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 66 ASN : amide:sc= 1.29 K(o=2.3,f=-2) USER MOD Set 1.2: A 68 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 78 LYS NZ :NH3+ 180:sc= 1.05 (180deg=0) USER MOD Set 2.1: A 53 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 107 HIS : no HD1:sc= -0.49 X(o=-0.49,f=-0.3) USER MOD Set 3.1: A 51 THR OG1 : rot 180:sc= 0.669 USER MOD Set 3.2: A 109 SER OG : rot 95:sc= 1.43 USER MOD Single : A 36 THR OG1 : rot -33:sc= 0.115 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= 0.6 K(o=0.6,f=-4.6!) USER MOD Single : A 55 SER OG : rot -36:sc= 1.25 USER MOD Single : A 70 MET CE :methyl -127:sc= 0 (180deg=-0.0374) USER MOD Single : A 71 SER OG : rot 180:sc= 0.567 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0.551 K(o=0.55,f=-4.5!) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.38) 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= 0.46 K(o=0.46,f=-0.33) USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=-0.083) USER MOD Single : A 108 MET CE :methyl -158:sc= -0.885 (180deg=-1.92) USER MOD Single : A 116 ASN : amide:sc=-0.00908 X(o=-0.0091,f=-0.0091) USER MOD Single : A 118 SER OG : rot 88:sc= 1.01 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot 15: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= 0.179 K(o=0.18,f=-2.5!) USER MOD Single : A 135 LYS NZ :NH3+ 173:sc= 0.804 (180deg=0.769) USER MOD Single : A 137 SER OG : rot 17:sc= 0.254 USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 0.179 -6.772 9.421 1.00 0.00 N ATOM 49 CA THR A 36 -1.089 -6.777 8.665 1.00 0.00 C ATOM 50 C THR A 36 -1.210 -5.531 7.786 1.00 0.00 C ATOM 51 O THR A 36 -0.627 -4.485 8.094 1.00 0.00 O ATOM 52 CB THR A 36 -2.326 -6.867 9.580 1.00 0.00 C ATOM 53 OG1 THR A 36 -2.279 -5.858 10.567 1.00 0.00 O ATOM 54 CG2 THR A 36 -2.472 -8.223 10.275 1.00 0.00 C ATOM 0 HA THR A 36 -1.062 -7.670 8.041 1.00 0.00 H new ATOM 0 HB THR A 36 -3.189 -6.735 8.928 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.346 -5.680 10.808 1.00 0.00 H new ATOM 0 HG21 THR A 36 -3.363 -8.216 10.903 1.00 0.00 H new ATOM 0 HG22 THR A 36 -2.563 -9.008 9.525 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.594 -8.411 10.893 1.00 0.00 H new ATOM 62 N PHE A 37 -1.974 -5.652 6.691 1.00 0.00 N ATOM 63 CA PHE A 37 -2.252 -4.577 5.727 1.00 0.00 C ATOM 64 C PHE A 37 -3.764 -4.333 5.630 1.00 0.00 C ATOM 65 O PHE A 37 -4.545 -5.280 5.520 1.00 0.00 O ATOM 66 CB PHE A 37 -1.684 -4.910 4.330 1.00 0.00 C ATOM 67 CG PHE A 37 -0.307 -5.552 4.301 1.00 0.00 C ATOM 68 CD1 PHE A 37 0.680 -5.174 5.227 1.00 0.00 C ATOM 69 CD2 PHE A 37 -0.037 -6.582 3.382 1.00 0.00 C ATOM 70 CE1 PHE A 37 1.870 -5.907 5.334 1.00 0.00 C ATOM 71 CE2 PHE A 37 1.177 -7.288 3.454 1.00 0.00 C ATOM 72 CZ PHE A 37 2.121 -6.966 4.447 1.00 0.00 C ATOM 0 H PHE A 37 -2.431 -6.530 6.444 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.760 -3.673 6.085 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.384 -5.577 3.826 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.645 -3.989 3.748 1.00 0.00 H new ATOM 0 HD1 PHE A 37 0.521 -4.314 5.860 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -0.762 -6.831 2.621 1.00 0.00 H new ATOM 0 HE1 PHE A 37 2.592 -5.658 6.097 1.00 0.00 H new ATOM 0 HE2 PHE A 37 1.385 -8.078 2.747 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.037 -7.533 4.527 1.00 0.00 H new ATOM 82 N SER A 38 -4.177 -3.068 5.660 1.00 0.00 N ATOM 83 CA SER A 38 -5.593 -2.657 5.576 1.00 0.00 C ATOM 84 C SER A 38 -5.820 -1.388 4.721 1.00 0.00 C ATOM 85 O SER A 38 -4.900 -0.575 4.582 1.00 0.00 O ATOM 86 CB SER A 38 -6.179 -2.424 6.982 1.00 0.00 C ATOM 87 OG SER A 38 -6.068 -3.562 7.828 1.00 0.00 O ATOM 0 H SER A 38 -3.534 -2.281 5.744 1.00 0.00 H new ATOM 0 HA SER A 38 -6.106 -3.481 5.081 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.667 -1.581 7.447 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.229 -2.148 6.890 1.00 0.00 H new ATOM 0 HG SER A 38 -6.454 -3.356 8.705 1.00 0.00 H new ATOM 93 N PRO A 39 -7.038 -1.162 4.183 1.00 0.00 N ATOM 94 CA PRO A 39 -8.168 -2.092 4.161 1.00 0.00 C ATOM 95 C PRO A 39 -7.899 -3.255 3.203 1.00 0.00 C ATOM 96 O PRO A 39 -7.104 -3.139 2.272 1.00 0.00 O ATOM 97 CB PRO A 39 -9.370 -1.268 3.693 1.00 0.00 C ATOM 98 CG PRO A 39 -8.728 -0.228 2.781 1.00 0.00 C ATOM 99 CD PRO A 39 -7.393 0.058 3.466 1.00 0.00 C ATOM 0 HA PRO A 39 -8.342 -2.535 5.142 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.098 -1.880 3.160 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.894 -0.805 4.529 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.588 -0.610 1.770 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.340 0.670 2.701 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.627 0.317 2.735 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.479 0.902 4.151 1.00 0.00 H new ATOM 107 N ALA A 40 -8.600 -4.371 3.418 1.00 0.00 N ATOM 108 CA ALA A 40 -8.582 -5.511 2.492 1.00 0.00 C ATOM 109 C ALA A 40 -9.027 -5.123 1.065 1.00 0.00 C ATOM 110 O ALA A 40 -8.492 -5.656 0.092 1.00 0.00 O ATOM 111 CB ALA A 40 -9.462 -6.625 3.073 1.00 0.00 C ATOM 0 H ALA A 40 -9.194 -4.512 4.235 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.556 -5.865 2.392 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.460 -7.480 2.397 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.071 -6.929 4.044 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.482 -6.259 3.191 1.00 0.00 H new ATOM 117 N LEU A 41 -9.948 -4.156 0.941 1.00 0.00 N ATOM 118 CA LEU A 41 -10.352 -3.522 -0.315 1.00 0.00 C ATOM 119 C LEU A 41 -10.522 -2.012 -0.091 1.00 0.00 C ATOM 120 O LEU A 41 -11.359 -1.587 0.708 1.00 0.00 O ATOM 121 CB LEU A 41 -11.647 -4.181 -0.836 1.00 0.00 C ATOM 122 CG LEU A 41 -12.290 -3.480 -2.056 1.00 0.00 C ATOM 123 CD1 LEU A 41 -11.373 -3.446 -3.288 1.00 0.00 C ATOM 124 CD2 LEU A 41 -13.602 -4.186 -2.423 1.00 0.00 C ATOM 0 H LEU A 41 -10.449 -3.782 1.747 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.584 -3.662 -1.075 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.429 -5.215 -1.103 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.375 -4.208 -0.025 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.473 -2.446 -1.763 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -11.884 -2.941 -4.108 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.457 -2.908 -3.045 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.127 -4.465 -3.587 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.054 -3.691 -3.283 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.398 -5.228 -2.670 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.288 -4.142 -1.577 1.00 0.00 H new ATOM 136 N LEU A 42 -9.753 -1.208 -0.826 1.00 0.00 N ATOM 137 CA LEU A 42 -9.878 0.246 -0.907 1.00 0.00 C ATOM 138 C LEU A 42 -10.617 0.619 -2.200 1.00 0.00 C ATOM 139 O LEU A 42 -10.193 0.208 -3.278 1.00 0.00 O ATOM 140 CB LEU A 42 -8.458 0.847 -0.874 1.00 0.00 C ATOM 141 CG LEU A 42 -8.387 2.383 -0.946 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.176 3.077 0.175 1.00 0.00 C ATOM 143 CD2 LEU A 42 -6.920 2.818 -0.862 1.00 0.00 C ATOM 0 H LEU A 42 -8.994 -1.568 -1.405 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.452 0.642 -0.070 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -7.965 0.520 0.042 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -7.888 0.435 -1.707 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.839 2.681 -1.892 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.086 4.158 0.068 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.226 2.792 0.111 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.776 2.774 1.143 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.859 3.905 -0.912 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.492 2.474 0.079 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.364 2.385 -1.693 1.00 0.00 H new ATOM 155 N VAL A 43 -11.682 1.417 -2.108 1.00 0.00 N ATOM 156 CA VAL A 43 -12.384 1.998 -3.270 1.00 0.00 C ATOM 157 C VAL A 43 -12.146 3.510 -3.277 1.00 0.00 C ATOM 158 O VAL A 43 -12.434 4.183 -2.288 1.00 0.00 O ATOM 159 CB VAL A 43 -13.901 1.687 -3.277 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.541 2.145 -4.600 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.180 0.183 -3.093 1.00 0.00 C ATOM 0 H VAL A 43 -12.093 1.686 -1.214 1.00 0.00 H new ATOM 0 HA VAL A 43 -11.979 1.541 -4.173 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.337 2.231 -2.439 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.607 1.918 -4.586 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.400 3.219 -4.720 