N ASP A 117 -4.609 1.689 -12.319 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.001 1.305 -11.035 1.00 0.00 C ATOM 1307 C ASP A 117 -4.793 0.214 -10.285 1.00 0.00 C ATOM 1308 O ASP A 117 -4.247 -0.407 -9.377 1.00 0.00 O ATOM 1309 CB ASP A 117 -3.852 2.536 -10.122 1.00 0.00 C ATOM 1310 CG ASP A 117 -2.991 3.665 -10.706 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -1.847 3.419 -11.153 1.00 0.00 O ATOM 1312 OD2 ASP A 117 -3.447 4.829 -10.673 1.00 0.00 O1- ATOM 0 H ASP A 117 -5.176 2.535 -12.258 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.023 0.889 -11.278 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.844 2.930 -9.901 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.417 2.218 -9.174 1.00 0.00 H new ATOM 1317 N SER A 118 -6.059 -0.041 -10.629 1.00 0.00 N ATOM 1318 CA SER A 118 -6.885 -1.055 -9.949 1.00 0.00 C ATOM 1319 C SER A 118 -6.279 -2.472 -10.035 1.00 0.00 C ATOM 1320 O SER A 118 -5.846 -2.919 -11.105 1.00 0.00 O ATOM 1321 CB SER A 118 -8.308 -1.078 -10.528 1.00 0.00 C ATOM 1322 OG SER A 118 -8.977 0.173 -10.396 1.00 0.00 O ATOM 0 H SER A 118 -6.543 0.446 -11.384 1.00 0.00 H new ATOM 0 HA SER A 118 -6.917 -0.767 -8.898 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.262 -1.351 -11.582 1.00 0.00 H new ATOM 0 HB3 SER A 118 -8.888 -1.850 -10.024 1.00 0.00 H new ATOM 0 HG SER A 118 -8.359 0.837 -10.024 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.263 -3.196 -8.907 1.00 0.00 N ATOM 1329 CA GLY A 119 -5.619 -4.512 -8.762 1.00 0.00 C ATOM 1330 C GLY A 119 -5.167 -4.809 -7.330 1.00 0.00 C ATOM 1331 O GLY A 119 -5.546 -4.089 -6.405 1.00 0.00 O ATOM 0 H GLY A 119 -6.709 -2.876 -8.047 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.314 -5.287 -9.084 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.756 -4.562 -9.426 1.00 0.00 H new ATOM 1335 N THR A 120 -4.378 -5.873 -7.138 1.00 0.00 N ATOM 1336 CA THR A 120 -3.889 -6.320 -5.817 1.00 0.00 C ATOM 1337 C THR A 120 -2.523 -5.721 -5.505 1.00 0.00 C ATOM 1338 O THR A 120 -1.693 -5.528 -6.393 1.00 0.00 O ATOM 1339 CB THR A 120 -3.824 -7.849 -5.713 1.00 0.00 C ATOM 1340 OG1 THR A 120 -4.955 -8.416 -6.345 1.00 0.00 O ATOM 1341 CG2 THR A 120 -3.817 -8.340 -4.261 1.00 0.00 C ATOM 0 H THR A 120 -4.053 -6.461 -7.905 1.00 0.00 H new ATOM 0 HA THR A 120 -4.609 -5.963 -5.081 1.00 0.00 H new ATOM 0 HB THR A 120 -2.894 -8.155 -6.193 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.911 -9.393 -6.279 1.00 0.00 H new ATOM 0 HG21 THR A 120 -3.770 -9.429 -4.245 1.00 0.00 H new ATOM 0 HG22 THR A 120 -2.949 -7.932 -3.743 1.00 0.00 H new ATOM 0 HG23 THR A 120 -4.727 -8.009 -3.761 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.285 -5.470 -4.223 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.084 -4.856 -3.659 1.00 0.00 C ATOM 1351 C TYR A 121 -0.687 -5.515 -2.319 1.00 0.00 C ATOM 1352 O TYR A 121 -1.533 -6.105 -1.640 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.354 -3.354 -3.431 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.500 -2.502 -4.681 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.716 -2.462 -5.396 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.416 -1.715 -5.114 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -2.828 -1.688 -6.565 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.538 -0.905 -6.260 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.737 -0.900 -6.999 1.00 0.00 C ATOM 1360 OH TYR A 121 -1.827 -0.140 -8.122 1.00 0.00 O ATOM 0 H TYR A 121 -2.968 -5.704 -3.502 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.261 -4.997 -4.359 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.265 -3.255 -2.841 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.540 -2.947 -2.832 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.565 -3.029 -5.044 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.514 -1.732 -4.565 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -3.748 -1.696 -7.131 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.290 -0.286 -6.573 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.707 -0.269 -8.534 1.00 0.00 H new ATOM 1370 N LEU A 122 0.578 -5.363 -1.908 1.00 0.00 N ATOM 1371 CA LEU A 122 1.110 -5.775 -0.596 1.00 0.00 C ATOM 1372 C LEU A 122 2.333 -4.935 -0.206 1.00 0.00 C ATOM 1373 O LEU A 122 3.043 -4.434 -1.077 1.00 0.00 O ATOM 1374 CB LEU A 122 1.374 -7.301 -0.563 1.00 0.00 C ATOM 1375 CG LEU A 122 2.526 -7.838 -1.450 1.00 0.00 C ATOM 1376 CD1 LEU A 122 3.891 -7.794 -0.746 1.00 0.00 C ATOM 1377 CD2 LEU A 122 2.233 -9.292 -1.851 1.00 0.00 C ATOM 0 H LEU A 122 1.289 -4.934 -2.500 1.00 0.00 H new ATOM 0 HA LEU A 122 0.356 -5.579 0.167 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.580 -7.586 0.469 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.456 -7.810 -0.857 1.00 0.00 H new ATOM 0 HG LEU A 122 2.578 -7.189 -2.324 1.00 0.00 H new ATOM 0 HD11 LEU A 122 4.658 -8.182 -1.416 1.00 0.00 H new ATOM 0 HD12 LEU A 122 4.130 -6.765 -0.479 1.00 0.00 H new ATOM 0 HD13 LEU A 122 3.855 -8.404 0.157 1.00 0.00 H new ATOM 0 HD21 LEU A 122 3.044 -9.668 -2.475 1.00 0.00 H new ATOM 0 HD22 LEU A 122 2.149 -9.907 -0.955 1.00 0.00 H new ATOM 0 HD23 LEU A 122 1.297 -9.334 -2.408 1.00 0.00 H new ATOM 1389 N CYS A 123 2.605 -4.795 1.092 1.00 0.00 N ATOM 1390 CA CYS A 123 3.843 -4.176 1.597 1.00 0.00 C ATOM 1391 C CYS A 123 4.869 -5.218 2.085 1.00 0.00 C ATOM 1392 O CYS A 123 4.506 -6.352 2.416 1.00 0.00 O ATOM 1393 CB CYS A 123 3.518 -3.129 2.671 1.00 0.00 C ATOM 1394 SG CYS A 123 2.705 -3.714 4.181 1.00 0.00 S ATOM 0 H CYS A 123 1.974 -5.107 1.830 1.00 0.00 H new ATOM 0 HA CYS A 123 4.322 -3.663 0.763 1.00 0.00 H new ATOM 0 HB2 CYS A 123 4.449 -2.639 2.957 1.00 0.00 H new ATOM 0 HB3 CYS A 123 2.882 -2.368 2.219 1.00 0.00 H new ATOM 1399 N GLY A 124 6.152 -4.834 2.126 1.00 0.00 N ATOM 1400 CA GLY A 124 7.274 -5.683 2.559 1.00 0.00 C ATOM 1401 C GLY A 124 8.418 -4.910 3.215 1.00 0.00 C ATOM 1402 O GLY A 124 8.716 -3.789 2.813 1.00 0.00 O ATOM 0 H GLY A 124 6.448 -3.897 1.851 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.902 -6.429 3.262 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.662 -6.224 1.696 1.00 0.00 H new ATOM 1406 N ALA A 125 9.076 -5.502 4.210 1.00 0.00 N ATOM 1407 CA ALA A 125 10.107 -4.861 5.036 1.00 0.00 C ATOM 1408 C ALA A 125 11.434 -5.641 5.056 1.00 0.00 C ATOM 1409 O ALA A 125 11.463 -6.843 4.791 1.00 0.00 O ATOM 1410 CB ALA A 125 9.543 -4.691 6.453 1.00 0.00 C ATOM 0 H ALA A 125 8.904 -6.472 4.475 1.00 0.00 H new ATOM 0 HA ALA A 125 10.349 -3.891 4.601 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.291 -4.216 7.088 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.649 -4.068 6.417 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.287 -5.668 6.863 1.00 0.00 H new ATOM 1416 N ILE A 126 12.533 -4.963 5.403 1.00 0.00 N ATOM 1417 CA ILE A 126 13.890 -5.533 5.507 1.00 0.00 C ATOM 1418 C ILE A 126 14.796 -4.655 6.390 1.00 0.00 C ATOM 1419 O ILE A 126 14.763 -3.429 6.288 1.00 0.00 O ATOM 1420 CB ILE A 126 14.479 -5.765 4.089 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.773 -6.600 4.158 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.722 -4.446 3.333 1.00 0.00 C ATOM 1423 CD1 ILE A 126 16.345 -6.988 2.790 1.00 0.00 C ATOM 0 H ILE A 126 12.507 -3.968 5.628 1.00 0.00 H new ATOM 0 HA ILE A 126 13.832 -6.503 6.000 1.00 0.00 H new ATOM 0 HB ILE A 126 13.733 -6.326 