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.070 1.622 -5.432 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.256 0.009 -3.104 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.714 -0.376 -3.905 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.768 -0.150 -2.140 1.00 0.00 H new ATOM 171 N VAL A 44 -11.625 4.030 -4.390 1.00 0.00 N ATOM 172 CA VAL A 44 -11.443 5.479 -4.633 1.00 0.00 C ATOM 173 C VAL A 44 -12.066 5.909 -5.964 1.00 0.00 C ATOM 174 O VAL A 44 -12.334 5.070 -6.822 1.00 0.00 O ATOM 175 CB VAL A 44 -9.957 5.906 -4.611 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.315 5.641 -3.242 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.131 5.241 -5.724 1.00 0.00 C ATOM 0 H VAL A 44 -11.309 3.452 -5.169 1.00 0.00 H new ATOM 0 HA VAL A 44 -11.955 5.980 -3.812 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.950 6.980 -4.798 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.271 5.953 -3.263 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.847 6.205 -2.476 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.371 4.577 -3.014 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.096 5.578 -5.660 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.168 4.158 -5.607 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.542 5.515 -6.696 1.00 0.00 H new ATOM 187 N THR A 45 -12.256 7.220 -6.151 1.00 0.00 N ATOM 188 CA THR A 45 -12.715 7.828 -7.409 1.00 0.00 C ATOM 189 C THR A 45 -11.524 8.147 -8.315 1.00 0.00 C ATOM 190 O THR A 45 -10.425 8.434 -7.838 1.00 0.00 O ATOM 191 CB THR A 45 -13.534 9.096 -7.121 1.00 0.00 C ATOM 192 OG1 THR A 45 -14.498 8.811 -6.126 1.00 0.00 O ATOM 193 CG2 THR A 45 -14.291 9.600 -8.353 1.00 0.00 C ATOM 0 H THR A 45 -12.091 7.906 -5.414 1.00 0.00 H new ATOM 0 HA THR A 45 -13.356 7.115 -7.927 1.00 0.00 H new ATOM 0 HB THR A 45 -12.827 9.863 -6.804 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.022 9.617 -5.938 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.853 10.497 -8.093 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.581 9.833 -9.146 1.00 0.00 H new ATOM 0 HG23 THR A 45 -14.979 8.828 -8.698 1.00 0.00 H new ATOM 201 N GLU A 46 -11.752 8.131 -9.626 1.00 0.00 N ATOM 202 CA GLU A 46 -10.818 8.569 -10.667 1.00 0.00 C ATOM 203 C GLU A 46 -10.142 9.912 -10.328 1.00 0.00 C ATOM 204 O GLU A 46 -10.808 10.935 -10.135 1.00 0.00 O ATOM 205 CB GLU A 46 -11.577 8.647 -12.010 1.00 0.00 C ATOM 206 CG GLU A 46 -11.060 7.650 -13.051 1.00 0.00 C ATOM 207 CD GLU A 46 -9.843 8.200 -13.798 1.00 0.00 C ATOM 208 OE1 GLU A 46 -8.818 8.485 -13.149 1.00 0.00 O1- ATOM 209 OE2 GLU A 46 -9.886 8.341 -15.042 1.00 0.00 O ATOM 0 H GLU A 46 -12.635 7.797 -10.013 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.011 7.840 -10.738 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -12.636 8.462 -11.833 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.493 9.657 -12.410 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.794 6.714 -12.559 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -11.853 7.422 -13.763 1.00 0.00 H new ATOM 216 N GLY A 47 -8.809 9.893 -10.249 1.00 0.00 N ATOM 217 CA GLY A 47 -7.950 11.042 -9.948 1.00 0.00 C ATOM 218 C GLY A 47 -7.762 11.350 -8.459 1.00 0.00 C ATOM 219 O GLY A 47 -7.057 12.308 -8.140 1.00 0.00 O ATOM 0 H GLY A 47 -8.275 9.037 -10.400 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.970 10.868 -10.392 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.368 11.924 -10.434 1.00 0.00 H new ATOM 223 N ASP A 48 -8.349 10.573 -7.544 1.00 0.00 N ATOM 224 CA ASP A 48 -8.160 10.727 -6.093 1.00 0.00 C ATOM 225 C ASP A 48 -6.902 9.985 -5.594 1.00 0.00 C ATOM 226 O ASP A 48 -6.424 9.039 -6.224 1.00 0.00 O ATOM 227 CB ASP A 48 -9.428 10.253 -5.358 1.00 0.00 C ATOM 228 CG ASP A 48 -9.449 10.596 -3.857 1.00 0.00 C ATOM 229 OD1 ASP A 48 -8.894 11.648 -3.460 1.00 0.00 O1- ATOM 230 OD2 ASP A 48 -10.052 9.816 -3.082 1.00 0.00 O ATOM 0 H ASP A 48 -8.978 9.808 -7.790 1.00 0.00 H new ATOM 0 HA ASP A 48 -7.999 11.782 -5.874 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.300 10.701 -5.834 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.520 9.173 -5.474 1.00 0.00 H new ATOM 235 N ASN A 49 -6.362 10.405 -4.448 1.00 0.00 N ATOM 236 CA ASN A 49 -5.202 9.774 -3.818 1.00 0.00 C ATOM 237 C ASN A 49 -5.640 8.546 -2.997 1.00 0.00 C ATOM 238 O ASN A 49 -6.480 8.652 -2.099 1.00 0.00 O ATOM 239 CB ASN A 49 -4.454 10.798 -2.950 1.00 0.00 C ATOM 240 CG ASN A 49 -3.932 11.997 -3.741 1.00 0.00 C ATOM 241 OD1 ASN A 49 -3.663 11.931 -4.933 1.00 0.00 O ATOM 242 ND2 ASN A 49 -3.775 13.141 -3.099 1.00 0.00 N ATOM 0 H ASN A 49 -6.723 11.203 -3.925 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.518 9.425 -4.591 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -5.121 11.153 -2.164 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -3.616 10.304 -2.458 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -3.431 13.962 -3.597 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -3.997 13.203 -2.105 1.00 0.00 H new ATOM 249 N ALA A 50 -5.066 7.380 -3.302 1.00 0.00 N ATOM 250 CA ALA A 50 -5.377 6.102 -2.653 1.00 0.00 C ATOM 251 C ALA A 50 -4.264 5.698 -1.676 1.00 0.00 C ATOM 252 O ALA A 50 -3.114 5.577 -2.102 1.00 0.00 O ATOM 253 CB ALA A 50 -5.558 5.041 -3.747 1.00 0.00 C ATOM 0 H ALA A 50 -4.353 7.295 -4.026 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.294 6.195 -2.072 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.790 4.080 -3.287 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.374 5.334 -4.407 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.638 4.954 -4.325 1.00 0.00 H new ATOM 259 N THR A 51 -4.596 5.463 -0.397 1.00 0.00 N ATOM 260 CA THR A 51 -3.621 5.152 0.664 1.00 0.00 C ATOM 261 C THR A 51 -4.057 3.945 1.488 1.00 0.00 C ATOM 262 O THR A 51 -5.160 3.925 2.034 1.00 0.00 O ATOM 263 CB THR A 51 -3.396 6.368 1.571 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.042 7.471 0.764 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.257 6.145 2.570 1.00 0.00 C ATOM 0 H THR A 51 -5.560 5.483 -0.065 1.00 0.00 H new ATOM 0 HA THR A 51 -2.678 4.902 0.179 1.00 0.00 H new ATOM 0 HB THR A 51 -4.318 6.539 2.126 1.00 0.00 H new ATOM 0 HG1 THR A 51 -2.896 8.257 1.330 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.137 7.034 3.189 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.491 5.290 3.204 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.331 5.952 2.029 1.00 0.00 H new ATOM 273 N PHE A 52 -3.159 2.967 1.602 1.00 0.00 N ATOM 274 CA PHE A 52 -3.261 1.800 2.481 1.00 0.00 C ATOM 275 C PHE A 52 -2.421 1.997 3.749 1.00 0.00 C ATOM 276 O PHE A 52 -1.404 2.696 3.725 1.00 0.00 O ATOM 277 CB PHE A 52 -2.762 0.553 1.734 1.00 0.00 C ATOM 278 CG PHE A 52 -3.625 0.139 0.561 1.00 0.00 C ATOM 279 CD1 PHE A 52 -4.702 -0.746 0.762 1.00 0.00 C ATOM 280 CD2 PHE A 52 -3.354 0.635 -0.730 1.00 0.00 C ATOM 281 CE1 PHE A 52 -5.508 -1.129 -0.322 1.00 0.00 C ATOM 282 CE2 PHE A 52 -4.161 0.250 -1.814 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.236 -0.631 -1.606 1.00 0.00 C ATOM 0 H PHE A 52 -2.297 2.966 1.057 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.305 1.674 2.769 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.749 0.740 1.376 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.703 -0.278 2.437 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -4.908 -1.130 1.750 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.526 1.311 -0.886 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -6.336 -1.805 -0.168 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.956 0.630 -2.804 1.00 0.00 H new ATOM 0 HZ PHE A 52 -5.857 -0.927 -2.439 1.00 0.00 H new ATOM 293 N THR A 53 -2.812 1.322 4.832 1.00 0.00 N ATOM 294 CA THR A 53 -2.043 1.196 6.075 1.00 0.00 C ATOM 295 C THR A 53 -1.378 -0.173 6.097 1.00 0.00 C ATOM 296 O THR A 53 -2.052 -1.189 5.935 1.00 0.00 O ATOM 297 CB THR A 53 -2.952 1.361 7.301 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.660 2.580 7.201 1.00 0.00 O ATOM 299 CG2 THR A 53 -2.146 1.398 8.602 1.00 0.00 C ATOM 0 H THR A 53 -3.705 0.830 4.870 1.00 0.00 H new ATOM 0 HA THR A 53 -1.288 1.981 6.113 1.00 0.00 H new ATOM 0 HB THR A 53 -3.629 0.507 7.322 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.242 2.686 7.983 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.824 1.516 9.447 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.588 0.468 8.711 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.451 2.237 8.575 1.00 0.00 H new ATOM 307 N CYS A 54 -0.069 -0.210 6.335 1.00 0.00 N ATOM 308 CA CYS A 54 0.697 -1.434 6.587 1.00 0.00 C ATOM 309 C CYS A 54 1.443 -1.307 7.923 1.00 0.00 C ATOM 310 O CYS A 54 2.143 -0.321 8.171 1.00 0.00 O ATOM 311 CB CYS A 54 1.662 -1.703 5.421 1.00 0.00 C ATOM 312 SG CYS A 54 0.857 -2.199 3.866 1.00 0.00 S ATOM 0 H CYS A 54 0.506 0.632 6.359 1.00 0.00 H new ATOM 0 HA CYS A 54 0.020 -2.285 6.656 1.00 0.00 H new ATOM 0 HB2 CYS A 54 2.250 -0.803 5.239 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.360 -2.485 5.718 1.00 0.00 H new ATOM 317 N SER A 55 1.295 -2.299 8.796 1.00 0.00 N ATOM 318 CA SER A 55 1.832 -2.271 10.157 1.00 0.00 C ATOM 319 C SER A 55 2.969 -3.287 10.289 1.00 0.00 C ATOM 320 O SER A 55 2.783 -4.463 9.972 1.00 0.00 O ATOM 321 CB SER A 55 0.726 -2.601 11.175 1.00 0.00 C ATOM 322 OG SER A 55 -0.414 -1.763 11.037 1.00 0.00 O ATOM 0 H SER A 55 0.792 -3.159 8.577 1.00 0.00 H new ATOM 0 HA SER A 55 2.214 -1.271 10.360 1.00 0.00 H new ATOM 0 HB2 SER A 55 0.424 -3.641 11.053 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.125 -2.501 12.184 1.00 0.00 H new ATOM 0 HG SER A 55 -0.127 -0.859 10.790 1.00 0.00 H new ATOM 328 N PHE A 56 4.132 -2.848 10.783 1.00 0.00 N ATOM 329 CA PHE A 56 5.281 -3.708 11.073 1.00 0.00 C ATOM 330 C PHE A 56 6.054 -3.194 12.294 1.00 0.00 C ATOM 331 O PHE A 56 6.260 -1.989 12.429 1.00 0.00 O ATOM 332 CB PHE A 56 6.279 -3.708 9.902 1.00 0.00 C ATOM 333 CG PHE A 56 5.825 -4.299 8.587 1.00 0.00 C ATOM 334 CD1 PHE A 56 5.946 -5.681 8.354 1.00 0.00 C ATOM 335 CD2 PHE A 56 5.373 -3.451 7.561 1.00 0.00 C ATOM 336 CE1 PHE A 56 5.633 -6.213 7.090 1.00 0.00 C ATOM 337 CE2 PHE A 56 5.040 -3.987 6.306 1.00 0.00 C ATOM 338 CZ PHE A 56 5.190 -5.364 6.062 1.00 0.00 C ATOM 0 H PHE A 56 4.303 -1.865 10.996 1.00 0.00 H new ATOM 0 HA PHE A 56 4.883 -4.707 11.250 1.00 0.00 H new ATOM 0 HB2 PHE A 56 6.580 -2.677 9.719 1.00 0.00 H new ATOM 0 HB3 PHE A 56 7.170 -4.248 10.222 1.00 0.00 H new ATOM 0 HD1 PHE A 56 6.280 -6.334 9.147 1.00 0.00 H new ATOM 0 HD2 PHE A 56 5.282 -2.389 7.737 1.00 0.00 H new ATOM 0 HE1 PHE A 56 5.733 -7.273 6.910 1.00 0.00 H new ATOM 0 HE2 PHE A 56 4.668 -3.340 5.526 1.00 0.00 H new ATOM 0 HZ PHE A 56 4.965 -5.768 5.086 1.00 0.00 H new ATOM 424 N PHE A 63 16.726 -0.691 8.670 1.00 0.00 N ATOM 425 CA PHE A 63 15.834 -1.577 7.910 1.00 0.00 C ATOM 426 C PHE A 63 15.436 -0.970 6.552 1.00 0.00 C ATOM 427 O PHE A 63 15.664 0.216 6.305 1.00 0.00 O ATOM 428 CB PHE A 63 14.579 -1.908 8.751 1.00 0.00 C ATOM 429 CG PHE A 63 13.651 -0.731 9.014 1.00 0.00 C ATOM 430 CD1 PHE A 63 13.880 0.117 10.115 1.00 0.00 C ATOM 431 CD2 PHE A 63 12.547 -0.487 8.171 1.00 0.00 C ATOM 432 CE1 PHE A 63 13.017 1.199 10.371 1.00 0.00 C ATOM 433 CE2 PHE A 63 11.690 0.600 8.422 1.00 0.00 C ATOM 434 CZ PHE A 63 11.923 1.442 9.522 1.00 0.00 C ATOM 0 HA PHE A 63 16.378 -2.498 7.699 1.00 0.00 H new ATOM 0 HB2 PHE A 63 14.015 -2.689 8.242 1.00 0.00 H new ATOM 0 HB3 PHE A 63 14.900 -2.319 9.708 1.00 0.00 H new ATOM 0 HD1 PHE A 63 14.722 -0.064 10.766 1.00 0.00 H new ATOM 0 HD2 PHE A 63 12.359 -1.137 7.329 1.00 0.00 H new ATOM 0 HE1 PHE A 63 13.195 1.843 11.220 1.00 0.00 H new ATOM 0 HE2 PHE A 63 10.851 0.787 7.768 1.00 0.00 H new ATOM 0 HZ PHE A 63 11.263 2.275 9.715 1.00 0.00 H new ATOM 444 N VAL A 64 14.811 -1.781 5.693 1.00 0.00 N ATOM 445 CA VAL A 64 14.143 -1.347 4.457 1.00 0.00 C ATOM 446 C VAL A 64 12.705 -1.869 4.492 1.00 0.00 C ATOM 447 O VAL A 64 12.466 -3.073 4.563 1.00 0.00 O ATOM 448 CB VAL A 64 14.853 -1.841 3.170 1.00 0.00 C ATOM 449 CG1 VAL A 64 14.205 -1.208 1.924 1.00 0.00 C ATOM 450 CG2 VAL A 64 16.352 -1.494 3.172 1.00 0.00 C ATOM 0 H VAL A 64 14.753 -2.789 5.841 1.00 0.00 H new ATOM 0 HA VAL A 64 14.174 -0.258 4.419 1.00 0.00 H new ATOM 0 HB VAL A 64 14.744 -2.925 3.145 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.714 -1.564 1.028 1.00 0.00 H new ATOM 0 HG12 VAL A 64 13.153 -1.488 1.879 1.00 0.00 H new ATOM 0 HG13 VAL A 64 14.289 -0.123 1.982 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.811 -1.858 2.253 1.00 0.00 H new ATOM 0 HG22 VAL A 64 16.475 -0.413 3.236 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.833 -1.965 4.029 1.00 0.00 H new ATOM 460 N LEU A 65 11.746 -0.949 4.445 1.00 0.00 N ATOM 461 CA LEU A 65 10.327 -1.233 4.250 1.00 0.00 C ATOM 462 C LEU A 65 9.976 -0.988 2.781 1.00 0.00 C ATOM 463 O LEU A 65 10.443 -0.022 2.189 1.00 0.00 O ATOM 464 CB LEU A 65 9.533 -0.332 5.204 1.00 0.00 C ATOM 465 CG LEU A 65 8.008 -0.380 5.020 1.00 0.00 C ATOM 466 CD1 LEU A 65 7.427 -1.770 5.301 1.00 0.00 C ATOM 467 CD2 LEU A 65 7.394 0.636 5.979 1.00 0.00 C ATOM 0 H LEU A 65 11.941 0.047 4.545 1.00 0.00 H new ATOM 0 HA LEU A 65 10.080 -2.270 4.475 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.770 -0.615 6.230 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.868 0.697 5.072 1.00 0.00 H new ATOM 0 HG LEU A 65 7.773 -0.146 3.982 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.347 -1.749 5.157 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.870 -2.495 4.618 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.650 -2.057 6.329 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.309 0.627 5.873 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.661 0.377 7.004 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.773 1.631 5.746 1.00 0.00 H new ATOM 479 N ASN A 66 9.154 -1.855 2.196 1.00 0.00 N ATOM 480 CA ASN A 66 8.862 -1.891 0.763 1.00 0.00 C ATOM 481 C ASN A 66 7.354 -2.023 0.507 1.00 0.00 C ATOM 482 O ASN A 66 6.621 -2.618 1.305 1.00 0.00 O ATOM 483 CB ASN A 66 9.574 -3.091 0.118 1.00 0.00 C ATOM 484 CG ASN A 66 11.059 -3.201 0.440 1.00 0.00 C ATOM 485 OD1 ASN A 66 11.907 -2.739 -0.313 1.00 0.00 O ATOM 486 ND2 ASN A 66 11.413 -3.855 1.531 1.00 0.00 N ATOM 0 H ASN A 66 8.657 -2.575 2.721 1.00 0.00 H new ATOM 0 HA ASN A 66 9.216 -0.957 0.327 1.00 0.00 H new ATOM 0 HB2 ASN A 66 9.078 -4.006 0.441 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.455 -3.028 -0.964 1.00 0.00 H new ATOM 0 HD21 ASN A 66 12.401 -3.979 1.753 1.00 0.00 H new ATOM 0 HD22 ASN A 66 10.699 -4.236 2.152 1.00 0.00 H new ATOM 493 N TRP A 67 6.907 -1.522 -0.643 1.00 0.00 N ATOM 494 CA TRP A 67 5.530 -1.627 -1.121 1.00 0.00 C ATOM 495 C TRP A 67 5.484 -2.182 -2.551 1.00 0.00 C ATOM 496 O TRP A 67 6.310 -1.813 -3.388 1.00 0.00 O ATOM 497 CB TRP A 67 4.922 -0.230 -1.050 1.00 0.00 C ATOM 498 CG TRP A 67 3.505 -0.103 -1.509 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.497 -0.980 -1.305 1.00 0.00 C ATOM 500 CD2 TRP A 67 2.923 1.006 -2.244 1.00 0.00 C ATOM 501 NE1 TRP A 67 1.344 -0.510 -1.903 1.00 0.00 N ATOM 502 CE2 TRP A 67 1.545 0.725 -2.483 1.00 0.00 C ATOM 503 CE3 TRP A 67 3.429 2.242 -2.694 1.00 0.00 C ATOM 504 CZ2 TRP A 67 0.708 1.627 -3.153 1.00 0.00 C ATOM 505 CZ3 TRP A 67 2.597 3.156 -3.355 1.00 0.00 C ATOM 506 CH2 TRP A 67 1.248 2.848 -3.588 1.00 0.00 C ATOM 0 H TRP A 67 7.513 -1.015 -1.288 1.00 0.00 H new ATOM 0 HA TRP A 67 4.961 -2.321 -0.502 1.00 0.00 H new ATOM 0 HB2 TRP A 67 4.980 0.117 -0.018 1.00 0.00 H new ATOM 0 HB3 TRP A 67 5.537 0.442 -1.648 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.580 -1.907 -0.758 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.456 -1.013 -1.914 1.00 0.00 H new ATOM 0 HE3 TRP A 67 4.468 2.487 -2.528 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -0.330 1.388 -3.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 2.997 4.103 -3.687 1.00 0.00 H new ATOM 0 HH2 TRP A 67 0.619 3.557 -4.107 1.00 0.00 H new ATOM 517 N TYR A 68 4.523 -3.066 -2.833 1.00 0.00 N ATOM 518 CA TYR A 68 4.453 -3.840 -4.070 1.00 0.00 C ATOM 519 C TYR A 68 3.058 -3.904 -4.708 1.00 0.00 C ATOM 520 O TYR A 68 2.037 -4.050 -4.031 1.00 0.00 O ATOM 521 CB TYR A 68 4.899 -5.287 -3.805 1.00 0.00 C ATOM 522 CG TYR A 68 6.290 -5.453 -3.233 1.00 0.00 C ATOM 523 CD1 TYR A 68 7.395 -5.560 -4.098 1.00 0.00 C ATOM 524 CD2 TYR A 68 6.480 -5.535 -1.840 1.00 0.00 C ATOM 525 CE1 TYR A 68 8.691 -5.726 -3.578 1.00 0.00 C ATOM 526 CE2 TYR A 68 7.770 -5.725 -1.312 1.00 0.00 C ATOM 527 CZ TYR A 68 8.883 -5.805 -2.181 1.00 0.00 C ATOM 528 OH TYR A 68 10.142 -5.949 -1.683 1.00 0.00 O ATOM 0 H TYR A 68 3.756 -3.266 -2.191 1.00 0.00 H new ATOM 0 HA TYR A 68 5.110 -3.318 -4.765 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.187 -5.747 -3.119 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.843 -5.842 -4.742 1.00 0.00 H new ATOM 0 HD1 TYR A 68 7.247 -5.514 -5.167 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.633 -5.452 -1.175 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.538 -5.793 -4.245 1.00 0.00 H new ATOM 0 HE2 TYR A 68 7.910 -5.810 -0.244 1.00 0.00 H new ATOM 0 HH TYR A 68 10.104 -5.986 -0.704 1.00 0.00 H new ATOM 538 N ARG A 69 