3.526 1.00 0.00 H new ATOM 0 HG12 ILE A 126 16.527 -6.036 4.708 1.00 0.00 H new ATOM 0 HG13 ILE A 126 15.576 -7.508 4.728 1.00 0.00 H new ATOM 0 HG21 ILE A 126 15.134 -4.662 2.347 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.779 -3.911 3.223 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.425 -3.830 3.893 1.00 0.00 H new ATOM 0 HD11 ILE A 126 17.254 -7.573 2.928 1.00 0.00 H new ATOM 0 HD12 ILE A 126 15.611 -7.581 2.244 1.00 0.00 H new ATOM 0 HD13 ILE A 126 16.577 -6.086 2.224 1.00 0.00 H new ATOM 1435 N SER A 127 15.603 -5.253 7.264 1.00 0.00 N ATOM 1436 CA SER A 127 16.596 -4.543 8.096 1.00 0.00 C ATOM 1437 C SER A 127 17.794 -4.014 7.273 1.00 0.00 C ATOM 1438 O SER A 127 18.057 -4.493 6.167 1.00 0.00 O ATOM 1439 CB SER A 127 17.097 -5.466 9.220 1.00 0.00 C ATOM 1440 OG SER A 127 16.011 -6.011 9.960 1.00 0.00 O ATOM 0 H SER A 127 15.592 -6.260 7.423 1.00 0.00 H new ATOM 0 HA SER A 127 16.093 -3.676 8.524 1.00 0.00 H new ATOM 0 HB2 SER A 127 17.691 -6.274 8.793 1.00 0.00 H new ATOM 0 HB3 SER A 127 17.752 -4.907 9.888 1.00 0.00 H new ATOM 0 HG SER A 127 16.357 -6.595 10.667 1.00 0.00 H new ATOM 1446 N LEU A 128 18.564 -3.048 7.803 1.00 0.00 N ATOM 1447 CA LEU A 128 19.717 -2.473 7.077 1.00 0.00 C ATOM 1448 C LEU A 128 20.973 -3.369 7.067 1.00 0.00 C ATOM 1449 O LEU A 128 21.908 -3.100 6.307 1.00 0.00 O ATOM 1450 CB LEU A 128 20.058 -1.067 7.618 1.00 0.00 C ATOM 1451 CG LEU A 128 18.934 -0.010 7.569 1.00 0.00 C ATOM 1452 CD1 LEU A 128 19.536 1.387 7.786 1.00 0.00 C ATOM 1453 CD2 LEU A 128 18.149 -0.005 6.252 1.00 0.00 C ATOM 0 H LEU A 128 18.412 -2.648 8.729 1.00 0.00 H new ATOM 0 HA LEU A 128 19.399 -2.399 6.037 1.00 0.00 H new ATOM 0 HB2 LEU A 128 20.381 -1.171 8.654 1.00 0.00 H new ATOM 0 HB3 LEU A 128 20.909 -0.684 7.055 1.00 0.00 H new ATOM 0 HG LEU A 128 18.232 -0.273 8.361 1.00 0.00 H new ATOM 0 HD11 LEU A 128 18.743 2.134 7.752 1.00 0.00 H new ATOM 0 HD12 LEU A 128 20.028 1.424 8.758 1.00 0.00 H new ATOM 0 HD13 LEU A 128 20.265 1.595 7.003 1.00 0.00 H new ATOM 0 HD21 LEU A 128 17.377 0.763 6.292 1.00 0.00 H new ATOM 0 HD22 LEU A 128 18.827 0.205 5.425 1.00 0.00 H new ATOM 0 HD23 LEU A 128 17.684 -0.979 6.102 1.00 0.00 H new ATOM 1465 N ALA A 129 21.023 -4.422 7.890 1.00 0.00 N ATOM 1466 CA ALA A 129 22.155 -5.352 7.966 1.00 0.00 C ATOM 1467 C ALA A 129 22.339 -6.167 6.658 1.00 0.00 C ATOM 1468 O ALA A 129 21.333 -6.579 6.069 1.00 0.00 O ATOM 1469 CB ALA A 129 21.943 -6.275 9.175 1.00 0.00 C ATOM 0 H ALA A 129 20.266 -4.656 8.532 1.00 0.00 H new ATOM 0 HA ALA A 129 23.074 -4.780 8.091 1.00 0.00 H new ATOM 0 HB1 ALA A 129 22.775 -6.975 9.249 1.00 0.00 H new ATOM 0 HB2 ALA A 129 21.890 -5.677 10.085 1.00 0.00 H new ATOM 0 HB3 ALA A 129 21.013 -6.829 9.051 1.00 0.00 H new ATOM 1475 N PRO A 130 23.584 -6.473 6.226 1.00 0.00 N ATOM 1476 CA PRO A 130 23.858 -7.302 5.044 1.00 0.00 C ATOM 1477 C PRO A 130 23.200 -8.690 5.067 1.00 0.00 C ATOM 1478 O PRO A 130 22.910 -9.250 4.012 1.00 0.00 O ATOM 1479 CB PRO A 130 25.383 -7.443 4.985 1.00 0.00 C ATOM 1480 CG PRO A 130 25.887 -6.188 5.688 1.00 0.00 C ATOM 1481 CD PRO A 130 24.837 -5.968 6.775 1.00 0.00 C ATOM 0 HA PRO A 130 23.431 -6.817 4.166 1.00 0.00 H new ATOM 0 HB2 PRO A 130 25.722 -8.348 5.489 1.00 0.00 H new ATOM 0 HB3 PRO A 130 25.741 -7.498 3.957 1.00 0.00 H new ATOM 0 HG2 PRO A 130 26.882 -6.332 6.109 1.00 0.00 H new ATOM 0 HG3 PRO A 130 25.949 -5.339 5.007 1.00 0.00 H new ATOM 0 HD2 PRO A 130 25.104 -6.497 7.690 1.00 0.00 H new ATOM 0 HD3 PRO A 130 24.754 -4.912 7.030 1.00 0.00 H new ATOM 1489 N LYS A 131 22.955 -9.247 6.260 1.00 0.00 N ATOM 1490 CA LYS A 131 22.350 -10.573 6.457 1.00 0.00 C ATOM 1491 C LYS A 131 20.804 -10.582 