3.054 -3.880 -6.043 1.00 0.00 N ATOM 539 CA ARG A 69 1.920 -4.221 -6.905 1.00 0.00 C ATOM 540 C ARG A 69 2.055 -5.703 -7.261 1.00 0.00 C ATOM 541 O ARG A 69 3.178 -6.173 -7.454 1.00 0.00 O ATOM 542 CB ARG A 69 2.000 -3.373 -8.182 1.00 0.00 C ATOM 543 CG ARG A 69 0.862 -3.629 -9.176 1.00 0.00 C ATOM 544 CD ARG A 69 1.089 -2.856 -10.482 1.00 0.00 C ATOM 545 NE ARG A 69 2.319 -3.274 -11.195 1.00 0.00 N ATOM 546 CZ ARG A 69 2.596 -4.458 -11.734 1.00 0.00 C ATOM 547 NH1 ARG A 69 1.745 -5.463 -11.742 1.00 0.00 N1+ ATOM 548 NH2 ARG A 69 3.774 -4.663 -12.278 1.00 0.00 N ATOM 0 H ARG A 69 3.880 -3.610 -6.577 1.00 0.00 H new ATOM 0 HA ARG A 69 0.968 -4.030 -6.409 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.996 -2.319 -7.906 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.951 -3.570 -8.677 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.793 -4.696 -9.388 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.088 -3.330 -8.732 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.229 -2.999 -11.137 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.148 -1.790 -10.262 1.00 0.00 H new ATOM 0 HE ARG A 69 3.045 -2.564 -11.284 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.822 -5.353 -11.321 1.00 0.00 H new ATOM 0 HH12 ARG A 69 2.008 -6.351 -12.169 1.00 0.00 H new ATOM 0 HH21 ARG A 69 4.469 -3.917 -12.285 1.00 0.00 H new ATOM 0 HH22 ARG A 69 3.993 -5.568 -12.693 1.00 0.00 H new ATOM 562 N MET A 70 0.951 -6.441 -7.381 1.00 0.00 N ATOM 563 CA MET A 70 0.972 -7.826 -7.872 1.00 0.00 C ATOM 564 C MET A 70 0.643 -7.917 -9.368 1.00 0.00 C ATOM 565 O MET A 70 -0.177 -7.160 -9.889 1.00 0.00 O ATOM 566 CB MET A 70 0.022 -8.717 -7.069 1.00 0.00 C ATOM 567 CG MET A 70 0.251 -8.593 -5.556 1.00 0.00 C ATOM 568 SD MET A 70 -0.303 -10.021 -4.600 1.00 0.00 S ATOM 569 CE MET A 70 1.069 -11.149 -4.961 1.00 0.00 C ATOM 0 H MET A 70 0.019 -6.101 -7.143 1.00 0.00 H new ATOM 0 HA MET A 70 1.991 -8.187 -7.733 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.009 -8.449 -7.302 1.00 0.00 H new ATOM 0 HB3 MET A 70 0.158 -9.755 -7.371 1.00 0.00 H new ATOM 0 HG2 MET A 70 1.314 -8.439 -5.373 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.267 -7.705 -5.194 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.675 -12.092 -5.339 1.00 0.00 H new ATOM 0 HE2 MET A 70 1.720 -10.701 -5.712 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.638 -11.333 -4.050 1.00 0.00 H new ATOM 579 N SER A 71 1.264 -8.869 -10.053 1.00 0.00 N ATOM 580 CA SER A 71 0.940 -9.265 -11.432 1.00 0.00 C ATOM 581 C SER A 71 0.133 -10.587 -11.463 1.00 0.00 C ATOM 582 O SER A 71 0.201 -11.355 -10.493 1.00 0.00 O ATOM 583 CB SER A 71 2.237 -9.388 -12.247 1.00 0.00 C ATOM 584 OG SER A 71 2.838 -8.112 -12.440 1.00 0.00 O ATOM 0 H SER A 71 2.034 -9.409 -9.657 1.00 0.00 H new ATOM 0 HA SER A 71 0.311 -8.496 -11.880 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.934 -10.049 -11.731 1.00 0.00 H new ATOM 0 HB3 SER A 71 2.022 -9.843 -13.214 1.00 0.00 H new ATOM 0 HG SER A 71 3.663 -8.214 -12.959 1.00 0.00 H new ATOM 590 N PRO A 72 -0.618 -10.886 -12.551 1.00 0.00 N ATOM 591 CA PRO A 72 -1.538 -12.031 -12.637 1.00 0.00 C ATOM 592 C PRO A 72 -0.900 -13.402 -12.374 1.00 0.00 C ATOM 593 O PRO A 72 -1.560 -14.293 -11.843 1.00 0.00 O ATOM 594 CB PRO A 72 -2.127 -11.988 -14.051 1.00 0.00 C ATOM 595 CG PRO A 72 -2.032 -10.517 -14.435 1.00 0.00 C ATOM 596 CD PRO A 72 -0.732 -10.082 -13.763 1.00 0.00 C ATOM 0 HA PRO A 72 -2.285 -11.932 -11.849 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -1.564 -12.619 -14.739 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.158 -12.340 -14.066 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.995 -10.382 -15.516 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.887 -9.947 -14.072 1.00 0.00 H new ATOM 0 HD2 PRO A 72 0.121 -10.245 -14.421 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -0.752 -9.018 -13.525 1.00 0.00 H new ATOM 604 N SER A 73 0.381 -13.576 -12.710 1.00 0.00 N ATOM 605 CA SER A 73 1.153 -14.813 -12.489 1.00 0.00 C ATOM 606 C SER A 73 1.611 -15.006 -11.022 1.00 0.00 C ATOM 607 O SER A 73 2.479 -15.839 -10.749 1.00 0.00 O ATOM 608 CB SER A 73 2.375 -14.817 -13.431 1.00 0.00 C ATOM 609 OG SER A 73 2.017 -14.545 -14.785 1.00 0.00 O ATOM 0 H SER A 73 0.930 -12.842 -13.157 1.00 0.00 H new ATOM 0 HA SER A 73 0.490 -15.650 -12.709 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.095 -14.072 -13.091 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.870 -15.787 -13.376 1.00 0.00 H new ATOM 0 HG SER A 73 2.821 -14.556 -15.345 1.00 0.00 H new ATOM 615 N ASN A 74 1.082 -14.209 -10.081 1.00 0.00 N ATOM 616 CA ASN A 74 1.420 -14.179 -8.647 1.00 0.00 C ATOM 617 C ASN A 74 2.839 -13.627 -8.387 1.00 0.00 C ATOM 618 O ASN A 74 3.472 -13.935 -7.374 1.00 0.00 O ATOM 619 CB ASN A 74 1.123 -15.545 -7.987 1.00 0.00 C ATOM 620 CG ASN A 74 1.097 -15.491 -6.459 1.00 0.00 C ATOM 621 OD1 ASN A 74 0.376 -14.706 -5.851 1.00 0.00 O ATOM 622 ND2 ASN A 74 1.866 -16.336 -5.793 1.00 0.00 N ATOM 0 H ASN A 74 0.362 -13.525 -10.314 1.00 0.00 H new ATOM 0 HA ASN A 74 0.767 -13.461 -8.151 1.00 0.00 H new ATOM 0 HB2 ASN A 74 0.161 -15.912 -8.346 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.877 -16.265 -8.305 1.00 0.00 H new ATOM 0 HD21 ASN A 74 1.860 -16.336 -4.773 1.00 0.00 H new ATOM 0 HD22 ASN A 74 2.465 -16.988 -6.299 1.00 0.00 H new ATOM 629 N GLN A 75 3.343 -12.802 -9.312 1.00 0.00 N ATOM 630 CA GLN A 75 4.602 -12.069 -9.163 1.00 0.00 C ATOM 631 C GLN A 75 4.348 -10.668 -8.575 1.00 0.00 C ATOM 632 O GLN A 75 3.196 -10.237 -8.469 1.00 0.00 O ATOM 633 CB GLN A 75 5.333 -12.003 -10.518 1.00 0.00 C ATOM 634 CG GLN A 75 5.744 -13.393 -11.036 1.00 0.00 C ATOM 635 CD GLN A 75 6.510 -13.308 -12.357 1.00 0.00 C ATOM 636 OE1 GLN A 75 5.967 -13.499 -13.439 1.00 0.00 O ATOM 637 NE2 GLN A 75 7.794 -13.003 -12.334 1.00 0.00 N ATOM 0 H GLN A 75 2.877 -12.623 -10.201 1.00 0.00 H new ATOM 0 HA GLN A 75 5.246 -12.598 -8.461 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.687 -11.522 -11.252 1.00 0.00 H new ATOM 0 HB3 GLN A 75 6.221 -11.379 -10.418 1.00 0.00 H new ATOM 0 HG2 GLN A 75 6.363 -13.890 -10.289 1.00 0.00 H new ATOM 0 HG3 GLN A 75 4.854 -14.007 -11.172 1.00 0.00 H new ATOM 0 HE21 GLN A 75 8.264 -12.840 -11.443 1.00 0.00 H new ATOM 0 HE22 GLN A 75 8.317 -12.930 -13.207 1.00 0.00 H new ATOM 646 N THR A 76 5.418 -9.955 -8.200 1.00 0.00 N ATOM 647 CA THR A 76 5.379 -8.651 -7.520 1.00 0.00 C ATOM 648 C THR A 76 6.362 -7.669 -8.138 1.00 0.00 C ATOM 649 O THR A 76 7.389 -8.052 -8.700 1.00 0.00 O ATOM 650 CB THR A 76 5.664 -8.776 -6.014 1.00 0.00 C ATOM 651 OG1 THR A 76 6.757 -9.645 -5.787 1.00 0.00 O ATOM 652 CG2 THR A 76 4.445 -9.300 -5.255 1.00 0.00 C ATOM 0 H THR A 76 6.370 -10.281 -8.367 1.00 0.00 H new ATOM 0 HA THR A 76 4.366 -8.271 -7.651 1.00 0.00 H new ATOM 0 HB THR A 76 5.903 -7.778 -5.647 1.00 0.00 H new ATOM 0 HG1 THR A 76 6.927 -9.713 -4.824 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.682 -9.376 -4.194 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.609 -8.614 -5.392 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.174 -10.284 -5.637 1.00 0.00 H new ATOM 660 N ASP A 77 6.032 -6.385 -8.018 1.00 0.00 N ATOM 661 CA ASP A 77 6.785 -5.255 -8.564 1.00 0.00 C ATOM 662 C ASP A 77 6.875 -4.133 -7.525 1.00 0.00 C ATOM 663 O ASP A 77 5.853 -3.689 -6.998 1.00 0.00 O ATOM 664 CB ASP A 77 6.034 -4.756 -9.801 1.00 0.00 C ATOM 665 CG ASP A 77 6.808 -3.794 -10.714 1.00 0.00 C ATOM 666 OD1 ASP A 77 8.053 -3.687 -10.603 1.00 0.00 O1- ATOM 667 OD2 ASP A 77 6.140 -3.169 -11.575 1.00 0.00 O ATOM 0 H ASP A 77 5.195 -6.089 -7.515 1.00 0.00 H new ATOM 0 HA ASP A 77 7.798 -5.562 -8.824 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.731 -5.621 -10.391 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.122 -4.259 -9.472 1.00 0.00 H new ATOM 672 N LYS A 78 8.089 -3.676 -7.213 1.00 0.00 N ATOM 673 CA LYS A 78 8.305 -2.665 -6.167 1.00 0.00 C ATOM 674 C LYS A 78 7.883 -1.270 -6.662 1.00 0.00 C ATOM 675 O LYS A 78 8.340 -0.796 -7.706 1.00 0.00 O ATOM 676 CB LYS A 78 9.758 -2.677 -5.642 1.00 0.00 C ATOM 677 CG LYS A 78 9.816 -2.069 -4.224 1.00 0.00 C ATOM 678 CD LYS A 78 11.212 -1.619 -3.759 1.00 0.00 C ATOM 679 CE LYS A 78 12.335 -2.666 -3.829 1.00 0.00 C ATOM 680 NZ LYS A 78 12.101 -3.839 -2.949 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.945 -3.990 -7.671 1.00 0.00 H new ATOM 0 HA LYS A 78 7.670 -2.923 -5.320 1.00 0.00 H new ATOM 0 HB2 LYS A 78 10.138 -3.699 -5.624 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.401 -2.110 -6.316 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.144 -1.211 -4.186 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.434 -2.804 -3.515 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.510 -0.760 -4.360 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.132 -1.274 -2.728 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.439 -3.008 -4.859 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.279 -2.196 -3.