6.388 1.00 0.00 C ATOM 1492 O LYS A 131 20.190 -11.644 6.535 1.00 0.00 O ATOM 1493 CB LYS A 131 22.851 -11.142 7.803 1.00 0.00 C ATOM 1494 CG LYS A 131 24.382 -11.218 7.966 1.00 0.00 C ATOM 1495 CD LYS A 131 25.074 -12.061 6.884 1.00 0.00 C ATOM 1496 CE LYS A 131 26.572 -12.176 7.192 1.00 0.00 C ATOM 1497 NZ LYS A 131 27.283 -12.992 6.172 1.00 0.00 N1+ ATOM 0 H LYS A 131 23.177 -8.777 7.138 1.00 0.00 H new ATOM 0 HA LYS A 131 22.666 -11.205 5.627 1.00 0.00 H new ATOM 0 HB2 LYS A 131 22.448 -10.529 8.609 1.00 0.00 H new ATOM 0 HB3 LYS A 131 22.440 -12.144 7.929 1.00 0.00 H new ATOM 0 HG2 LYS A 131 24.792 -10.208 7.946 1.00 0.00 H new ATOM 0 HG3 LYS A 131 24.615 -11.637 8.945 1.00 0.00 H new ATOM 0 HD2 LYS A 131 24.625 -13.053 6.841 1.00 0.00 H new ATOM 0 HD3 LYS A 131 24.929 -11.603 5.906 1.00 0.00 H new ATOM 0 HE2 LYS A 131 27.013 -11.180 7.233 1.00 0.00 H new ATOM 0 HE3 LYS A 131 26.708 -12.625 8.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 28.293 -13.047 6.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 26.879 -13.950 6.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 27.175 -12.550 5.237 1.00 0.00 H new ATOM 1511 N ALA A 132 20.159 -9.424 6.196 1.00 0.00 N ATOM 1512 CA ALA A 132 18.698 -9.285 6.162 1.00 0.00 C ATOM 1513 C ALA A 132 18.044 -9.959 4.935 1.00 0.00 C ATOM 1514 O ALA A 132 18.699 -10.237 3.926 1.00 0.00 O ATOM 1515 CB ALA A 132 18.349 -7.792 6.247 1.00 0.00 C ATOM 0 H ALA A 132 20.648 -8.540 6.057 1.00 0.00 H new ATOM 0 HA ALA A 132 18.285 -9.814 7.020 1.00 0.00 H new ATOM 0 HB1 ALA A 132 17.266 -7.670 6.223 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.740 -7.379 7.177 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.792 -7.266 5.402 1.00 0.00 H new ATOM 1521 N GLN A 133 16.731 -10.184 5.014 1.00 0.00 N ATOM 1522 CA GLN A 133 15.897 -10.770 3.962 1.00 0.00 C ATOM 1523 C GLN A 133 14.481 -10.168 4.057 1.00 0.00 C ATOM 1524 O GLN A 133 14.060 -9.728 5.130 1.00 0.00 O ATOM 1525 CB GLN A 133 15.891 -12.310 4.109 1.00 0.00 C ATOM 1526 CG GLN A 133 16.037 -13.058 2.774 1.00 0.00 C ATOM 1527 CD GLN A 133 14.836 -12.884 1.845 1.00 0.00 C ATOM 1528 OE1 GLN A 133 14.781 -11.971 1.030 1.00 0.00 O ATOM 1529 NE2 GLN A 133 13.811 -13.704 1.959 1.00 0.00 N ATOM 0 H GLN A 133 16.196 -9.952 5.851 1.00 0.00 H new ATOM 0 HA GLN A 133 16.296 -10.539 2.974 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.704 -12.606 4.772 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.961 -12.617 4.588 1.00 0.00 H new ATOM 0 HG2 GLN A 133 16.934 -12.706 2.265 1.00 0.00 H new ATOM 0 HG3 GLN A 133 16.180 -14.120 2.975 1.00 0.00 H new ATOM 0 HE21 GLN A 133 13.842 -14.469 2.633 1.00 0.00 H new ATOM 0 HE22 GLN A 133 12.986 -13.574 1.373 1.00 0.00 H new ATOM 1538 N ILE A 134 13.745 -10.118 2.944 1.00 0.00 N ATOM 1539 CA ILE A 134 12.437 -9.448 2.861 1.00 0.00 C ATOM 1540 C ILE A 134 11.325 -10.284 3.511 1.00 0.00 C ATOM 1541 O ILE A 134 11.077 -11.427 3.120 1.00 0.00 O ATOM 1542 CB ILE A 134 12.063 -9.101 1.394 1.00 0.00 C ATOM 1543 CG1 ILE A 134 13.154 -8.238 0.716 1.00 0.00 C ATOM 1544 CG2 ILE A 134 10.697 -8.380 1.343 1.00 0.00 C ATOM 1545 CD1 ILE A 134 12.892 -7.953 -0.768 1.00 0.00 C ATOM 0 H ILE A 134 14.039 -10.544 2.065 1.00 0.00 H new ATOM 0 HA ILE A 134 12.529 -8.516 3.419 1.00 0.00 H new ATOM 0 HB ILE A 134 11.991 -10.037 0.841 1.00 0.00 H new ATOM 0 HG12 ILE A 134 13.236 -7.290 1.248 1.00 0.00 H new ATOM 0 HG13 ILE A 134 14.115 -8.743 0.814 1.00 0.00 H new ATOM 0 HG21 ILE A 134 10.449 -8.143 0.308 1.00 0.00 H new ATOM 0 HG22 ILE A 134 9.927 -9.029 1.762 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.750 -7.459 1.923 1.00 0.00 H new ATOM 0 HD11 ILE A 134 13.701 -7.343 -1.170 1.00 0.00 H new ATOM 0 HD12 ILE A 134 12.841 -8.894 -1.316 1.00 0.00 H new ATOM 0 HD13 ILE A 134 11.948 -7.419 -0.875 1.00 0.00 H new ATOM 1557 N LYS A 135 10.615 -9.679 4.465 1.00 0.00 N ATOM 1558 CA LYS A 135 9.336 -10.172 4.996 1.00 0.00 C ATOM 1559 C LYS A 135 8.195 -9.429 4.267 1.00 0.00 C ATOM 1560 O LYS A 135 8.355 -8.252 3.940 1.00 0.00 O ATOM 1561 CB LYS A 135 9.286 -10.004 6.532 1.00 0.00 C ATOM 1562 CG LYS A 135 9.331 -8.540 7.007 1.00 0.00 C ATOM 1563 CD LYS A 135 9.227 -8.376 8.529 1.00 0.00 C ATOM 1564 CE LYS A 135 10.521 -8.790 9.242 1.00 0.00 C ATOM 1565 NZ LYS A 135 10.507 -8.371 10.667 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.919 -8.810 4.903 1.00 0.00 H new ATOM 0 HA LYS A 135 9.222 -11.240 4.811 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.374 -10.469 6.908 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.124 -10.544 6.973 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.261 -8.086 6.665 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.516 -7.990 6.536 1.00 0.00 H new ATOM 0 HD2 LYS A 135 8.999 -7.337 8.767 1.00 0.00 H new ATOM 0 HD3 LYS A 135 8.399 -8.978 8.903 1.00 0.00 H new ATOM 0 HE2 LYS A 135 10.644 -9.871 9.179 1.00 0.00 H new ATOM 0 HE3 LYS A 135 11.377 -8.342 8.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 11.394 -8.664 11.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 10.414 -7.337 10.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 9.703 -8.818 11.153 1.00 0.00 H new ATOM 1579 N GLU A 136 7.055 -10.071 4.007 1.00 0.00 N ATOM 1580 CA GLU A 136 5.917 -9.457 3.300 1.00 0.00 C ATOM 1581 C GLU A 136 4.597 -9.665 4.055 1.00 0.00 C ATOM 1582 O GLU A 136 4.410 -10.647 4.773 1.00 0.00 O ATOM 1583 CB GLU A 136 5.802 -9.886 1.818 1.00 0.00 C ATOM 1584 CG GLU A 136 6.530 -11.174 1.426 1.00 0.00 C ATOM 1585 CD GLU A 136 6.153 -11.624 0.006 1.00 0.00 C ATOM 1586 OE1 GLU A 136 6.800 -11.171 -0.967 1.00 0.00 O ATOM 1587 OE2 GLU A 136 5.225 -12.455 -0.141 1.00 0.00 O1- ATOM 0 H GLU A 136 6.889 -11.039 4.281 1.00 0.00 H new ATOM 0 HA GLU A 136 6.126 -8.387 3.282 1.00 0.00 H new ATOM 0 HB2 GLU A 136 4.745 -10.003 1.577 1.00 0.00 H new ATOM 0 HB3 GLU A 136 6.183 -9.075 1.197 1.00 0.00 H new ATOM 0 HG2 GLU A 136 7.607 -11.017 1.485 1.00 0.00 H new ATOM 0 HG3 GLU A 136 6.284 -11.963 2.136 1.00 0.00 H new ATOM 1594 N SER A 137 3.697 -8.695 3.910 1.00 0.00 N ATOM 1595 CA SER A 137 2.431 -8.605 4.645 1.00 0.00 C ATOM 1596 C SER A 137 1.241 -9.221 3.880 1.00 0.00 C ATOM 1597 O SER A 137 1.399 -9.948 2.893 1.00 0.00 O ATOM 1598 CB SER A 137 2.179 -7.130 4.998 1.00 0.00 C ATOM 1599 OG SER A 137 1.256 -7.015 6.065 1.00 0.00 O ATOM 0 H SER A 137 3.830 -7.923 3.257 1.00 0.00 H new ATOM 0 HA SER A 137 2.516 -9.197 5.556 1.00 0.00 H new ATOM 0 HB2 SER A 137 3.119 -6.652 5.273 1.00 0.00 H new ATOM 0 HB3 SER A 137 1.797 -6.603 4.124 1.00 0.00 H new ATOM 0 HG SER A 137 1.544 -6.301 6.671 1.00 0.00 H new ATOM 1605 N LEU A 138 0.026 -8.922 4.350 1.00 0.00 N ATOM 1606 CA LEU A 138 -1.242 -9.312 3.739 1.00 0.00 C ATOM 1607 C LEU A 138 -1.434 -8.659 2.357 1.00 0.00 C ATOM 1608 O LEU A 138 -0.894 -7.585 2.075 1.00 0.00 O ATOM 1609 CB LEU A 138 -2.390 -8.928 4.692 1.00 0.00 C ATOM 1610 CG LEU A 138 -2.324 -9.538 6.109 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -3.525 -9.042 6.925 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -2.314 -11.074 6.090 1.00 0.00 C ATOM 0 H LEU A 138 -0.103 -8.378 5.203 1.00 0.00 H new ATOM 0 HA LEU A 138 -1.240 -10.390 3.579 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -2.411 -7.842 4.786 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -3.332 -9.226 4.233 1.00 0.00 H new ATOM 0 HG LEU