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 12.893 -4.507 -3.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 12.029 -3.523 -1.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 11.216 -4.310 -3.227 1.00 0.00 H new ATOM 694 N LEU A 79 7.011 -0.612 -5.897 1.00 0.00 N ATOM 695 CA LEU A 79 6.443 0.704 -6.202 1.00 0.00 C ATOM 696 C LEU A 79 7.232 1.817 -5.516 1.00 0.00 C ATOM 697 O LEU A 79 7.645 2.769 -6.176 1.00 0.00 O ATOM 698 CB LEU A 79 4.977 0.706 -5.746 1.00 0.00 C ATOM 699 CG LEU A 79 4.095 -0.314 -6.492 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.735 -0.337 -5.795 1.00 0.00 C ATOM 701 CD2 LEU A 79 3.950 0.046 -7.980 1.00 0.00 C ATOM 0 H LEU A 79 6.668 -0.994 -5.016 1.00 0.00 H new ATOM 0 HA LEU A 79 6.500 0.893 -7.274 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.938 0.494 -4.678 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.563 1.704 -5.888 1.00 0.00 H new ATOM 0 HG LEU A 79 4.556 -1.301 -6.461 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.081 -1.050 -6.297 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.865 -0.634 -4.754 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.288 0.656 -5.836 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.322 -0.695 -8.474 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.492 1.031 -8.073 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.934 0.058 -8.449 1.00 0.00 H new ATOM 713 N ALA A 80 7.485 1.670 -4.213 1.00 0.00 N ATOM 714 CA ALA A 80 8.268 2.591 -3.394 1.00 0.00 C ATOM 715 C ALA A 80 8.748 1.892 -2.107 1.00 0.00 C ATOM 716 O ALA A 80 8.421 0.728 -1.854 1.00 0.00 O ATOM 717 CB ALA A 80 7.434 3.860 -3.132 1.00 0.00 C ATOM 0 H ALA A 80 7.135 0.873 -3.681 1.00 0.00 H new ATOM 0 HA ALA A 80 9.173 2.899 -3.918 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.010 4.554 -2.521 1.00 0.00 H new ATOM 0 HB2 ALA A 80 7.184 4.334 -4.081 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.517 3.591 -2.608 1.00 0.00 H new ATOM 723 N ALA A 81 9.533 2.611 -1.305 1.00 0.00 N ATOM 724 CA ALA A 81 10.180 2.105 -0.097 1.00 0.00 C ATOM 725 C ALA A 81 10.436 3.221 0.932 1.00 0.00 C ATOM 726 O ALA A 81 10.357 4.409 0.609 1.00 0.00 O ATOM 727 CB ALA A 81 11.484 1.401 -0.510 1.00 0.00 C ATOM 0 H ALA A 81 9.742 3.593 -1.485 1.00 0.00 H new ATOM 0 HA ALA A 81 9.518 1.394 0.398 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.985 1.014 0.377 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.254 0.577 -1.185 1.00 0.00 H new ATOM 0 HB3 ALA A 81 12.137 2.112 -1.015 1.00 0.00 H new ATOM 733 N PHE A 82 10.765 2.821 2.161 1.00 0.00 N ATOM 734 CA PHE A 82 11.200 3.683 3.258 1.00 0.00 C ATOM 735 C PHE A 82 12.382 3.008 3.995 1.00 0.00 C ATOM 736 O PHE A 82 12.173 1.944 4.588 1.00 0.00 O ATOM 737 CB PHE A 82 10.003 3.937 4.186 1.00 0.00 C ATOM 738 CG PHE A 82 10.311 4.833 5.369 1.00 0.00 C ATOM 739 CD1 PHE A 82 10.284 6.231 5.214 1.00 0.00 C ATOM 740 CD2 PHE A 82 10.625 4.273 6.622 1.00 0.00 C ATOM 741 CE1 PHE A 82 10.568 7.068 6.309 1.00 0.00 C ATOM 742 CE2 PHE A 82 10.912 5.109 7.715 1.00 0.00 C ATOM 743 CZ PHE A 82 10.883 6.506 7.559 1.00 0.00 C ATOM 0 H PHE A 82 10.733 1.838 2.431 1.00 0.00 H new ATOM 0 HA PHE A 82 11.551 4.647 2.889 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.197 4.385 3.606 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.635 2.980 4.556 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.045 6.662 4.253 1.00 0.00 H new ATOM 0 HD2 PHE A 82 10.645 3.200 6.744 1.00 0.00 H new ATOM 0 HE1 PHE A 82 10.544 8.141 6.189 1.00 0.00 H new ATOM 0 HE2 PHE A 82 11.155 4.678 8.675 1.00 0.00 H new ATOM 0 HZ PHE A 82 11.103 7.148 8.399 1.00 0.00 H new ATOM 753 N PRO A 83 13.607 3.579 3.985 1.00 0.00 N ATOM 754 CA PRO A 83 14.047 4.766 3.243 1.00 0.00 C ATOM 755 C PRO A 83 13.819 4.673 1.726 1.00 0.00 C ATOM 756 O PRO A 83 13.696 3.581 1.171 1.00 0.00 O ATOM 757 CB PRO A 83 15.540 4.926 3.556 1.00 0.00 C ATOM 758 CG PRO A 83 15.705 4.219 4.899 1.00 0.00 C ATOM 759 CD PRO A 83 14.711 3.067 4.785 1.00 0.00 C ATOM 0 HA PRO A 83 13.456 5.627 3.555 1.00 0.00 H new ATOM 0 HB2 PRO A 83 16.162 4.471 2.785 1.00 0.00 H new ATOM 0 HB3 PRO A 83 15.826 5.976 3.618 1.00 0.00 H new ATOM 0 HG2 PRO A 83 16.724 3.863 5.049 1.00 0.00 H new ATOM 0 HG3 PRO A 83 15.471 4.877 5.736 1.00 0.00 H new ATOM 0 HD2 PRO A 83 15.169 2.199 4.310 1.00 0.00 H new ATOM 0 HD3 PRO A 83 14.367 2.748 5.769 1.00 0.00 H new ATOM 907 N ARG A 94 4.794 9.486 -7.938 1.00 0.00 N ATOM 908 CA ARG A 94 3.390 9.201 -7.602 1.00 0.00 C ATOM 909 C ARG A 94 3.203 8.079 -6.569 1.00 0.00 C ATOM 910 O ARG A 94 2.117 7.973 -5.999 1.00 0.00 O ATOM 911 CB ARG A 94 2.559 8.930 -8.870 1.00 0.00 C ATOM 912 CG ARG A 94 2.743 7.521 -9.467 1.00 0.00 C ATOM 913 CD ARG A 94 2.003 7.372 -10.802 1.00 0.00 C ATOM 914 NE ARG A 94 0.534 7.461 -10.646 1.00 0.00 N ATOM 915 CZ ARG A 94 -0.341 6.462 -10.701 1.00 0.00 C ATOM 916 NH1 ARG A 94 0.022 5.203 -10.813 1.00 0.00 N ATOM 917 NH2 ARG A 94 -1.627 6.711 -10.649 1.00 0.00 N1+ ATOM 0 HA ARG A 94 3.018 10.105 -7.120 1.00 0.00 H new ATOM 0 HB2 ARG A 94 1.505 9.077 -8.636 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.823 9.669 -9.627 1.00 0.00 H new ATOM 0 HG2 ARG A 94 3.805 7.324 -9.615 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.376 6.776 -8.762 1.00 0.00 H new ATOM 0 HD2 ARG A 94 2.340 8.148 -11.490 1.00 0.00 H new ATOM 0 HD3 ARG A 94 2.260 6.413 -11.252 1.00 0.00 H new ATOM 0 HE ARG A 94 0.151 8.391 -10.478 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.011 4.960 -10.861 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -0.686 4.470 -10.851 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -1.957 7.672 -10.566 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.297 5.943 -10.691 1.00 0.00 H new ATOM 931 N PHE A 95 4.222 7.247 -6.334 1.00 0.00 N ATOM 932 CA PHE A 95 4.219 6.181 -5.331 1.00 0.00 C ATOM 933 C PHE A 95 5.010 6.622 -4.088 1.00 0.00 C ATOM 934 O PHE A 95 6.159 7.055 -4.209 1.00 0.00 O ATOM 935 CB PHE A 95 4.807 4.906 -5.954 1.00 0.00 C ATOM 936 CG PHE A 95 4.067 4.409 -7.185 1.00 0.00 C ATOM 937 CD1 PHE A 95 2.722 4.002 -7.089 1.00 0.00 C ATOM 938 CD2 PHE A 95 4.723 4.354 -8.431 1.00 0.00 C ATOM 939 CE1 PHE A 95 2.040 3.536 -8.228 1.00 0.00 C ATOM 940 CE2 PHE A 95 4.042 3.885 -9.568 1.00 0.00 C ATOM 941 CZ PHE A 95 2.704 3.468 -9.467 1.00 0.00 C ATOM 0 H PHE A 95 5.098 7.299 -6.853 1.00 0.00 H new ATOM 0 HA PHE A 95 3.199 5.971 -5.010 1.00 0.00 H new ATOM 0 HB2 PHE A 95 5.847 5.093 -6.221 1.00 0.00 H new ATOM 0 HB3 PHE A 95 4.808 4.116 -5.203 1.00 0.00 H new ATOM 0 HD1 PHE A 95 2.212 4.048 -6.138 1.00 0.00 H new ATOM 0 HD2 PHE A 95 5.752 4.673 -8.513 1.00 0.00 H new ATOM 0 HE1 PHE A 95 1.007 3.230 -8.151 1.00 0.00 H new ATOM 0 HE2 PHE A 95 4.548 3.845 -10.521 1.00 0.00 H new ATOM 0 HZ PHE A 95 2.186 3.096 -10.339 1.00 0.00 H new ATOM 951 N ARG A 96 4.395 6.521 -2.901 1.00 0.00 N ATOM 952 CA ARG A 96 4.926 7.067 -1.638 1.00 0.00 C ATOM 953 C ARG A 96 4.824 6.061 -0.483 1.00 0.00 C ATOM 954 O ARG A 96 3.824 5.351 -0.385 1.00 0.00 O ATOM 955 CB ARG A 96 4.132 8.330 -1.252 1.00 0.00 C ATOM 956 CG ARG A 96 4.087 9.415 -2.345 1.00 0.00 C ATOM 957 CD ARG A 96 3.330 10.663 -1.875 1.00 0.00 C ATOM 958 NE ARG A 96 1.901 10.385 -1.629 1.00 0.00 N ATOM 959 CZ ARG A 96 1.021 11.217 -1.083 1.00 0.00 C ATOM 960 NH1 ARG A 96 1.350 12.436 -0.707 1.00 0.00 N1+ ATOM 961 NH2 ARG A 96 -0.222 10.826 -0.909 1.00 0.00 N ATOM 0 H ARG A 96 3.498 6.049 -2.787 1.00 0.00 H new ATOM 0 HA ARG A 96 5.979 7.297 -1.802 1.00 0.00 H new ATOM 0 HB2 ARG A 96 3.111 8.040 -1.003 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.570 8.758 -0.351 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.103 9.690 -2.626 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.607 9.013 -3.237 1.00 0.00 H new ATOM 0 HD2 ARG A 96 3.788 11.042 -0.961 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.422 11.447 -2.626 1.00 0.00 H new ATOM 0 HE ARG A 96 1.556 9.466 -1.905 1.00 0.00 H new ATOM 0 HH11 ARG A 96 2.306 12.768 -0.832 1.00 0.00 H new ATOM 0 HH12 ARG A 96 0.648 13.048 -0.291 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -0.506 9.888 -1.193 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -0.902 11.460 -0.490 1.00 0.00 H new ATOM 975 N VAL A 97 5.823 6.035 0.408 1.00 0.00 N ATOM 976 CA VAL A 97 5.792 5.317 1.702 1.00 0.00 C ATOM 977 C VAL A 97 6.147 6.296 2.833 1.00 0.00 C ATOM 978 O VAL A 97 7.174 6.974 2.751 1.00 0.00 O ATOM 979 CB VAL A 97 6.739 4.093 1.743 1.00 0.00 C ATOM 980 CG1 VAL A 97 6.547 3.292 3.043 1.00 0.00 C ATOM 981 CG2 VAL A 97 6.518 3.152 0.547 1.00 0.00 C ATOM 0 H VAL A 97 6.704 6.525 0.250 1.00 0.00 H new ATOM 0 HA VAL A 97 4.782 4.929 1.833 1.00 0.00 H new ATOM 0 HB VAL A 97 7.754 4.487 1.696 1.00 0.00 H new ATOM 0 HG11 VAL A 97 7.224 2.437 3.047 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.764 3.931 3.899 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.517 2.940 3.105 1.00 0.00 H new ATOM 0 HG21 VAL A 97 7.204 2.308 0.617 1.00 0.00 H new ATOM 0 HG22 VAL A 97 5.491 2.787 0.556 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.703 3.693 -0.381 1.00 0.00 H new ATOM 991 N THR A 98 5.306 6.372 3.873 1.00 0.00 N ATOM 992 CA THR A 98 5.410 7.331 4.991 1.00 0.00 C ATOM 993 C THR A 98 5.301 6.611 6.335 1.00 0.00 C ATOM 994 O THR A 98 4.435 5.757 6.505 1.00 0.00 O ATOM 995 CB THR A 98 4.291 8.378 4.855 1.00 0.00 C ATOM 996 OG1 THR A 98 4.403 9.022 3.602 1.00 0.00 O ATOM 997 CG2 THR A 98 4.332 9.459 5.937 1.00 0.00 C ATOM 0 H THR A 98 4.505 5.747 3.966 1.00 0.00 H new ATOM 0 HA THR A 98 6.382 7.823 4.953 1.00 0.00 H new ATOM 0 HB THR A 98 3.351 7.835 4.958 1.00 0.00 H new ATOM 0 HG1 THR A 98 3.690 9.688 3.512 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.515 10.163 5.779 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.228 8.996 6.918 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.283 9.989 5.885 1.00 0.00 H new ATOM 1005 N GLN A 99 6.139 6.977 7.309 1.00 0.00 N ATOM 1006 CA GLN A 99 6.050 6.499 8.696 1.00 0.00 C ATOM 1007 C GLN A 99 5.078 7.371 9.507 1.00 0.00 C ATOM 1008 O GLN A 99 5.131 8.603 9.443 1.00 0.00 O ATOM 1009 CB GLN A 99 7.460 6.496 9.315 1.00 0.00 C ATOM 1010 CG GLN A 99 7.513 5.901 10.737 1.00 0.00 C ATOM 1011 CD GLN A 99 8.937 5.826 11.303 1.00 0.00 C ATOM 1012 OE1 GLN A 99 9.850 6.538 10.901 1.00 0.00 O ATOM 1013 NE2 GLN A 99 9.200 4.971 12.271 1.00 0.00 N ATOM 0 H GLN A 99 6.912 7.625 7.156 1.00 0.00 H new ATOM 0 HA GLN A 99 5.657 5.482 8.712 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.130 5.929 8.668 1.00 0.00 H new ATOM 0 HB3 GLN A 99 7.836 7.519 9.345 1.00 0.00 H new ATOM 0 HG2 GLN A 99 6.895 6.506 11.401 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.081 4.901 10.723 1.00 0.00 H new ATOM 0 HE21 GLN A 99 8.463 4.363 12.629 1.00 0.00 H new ATOM 0 HE22 GLN A 99 10.140 4.917 12.662 1.00 0.00 H new ATOM 1022 N LEU A 100 4.199 6.735 10.290 1.00 0.00 N ATOM 1023 CA LEU A 100 3.192 7.410 11.118 1.00 0.00 C ATOM 1024 C LEU A 100 3.745 7.793 12.505 1.00 0.00 C ATOM 1025 O LEU A 100 4.686 7.145 12.982 1.00 0.00 O ATOM 1026 CB LEU A 100 1.956 6.491 11.252 1.00 0.00 C ATOM 1027 CG LEU A 100 1.311 6.088 9.912 1.00 0.00 C ATOM 1028 CD1 LEU A 100 0.040 5.270 10.162 1.00 0.00 C ATOM 1029 CD2 LEU A 100 0.966 7.297 9.033 1.00 0.00 C ATOM 0 H LEU A 100 4.167 5.718 10.368 1.00 0.00 H new ATOM 0 HA LEU A 100 2.908 8.342 10.629 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.247 5.587 11.787 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.208 6.996 11.863 1.00 0.00 H new ATOM 0 HG LEU A 100 2.049 5.489 9.378 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.407 4.991 9.208 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.291 4.369 10.722 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.670 5.867 10.734 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.515 6.953 8.102 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.263 7.942 9.561 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.875 7.856 8.811 1.00 0.00 H new ATOM 1041 N PRO A 101 3.125 8.769 13.206 1.00 0.00 N ATOM 1042 CA PRO A 101 3.476 9.128 14.582 1.00 0.00 C ATOM 1043 C PRO A 101 3.228 8.004 15.606 1.00 0.00 C ATOM 1044 O PRO A 101 3.646 8.143 16.755 1.00 0.00 O ATOM 1045 CB PRO A 101 2.666 10.391 14.901 1.00 0.00 C ATOM 1046 CG PRO A 101 1.456 10.283 13.979 1.00 0.00 C ATOM 1047 CD PRO A 101 2.053 9.641 12.730 1.00 0.00 C ATOM 0 HA PRO A 101 4.549 9.303 14.659 1.00 0.00 H new ATOM 0 HB2 PRO A 101 2.370 10.423 15.949 1.00 0.00 H new ATOM 0 HB3 PRO A 101 3.241 11.296 14.704 1.00 0.00 H new ATOM 0 HG2 PRO A 101 0.667 9.669 14.414 1.00 0.00 H new ATOM 0 HG3 PRO A 101 1.019 11.259 13.765 1.00 0.00 H new ATOM 0 HD2 PRO A 101 1.300 9.073 12.184 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.438 10.398 12.047 1.00 0.00 H new ATOM 1055 N ASN A 102 2.602 6.880 15.218 1.00 0.00 N ATOM 1056 CA ASN A 102 2.535 5.677 16.062 1.00 0.00 C ATOM 1057 C ASN A 102 3.935 5.055 16.308 1.00 0.00 C ATOM 1058 O ASN A 102 4.163 4.403 17.329 1.00 0.00 O ATOM 1059 CB ASN A 102 1.606 4.668 15.369 1.00 0.00 C ATOM 1060 CG ASN A 102 1.461 3.375 16.167 1.00 0.00 C ATOM 1061 OD1 ASN A 102 2.203 2.420 15.970 1.00 0.00 O ATOM 1062 ND2 ASN A 102 0.528 3.317 17.102 1.00 0.00 N ATOM 0 H ASN A 102 2.132 6.781 14.318 1.00 0.00 H new ATOM 0 HA ASN A 102 2.146 5.949 17.043 1.00 0.00 H new ATOM 0 HB2 ASN A 102 0.623 5.118 15.229 1.00 0.00 H new ATOM 0 HB3 ASN A 102 1.996 4.439 14.377 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.422 2.473 17.665 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.086 4.116 17.260 1.00 0.00 H new ATOM 1069 N GLY A 103 4.881 5.281 15.386 1.00 0.00 N ATOM 1070 CA GLY A 103 6.295 4.886 15.467 1.00 0.00 C ATOM 1071 C GLY A 103 6.590 3.530 14.822 1.00 0.00 C ATOM 1072 O GLY A 103 7.641 3.382 14.195 1.00 0.00 O ATOM 0 H GLY A 103 4.669 5.771 14.517 1.00 0.00 H new ATOM 0 HA2 GLY A 103 6.905 5.649 14.984 1.00 0.00 H new ATOM 0 HA3 GLY A 103 6.595 4.854 16.514 1.00 0.00 H new ATOM 1076 N ARG A 104 5.650 2.580 14.895 1.00 0.00 N ATOM 1077 CA ARG A 104 5.699 1.302 14.172 1.00 0.00 C ATOM 1078 C ARG A 104 4.368 1.045 13.449 1.00 0.00 C ATOM 1079 O ARG A 104 3.577 0.168 13.798 1.00 0.00 O ATOM 1080 CB ARG A 104 6.100 0.164 15.132 1.00 0.00 C ATOM 1081 CG ARG A 104 5.344 0.118 16.474 1.00 0.00 C ATOM 1082 CD ARG A 104 5.546 -1.252 17.126 1.00 0.00 C ATOM 1083 NE ARG A 104 4.953 -1.316 18.472 1.00 0.00 N ATOM 1084 CZ ARG A 104 4.837 -2.412 19.214 1.00 0.00 C ATOM 1085 NH1 ARG A 104 5.221 -3.596 18.781 1.00 0.00 N ATOM 1086 NH2 ARG A 104 4.324 -2.329 20.423 1.00 0.00 N1+ ATOM 0 H ARG A 104 4.815 2.680 15.472 1.00 0.00 H new ATOM 0 HA ARG A 104 6.466 1.345 13.399 1.00 0.00 H new ATOM 0 HB2 ARG A 104 5.951 -0.787 14.620 1.00 0.00 H new ATOM 0 HB3 ARG A 104 7.166 0.250 15.341 1.00 0.00 H new ATOM 0 HG2 ARG A 104 5.707 0.905 17.135 1.00 0.00 H new ATOM 0 HG3 ARG A 104 4.282 0.303 16.312 1.00 0.00 H new ATOM 0 HD2 ARG A 104 5.100 -2.022 16.497 1.00 0.00 H new ATOM 0 HD3 ARG A 104 6.612 -1.470 17.189 1.00 0.00 H new ATOM 0 HE ARG A 104 4.601 -0.445 18.869 1.00 0.00 H new ATOM 0 HH11 ARG A 104 5.623 -3.692 17.848 1.00 0.00 H new ATOM 0 HH12 ARG A 104 5.117 -4.416 19.379 1.00 0.00 H new ATOM 0 HH21 ARG A 104 4.018 -1.426 20.786 1.00 0.00 H new ATOM 0 HH22 ARG A 104 4.233 -3.167 20.997 1.00 0.00 H new ATOM 1100 N ASP A 105 4.177 1.801 12.368 1.00 0.00 N ATOM 1101 CA ASP A 105 2.997 1.828 11.497 1.00 0.00 C ATOM 1102 C ASP A 105 3.266 2.765 10.316 1.00 0.00 C ATOM 1103 O ASP A 105 3.945 3.786 10.476 1.00 0.00 O ATOM 1104 CB ASP A 105 1.740 2.288 12.262 1.00 0.00 C ATOM 1105 CG ASP A 105 0.417 1.726 11.716 1.00 0.00 C ATOM 1106 OD1 ASP A 105 0.440 0.749 10.932 1.00 0.00 O ATOM 1107 OD2 ASP A 105 -0.651 2.240 12.124 1.00 0.00 O1- ATOM 0 H ASP A 105 4.892 2.458 12.054 1.00 0.00 H new ATOM 0 HA ASP A 105 2.810 0.817 11.136 1.00 0.00 H new ATOM 0 HB2 ASP A 105 1.840 1.996 13.307 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.694 3.377 12.238 1.00 0.00 H new ATOM 1112 N PHE A 106 2.754 2.413 9.136 1.00 0.00 N ATOM 1113 CA PHE A 106 3.128 3.078 7.885 1.00 0.00 C ATOM 1114 C PHE A 106 1.947 3.238 6.918 1.00 0.00 C ATOM 1115 O PHE A 106 1.046 2.401 6.862 1.00 0.00 O ATOM 1116 CB PHE A 106 4.284 2.300 7.228 1.00 0.00 C ATOM 1117 CG PHE A 106 5.513 2.120 8.110 1.00 0.00 C ATOM 1118 CD1 PHE A 106 5.586 1.046 9.020 1.00 0.00 C ATOM 1119 CD2 PHE A 106 6.591 3.024 8.019 1.00 0.00 C ATOM 1120 CE1 PHE A 106 6.698 0.907 9.869 1.00 0.00 C ATOM 1121 CE2 PHE A 106 7.717 2.866 8.848 1.00 0.00 C ATOM 1122 CZ PHE A 106 7.764 1.821 9.787 1.00 0.00 C ATOM 0 H PHE A 106 2.072 1.663 9.019 1.00 0.00 H new ATOM 0 HA PHE A 106 3.453 4.090 8.125 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.919 1.317 6.931 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.581 