A 138 -1.387 -9.216 6.564 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.485 -9.469 7.927 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.495 -7.954 6.992 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.449 -9.350 6.436 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -2.267 -11.450 7.112 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -3.223 -11.438 5.611 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -1.445 -11.425 5.534 1.00 0.00 H new ATOM 1624 N ARG A 139 -2.246 -9.299 1.513 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.675 -8.774 0.212 1.00 0.00 C ATOM 1626 C ARG A 139 -3.961 -7.950 0.364 1.00 0.00 C ATOM 1627 O ARG A 139 -4.877 -8.347 1.091 1.00 0.00 O ATOM 1628 CB ARG A 139 -2.881 -9.943 -0.767 1.00 0.00 C ATOM 1629 CG ARG A 139 -1.536 -10.546 -1.207 1.00 0.00 C ATOM 1630 CD ARG A 139 -1.676 -11.933 -1.847 1.00 0.00 C ATOM 1631 NE ARG A 139 -2.422 -11.896 -3.118 1.00 0.00 N ATOM 1632 CZ ARG A 139 -3.631 -12.388 -3.370 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -4.380 -12.940 -2.439 1.00 0.00 N ATOM 1634 NH2 ARG A 139 -4.109 -12.327 -4.594 1.00 0.00 N1+ ATOM 0 H ARG A 139 -2.634 -10.220 1.719 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.903 -8.114 -0.185 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -3.490 -10.713 -0.294 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -3.430 -9.595 -1.642 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -1.058 -9.872 -1.918 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -0.877 -10.617 -0.342 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -0.684 -12.350 -2.024 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -2.183 -12.601 -1.151 1.00 0.00 H new ATOM 0 HE ARG A 139 -1.953 -11.437 -3.899 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -4.038 -13.003 -1.480 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -5.302 -13.305 -2.676 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -3.553 -11.905 -5.338 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -5.035 -12.701 -4.799 1.00 0.00 H new ATOM 1648 N ALA A 140 -4.044 -6.823 -0.342 1.00 0.00 N ATOM 1649 CA ALA A 140 -5.197 -5.918 -0.365 1.00 0.00 C ATOM 1650 C ALA A 140 -5.507 -5.441 -1.791 1.00 0.00 C ATOM 1651 O ALA A 140 -4.608 -5.345 -2.624 1.00 0.00 O ATOM 1652 CB ALA A 140 -4.896 -4.723 0.542 1.00 0.00 C ATOM 0 H ALA A 140 -3.281 -6.501 -0.938 1.00 0.00 H new ATOM 0 HA ALA A 140 -6.076 -6.452 -0.004 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.745 -4.039 0.536 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.719 -5.073 1.559 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -4.009 -4.204 0.178 1.00 0.00 H new ATOM 1658 N GLU A 141 -6.773 -5.139 -2.073 1.00 0.00 N ATOM 1659 CA GLU A 141 -7.251 -4.725 -3.394 1.00 0.00 C ATOM 1660 C GLU A 141 -7.511 -3.213 -3.457 1.00 0.00 C ATOM 1661 O GLU A 141 -8.106 -2.634 -2.547 1.00 0.00 O ATOM 1662 CB GLU A 141 -8.540 -5.485 -3.746 1.00 0.00 C ATOM 1663 CG GLU A 141 -8.330 -7.002 -3.817 1.00 0.00 C ATOM 1664 CD GLU A 141 -9.599 -7.713 -4.314 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -9.842 -7.738 -5.544 1.00 0.00 O ATOM 1666 OE2 GLU A 141 -10.356 -8.267 -3.482 1.00 0.00 O1- ATOM 0 H GLU A 141 -7.514 -5.176 -1.373 1.00 0.00 H new ATOM 0 HA GLU A 141 -6.471 -4.963 -4.117 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -9.304 -5.262 -3.001 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.917 -5.129 -4.705 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -7.498 -7.226 -4.485 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -8.059 -7.381 -2.832 1.00 0.00 H new ATOM 1673 N LEU A 142 -7.105 -2.585 -4.562 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.443 -1.212 -4.938 1.00 0.00 C ATOM 1675 C LEU A 142 -8.464 -1.247 -6.077 1.00 0.00 C ATOM 1676 O LEU A 142 -8.223 -1.883 -7.107 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.158 -0.481 -5.381 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.363 0.979 -5.841 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -6.945 1.871 -4.734 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.021 1.551 -6.310 1.00 0.00 C ATOM 0 H LEU A 142 -6.505 -3.040 -5.250 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.876 -0.679 -4.092 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.450 -0.489 -4.553 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.701 -1.042 -6.196 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.085 0.969 -6.658 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.068 2.886 -5.112 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.913 1.479 -4.423 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.267 1.881 -3.881 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.159 2.582 -6.636 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.306 1.523 -5.488 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.642 0.955 -7.140 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.563 -0.510 -5.911 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.575 -0.253 -6.933 1.00 0.00 C ATOM 1694 C ARG A 143 -10.683 1.256 -7.174 1.00 0.00 C ATOM 1695 O ARG A 143 -11.049 2.018 -6.276 1.00 0.00 O ATOM 1696 CB ARG A 143 -11.913 -0.853 -6.463 1.00 0.00 C ATOM 1697 CG ARG A 143 -13.021 -0.718 -7.519 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.348 -1.286 -7.004 1.00 0.00 C ATOM 1699 NE ARG A 143 -15.407 -1.152 -8.019 1.00 0.00 N ATOM 1700 CZ ARG A 143 -16.718 -1.209 -7.808 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -17.229 -1.418 -6.612 1.00 0.00 N1+ ATOM 1702 NH2 ARG A 143 -17.548 -1.056 -8.817 1.00 0.00 N ATOM 0 H ARG A 143 -9.780 -0.057 -5.023 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.300 -0.721 -7.878 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.771 -1.907 -6.223 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.228 -0.357 -5.545 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.150 0.332 -7.783 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -12.726 -1.242 -8.428 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.221 -2.336 -6.742 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.643 -0.764 -6.094 1.00 0.00 H new ATOM 0 HE ARG A 143 -15.104 -1.000 -8.981 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.613 -1.543 -5.809 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.241 -1.455 -6.489 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.185 -0.894 -9.756 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -18.555 -1.099 -8.660 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.390 1.685 -8.396 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.629 3.051 -8.877 1.00 0.00 C ATOM 1718 C VAL A 144 -11.886 3.043 -9.754 1.00 0.00 C ATOM 1719 O VAL A 144 -11.927 2.339 -10.764 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.415 3.609 -9.647 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -9.651 5.082 -10.000 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.113 3.490 -8.836 1.00 0.00 C ATOM 0 H VAL A 144 -9.969 1.081 -9.102 1.00 0.00 H new ATOM 0 HA VAL A 144 -10.778 3.711 -8.022 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.307 3.015 -10.554 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -8.789 5.468 -10.544 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.541 5.169 -10.623 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -9.791 5.658 -9.085 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.284 3.895 -9.417 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.212 4.049 -7.906 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -7.919 2.441 -8.610 1.00 0.00 H new ATOM 1732 N THR A 145 -12.911 3.806 -9.360 1.00 0.00 N ATOM 1733 CA THR A 145 -14.196 3.944 -10.066 1.00 0.00 C ATOM 1734 C THR A 145 -14.207 5.231 -10.888 1.00 0.00 C ATOM 1735 O THR A 145 -13.620 6.233 -10.485 1.00 0.00 O ATOM 1736 CB THR A 145 -15.367 3.899 -9.070 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.217 4.904 -8.093 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.443 2.547 -8.358 1.00 0.00 C ATOM 0 H THR A 145 -12.870 4.367 -8.509 1.00 0.00 H new ATOM 0 HA THR A 145 -14.317 3.106 -10.752 1.00 0.00 H new ATOM 0 HB THR A 145 -16.282 4.057 -9.641 1.00 0.00 H new ATOM 0 HG1 THR A 145 -15.969 4.866 -7.466 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.281 2.549 -7.661 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.585 1.756 -9.094 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.517 2.372 -7.811 1.00 0.00 H new ATOM 1746 N GLU A 146 -14.849 5.215 -12.058 1.00 0.00 N ATOM 1747 CA GLU A 146 -14.831 6.349 -12.993 1.00 0.00 C ATOM 1748 C GLU A 146 -15.477 7.613 -12.397 1.00 0.00 C ATOM 1749 O GLU A 146 -16.442 7.537 -11.629 1.00 0.00 O ATOM 1750 CB GLU A 146 -15.454 5.965 -14.346 1.00 0.00 C ATOM 1751 CG GLU A 146 -16.965 5.708 -14.298 1.00 0.00 C ATOM 1752 CD GLU A 146 -17.483 5.249 -15.669 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -17.497 4.024 -15.936 1.00 0.00 O ATOM 1754 OE2 GLU A 146 -17.885 6.109 -16.489 1.00 0.00 O1- ATOM 0 H GLU A 146 -15.396 4.419 -12.386 1.00 0.00 H new ATOM 0 HA GLU A 146 -13.785 6.599 -13.173 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.256 6.762 -15.063 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.957 5.070 -14.720 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -17.186 4.949 -13.548 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -17.484 6.617 -13.994 1.00 0.00 H new ATOM 1761 N ARG A 147 -14.934 8.783 -12.752 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.292 10.074 -12.153 1.00 0.00 C ATOM 1763 C ARG A 147 -16.601 10.610 -12.751 1.00 0.00 C ATOM 1764 O ARG A 147 -16.618 11.173 -13.851 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.115 11.054 -12.298 1.00 0.00 C ATOM 1766 CG ARG A 147 -14.272 12.287 -11.397 1.00 0.00 C ATOM 1767 CD ARG A 147 -13.071 13.232 -11.546 1.00 0.00 C ATOM 1768 NE ARG A 147 -13.072 14.266 -10.495 1.00 0.00 N ATOM 1769 CZ ARG A 147 -12.501 14.185 -9.295 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -11.804 13.138 -8.907 1.00 0.00 N1+ ATOM 1771 NH2 ARG A 147 -12.630 15.186 -8.451 1.00 0.00 N ATOM 0 H ARG A 147 -14.221 8.861 -13.477 1.00 0.00 H new ATOM 0 HA ARG A 147 -15.479 9.947 -11.087 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.185 10.542 -12.051 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -14.036 11.373 -13.337 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -15.190 12.816 -11.654 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -14.366 11.973 -10.357 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -12.145 12.659 -11.495 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -13.098 13.707 -12.527 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.562 15.135 -10.710 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.683 12.344 -9.536 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -11.384 13.121 -7.977 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -13.163 16.013 -8.719 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.197 15.135 -7.529 1.00 0.00 H new