2.818 6.316 1.00 0.00 H new ATOM 0 HD1 PHE A 106 4.783 0.325 9.065 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.553 3.839 7.312 1.00 0.00 H new ATOM 0 HE1 PHE A 106 6.734 0.098 10.584 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.548 3.550 8.762 1.00 0.00 H new ATOM 0 HZ PHE A 106 8.616 1.720 10.443 1.00 0.00 H new ATOM 1132 N HIS A 107 1.975 4.315 6.132 1.00 0.00 N ATOM 1133 CA HIS A 107 1.068 4.566 5.007 1.00 0.00 C ATOM 1134 C HIS A 107 1.782 4.396 3.654 1.00 0.00 C ATOM 1135 O HIS A 107 2.877 4.925 3.453 1.00 0.00 O ATOM 1136 CB HIS A 107 0.465 5.978 5.128 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.817 6.076 5.917 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.612 7.223 5.993 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -1.420 5.081 6.631 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.672 6.886 6.748 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -2.584 5.603 7.144 1.00 0.00 N ATOM 0 H HIS A 107 2.654 5.065 6.265 1.00 0.00 H new ATOM 0 HA HIS A 107 0.266 3.829 5.046 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.205 6.631 5.590 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.283 6.363 4.125 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -1.052 4.075 6.767 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -3.483 7.553 7.002 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -3.261 5.106 7.722 1.00 0.00 H new ATOM 1149 N MET A 108 1.132 3.705 2.718 1.00 0.00 N ATOM 1150 CA MET A 108 1.596 3.452 1.348 1.00 0.00 C ATOM 1151 C MET A 108 0.570 4.055 0.384 1.00 0.00 C ATOM 1152 O MET A 108 -0.601 3.687 0.444 1.00 0.00 O ATOM 1153 CB MET A 108 1.734 1.939 1.124 1.00 0.00 C ATOM 1154 CG MET A 108 2.959 1.317 1.810 1.00 0.00 C ATOM 1155 SD MET A 108 2.921 1.225 3.619 1.00 0.00 S ATOM 1156 CE MET A 108 4.370 0.177 3.900 1.00 0.00 C ATOM 0 H MET A 108 0.221 3.284 2.901 1.00 0.00 H new ATOM 0 HA MET A 108 2.571 3.908 1.176 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.835 1.444 1.490 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.792 1.744 0.053 1.00 0.00 H new ATOM 0 HG2 MET A 108 3.090 0.307 1.421 1.00 0.00 H new ATOM 0 HG3 MET A 108 3.840 1.889 1.517 1.00 0.00 H new ATOM 0 HE1 MET A 108 4.289 -0.302 4.876 1.00 0.00 H new ATOM 0 HE2 MET A 108 4.423 -0.586 3.124 1.00 0.00 H new ATOM 0 HE3 MET A 108 5.272 0.788 3.870 1.00 0.00 H new ATOM 1166 N SER A 109 0.972 4.985 -0.484 1.00 0.00 N ATOM 1167 CA SER A 109 0.023 5.819 -1.243 1.00 0.00 C ATOM 1168 C SER A 109 0.304 5.973 -2.750 1.00 0.00 C ATOM 1169 O SER A 109 1.443 6.221 -3.157 1.00 0.00 O ATOM 1170 CB SER A 109 -0.009 7.211 -0.596 1.00 0.00 C ATOM 1171 OG SER A 109 -1.006 8.042 -1.169 1.00 0.00 O ATOM 0 H SER A 109 1.952 5.184 -0.683 1.00 0.00 H new ATOM 0 HA SER A 109 -0.932 5.296 -1.193 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.193 7.109 0.474 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.966 7.685 -0.708 1.00 0.00 H new ATOM 0 HG SER A 109 -1.825 7.987 -0.634 1.00 0.00 H new ATOM 1177 N VAL A 110 -0.763 5.882 -3.562 1.00 0.00 N ATOM 1178 CA VAL A 110 -0.817 6.225 -4.993 1.00 0.00 C ATOM 1179 C VAL A 110 -1.371 7.650 -5.100 1.00 0.00 C ATOM 1180 O VAL A 110 -2.531 7.889 -4.760 1.00 0.00 O ATOM 1181 CB VAL A 110 -1.751 5.296 -5.823 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -1.709 5.665 -7.318 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -1.438 3.798 -5.698 1.00 0.00 C ATOM 0 H VAL A 110 -1.663 5.548 -3.217 1.00 0.00 H new ATOM 0 HA VAL A 110 0.190 6.116 -5.395 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.741 5.462 -5.399 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.370 5.001 -7.875 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.037 6.696 -7.448 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.690 5.559 -7.690 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.138 3.228 -6.309 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.420 3.609 -6.040 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.533 3.492 -4.656 1.00 0.00 H new ATOM 1193 N VAL A 111 -0.568 8.582 -5.608 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.019 9.934 -5.979 1.00 0.00 C ATOM 1195 C VAL A 111 -1.774 9.861 -7.312 1.00 0.00 C ATOM 1196 O VAL A 111 -1.247 9.328 -8.290 1.00 0.00 O ATOM 1197 CB VAL A 111 0.152 10.939 -6.077 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.316 12.345 -6.492 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.898 11.053 -4.738 1.00 0.00 C ATOM 0 H VAL A 111 0.425 8.425 -5.778 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.679 10.299 -5.192 1.00 0.00 H new ATOM 0 HB VAL A 111 0.818 10.548 -6.846 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.543 13.013 -6.546 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.799 12.294 -7.468 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.025 12.725 -5.756 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.716 11.766 -4.837 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.209 11.395 -3.966 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.299 10.078 -4.460 1.00 0.00 H new ATOM 1209 N ARG A 112 -2.999 10.406 -7.340 1.00 0.00 N ATOM 1210 CA ARG A 112 -3.871 10.508 -8.519 1.00 0.00 C ATOM 1211 C ARG A 112 -4.098 9.134 -9.175 1.00 0.00 C ATOM 1212 O ARG A 112 -3.546 8.831 -10.238 1.00 0.00 O ATOM 1213 CB ARG A 112 -3.309 11.578 -9.480 1.00 0.00 C ATOM 1214 CG ARG A 112 -4.311 11.961 -10.578 1.00 0.00 C ATOM 1215 CD ARG A 112 -3.775 13.097 -11.456 1.00 0.00 C ATOM 1216 NE ARG A 112 -4.722 13.441 -12.535 1.00 0.00 N ATOM 1217 CZ ARG A 112 -5.841 14.152 -12.425 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -6.259 14.641 -11.274 1.00 0.00 N ATOM 1219 NH2 ARG A 112 -6.570 14.385 -13.496 1.00 0.00 N1+ ATOM 0 H ARG A 112 -3.428 10.805 -6.505 1.00 0.00 H new ATOM 0 HA ARG A 112 -4.865 10.838 -8.217 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -3.039 12.468 -8.911 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -2.394 11.205 -9.940 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -4.524 11.090 -11.198 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -5.253 12.266 -10.122 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -3.588 13.977 -10.840 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -2.819 12.803 -11.890 1.00 0.00 H new ATOM 0 HE ARG A 112 -4.493 13.096 -13.467 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -5.718 14.479 -10.425 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -7.123 15.181 -11.233 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -6.276 14.021 -14.402 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -7.429 14.929 -13.420 1.00 0.00 H new ATOM 1233 N ALA A 113 -4.869 8.268 -8.516 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.138 6.906 -8.980 1.00 0.00 C ATOM 1235 C ALA A 113 -6.034 6.917 -10.231 1.00 0.00 C ATOM 1236 O ALA A 113 -7.079 7.570 -10.249 1.00 0.00 O ATOM 1237 CB ALA A 113 -5.759 6.100 -7.833 1.00 0.00 C ATOM 0 H ALA A 113 -5.330 8.495 -7.635 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.204 6.427 -9.273 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -5.962 5.084 -8.171 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.066 6.071 -6.992 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.690 6.571 -7.520 1.00 0.00 H new ATOM 1243 N ARG A 114 -5.611 6.198 -11.273 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.303 6.053 -12.560 1.00 0.00 C ATOM 1245 C ARG A 114 -6.985 4.682 -12.645 1.00 0.00 C ATOM 1246 O ARG A 114 -6.598 3.761 -11.926 1.00 0.00 O ATOM 1247 CB ARG A 114 -5.298 6.230 -13.716 1.00 0.00 C ATOM 1248 CG ARG A 114 -4.437 7.509 -13.665 1.00 0.00 C ATOM 1249 CD ARG A 114 -5.203 8.821 -13.423 1.00 0.00 C ATOM 1250 NE ARG A 114 -6.360 8.976 -14.317 1.00 0.00 N ATOM 1251 CZ ARG A 114 -6.379 9.319 -15.596 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -5.285 9.639 -16.259 1.00 0.00 N1+ ATOM 1253 NH2 ARG A 114 -7.529 9.335 -16.229 1.00 0.00 N ATOM 0 H ARG A 114 -4.735 5.676 -11.243 1.00 0.00 H new ATOM 0 HA ARG A 114 -7.070 6.823 -12.641 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -4.633 5.367 -13.730 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.849 6.223 -14.656 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -3.694 7.393 -12.876 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -3.893 7.596 -14.605 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -5.542 8.853 -12.388 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -4.526 9.663 -13.563 1.00 0.00 H new ATOM 0 HE ARG A 114 -7.271 8.795 -13.895 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -4.381 9.628 -15.787 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -5.343 9.898 -17.244 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -8.386 9.086 -15.736 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -7.565 9.596 -17.214 1.00 0.00 H new ATOM 1267 N ARG A 115 -7.953 4.490 -13.552 1.00 0.00 N ATOM 1268 CA ARG A 115 -8.677 3.206 -13.707 1.00 0.00 C ATOM 1269 C ARG A 115 -7.741 1.989 -13.862 1.00 0.00 C ATOM 1270 O ARG A 115 -8.037 0.926 -13.314 1.00 0.00 O ATOM 1271 CB ARG A 115 -9.678 3.288 -14.881 1.00 0.00 C ATOM 1272 CG ARG A 115 -10.865 4.239 -14.633 1.00 0.00 C ATOM 1273 CD ARG A 115 -11.774 3.910 -13.433 1.00 0.00 C ATOM 1274 NE ARG A 115 -12.769 2.854 -13.697 1.00 0.00 N ATOM 1275 CZ ARG A 115 -12.667 1.533 -13.615 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -11.541 0.891 -13.386 1.00 0.00 N1+ ATOM 1277 NH2 ARG A 115 -13.769 0.837 -13.758 1.00 0.00 N ATOM 0 H ARG A 115 -8.261 5.214 -14.201 1.00 0.00 H new ATOM 0 HA ARG A 115 -9.226 3.046 -12.779 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.146 3.614 -15.775 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -10.064 2.289 -15.086 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -10.472 5.246 -14.496 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -11.481 4.257 -15.532 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -11.150 3.604 -12.593 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -12.296 4.817 -13.128 1.00 0.00 H new ATOM 0 HE ARG A 115 -13.685 3.194 -13.990 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -10.674 1.412 -13.259 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -11.536 -0.128 -13.336 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -14.655 1.314 -13.924 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -13.740 -0.181 -13.703 1.00 0.00 H new ATOM 1291 N ASN A 116 -6.590 2.170 -14.517 1.00 0.00 N ATOM 1292 CA ASN A 116 -5.548 1.151 -14.705 1.00 0.00 C ATOM 1293 C ASN A 116 -4.821 0.709 -13.407 1.00 0.00 C ATOM 1294 O ASN A 116 -4.234 -0.374 -13.387 1.00 0.00 O ATOM 1295 CB ASN A 116 -4.550 1.708 -15.737 1.00 0.00 C ATOM 1296 CG ASN A 116 -3.492 0.689 -16.159 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -2.324 0.792 -15.799 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -3.863 -0.317 -16.932 1.00 0.00 N ATOM 0 H ASN A 116 -6.348 3.062 -14.947 1.00 0.00 H new ATOM 0 HA ASN A 116 -6.031 0.238 -15.054 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -5.097 2.041 -16.619 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.055 2.584 -15.319 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -3.177 -1.010 -17.231 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -4.835 -0.400 -17.230 1.00 0.00 H new ATOM 1305 N ASP A 117 -4.863 1.493 -12.318 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.239 1.133 -11.033 1.00 0.00 C ATOM 1307 C ASP A 117 -5.039 0.076 -10.246 1.00 0.00 C ATOM 1308 O ASP A 117 -4.514 -0.501 -9.299 1.00 0.00 O ATOM 1309 CB ASP A 117 -4.036 2.385 -10.157 1.00 0.00 C ATOM 1310 CG ASP A 117 -2.999 3.371 -10.711 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -1.814 3.002 -10.877 1.00 0.00 O1- ATOM 1312 OD2 ASP A 117 -3.354 4.552 -10.923 1.00 0.00 O ATOM 0 H ASP A 117 -5.333 2.398 -12.303 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.273 0.691 -11.279 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.991 2.900 -10.049 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.728 2.072 -9.159 1.00 0.00 H new ATOM 1317 N SER A 118 -6.294 -0.209 -10.607 1.00 0.00 N ATOM 1318 CA SER A 118 -7.111 -1.207 -9.898 1.00 0.00 C ATOM 1319 C SER A 118 -6.508 -2.624 -9.990 1.00 0.00 C ATOM 1320 O SER A 118 -6.186 -3.104 -11.084 1.00 0.00 O ATOM 1321 CB SER A 118 -8.556 -1.219 -10.421 1.00 0.00 C ATOM 1322 OG SER A 118 -9.133 0.083 -10.439 1.00 0.00 O ATOM 0 H SER A 118 -6.771 0.238 -11.390 1.00 0.00 H new ATOM 0 HA SER A 118 -7.118 -0.912 -8.849 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.573 -1.636 -11.428 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.162 -1.874 -9.795 1.00 0.00 H new ATOM 0 HG SER A 118 -8.929 0.520 -11.292 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.354 -3.309 -8.847 1.00 0.00 N ATOM 1329 CA GLY A 119 -5.674 -4.608 -8.750 1.00 0.00 C ATOM 1330 C GLY A 119 -5.236 -4.955 -7.327 1.00 0.00 C ATOM 1331 O GLY A 119 -5.691 -4.325 -6.369 1.00 0.00 O ATOM 0 H GLY A 119 -6.704 -2.970 -7.951 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.341 -5.388 -9.118 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.800 -4.602 -9.401 1.00 0.00 H new ATOM 1335 N THR A 120 -4.376 -5.969 -7.184 1.00 0.00 N ATOM 1336 CA THR A 120 -3.890 -6.481 -5.888 1.00 0.00 C ATOM 1337 C THR A 120 -2.534 -5.873 -5.538 1.00 0.00 C ATOM 1338 O THR A 120 -1.687 -5.661 -6.407 1.00 0.00 O ATOM 1339 CB THR A 120 -3.789 -8.010 -5.891 1.00 0.00 C ATOM 1340 OG1 THR A 120 -4.833 -8.587 -6.652 1.00 0.00 O ATOM 1341 CG2 THR A 120 -3.855 -8.613 -4.489 1.00 0.00 C ATOM 0 H THR A 120 -3.987 -6.471 -7.982 1.00 0.00 H new ATOM 0 HA THR A 120 -4.617 -6.187 -5.131 1.00 0.00 H new ATOM 0 HB THR A 120 -2.817 -8.234 -6.329 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.746 -9.563 -6.640 1.00 0.00 H new ATOM 0 HG21 THR A 120 -3.778 -9.698 -4.556 1.00 0.00 H new ATOM 0 HG22 THR A 120 -3.031 -8.227 -3.888 1.00 0.00 H new ATOM 0 HG23 THR A 120 -4.802 -8.344 -4.022 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.325 -5.623 -4.249 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.151 -4.962 -3.671 1.00 0.00 C ATOM 1351 C TYR A 121 -0.765 -5.589 -2.315 1.00 0.00 C ATOM 1352 O TYR A 121 -1.609 -6.182 -1.636 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.457 -3.462 -3.480 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.616 -2.651 -4.757 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.840 -2.642 -5.459 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.535 -1.885 -5.238 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -2.965 -1.922 -6.662 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.671 -1.135 -6.423 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.877 -1.164 -7.145 1.00 0.00 C ATOM 1360 OH TYR A 121 -1.977 -0.453 -8.301 1.00 0.00 O ATOM 0 H TYR A 121 -3.005 -5.889 -3.537 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.311 -5.091 -4.353 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.373 -3.369 -2.896 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.656 -3.019 -2.888 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.686 -3.191 -5.071 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.400 -1.873 -4.697 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -3.892 -1.950 -7.215 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.154 -0.536 -6.778 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.920 -0.373 -8.555 1.00 0.00 H new ATOM 1370 N LEU A 122 0.490 -5.423 -1.880 1.00 0.00 N ATOM 1371 CA LEU A 122 0.980 -5.853 -0.560 1.00 0.00 C ATOM 1372 C LEU A 122 2.246 -5.097 -0.137 1.00 0.00 C ATOM 1373 O LEU A 122 2.884 -4.426 -0.945 1.00 0.00 O ATOM 1374 CB LEU A 122 1.098 -7.399 -0.482 1.00 0.00 C ATOM 1375 CG LEU A 122 2.049 -8.112 -1.470 1.00 0.00 C ATOM 1376 CD1 LEU A 122 3.529 -7.961 -1.089 1.00 0.00 C ATOM 1377 CD2 LEU A 122 1.720 -9.611 -1.501 1.00 0.00 C ATOM 0 H LEU A 122 1.211 -4.976 -2.447 1.00 0.00 H new ATOM 0 HA LEU A 122 0.236 -5.577 0.187 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.414 -7.658 0.529 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.101 -7.816 -0.621 1.00 0.00 H new ATOM 0 HG LEU A 122 1.899 -7.644 -2.443 1.00 0.00 H new ATOM 0 HD11 LEU A 122 4.148 -8.482 -1.819 1.00 0.00 H new ATOM 0 HD12 LEU A 122 3.795 -6.904 -1.076 1.00 0.00 H new ATOM 0 HD13 LEU A 122 3.696 -8.389 -0.101 1.00 0.00 H new ATOM 0 HD21 LEU A 122 2.389 -10.116 -2.197 1.00 0.00 H new ATOM 0 HD22 LEU A 122 1.848 -10.032 -0.504 1.00 0.00 H new ATOM 0 HD23 LEU A 122 0.688 -9.750 -1.824 1.00 0.00 H new ATOM 1389 N CYS A 123 2.612 -5.204 1.139 1.00 0.00 N ATOM 1390 CA CYS A 123 3.819 -4.602 1.720 1.00 0.00 C ATOM 1391 C CYS A 123 4.823 -5.683 2.168 1.00 0.00 C ATOM 1392 O CYS A 123 4.455 -6.848 2.345 1.00 0.00 O ATOM 1393 CB CYS A 123 3.389 -3.704 2.888 1.00 0.00 C ATOM 1394 SG CYS A 123 2.318 -2.305 2.438 1.00 0.00 S ATOM 0 H CYS A 123 2.063 -5.727 1.821 1.00 0.00 H new ATOM 0 HA CYS A 123 4.334 -4.001 0.971 1.00 0.00 H new ATOM 0 HB2 CYS A 123 2.868 -4.317 3.624 1.00 0.00 H new ATOM 0 HB3 CYS A 123 4.284 -3.314 3.374 1.00 0.00 H new ATOM 1399 N GLY A 124 6.094 -5.311 2.372 1.00 0.00 N ATOM 1400 CA GLY A 124 7.132 -6.225 2.872 1.00 0.00 C ATOM 1401 C GLY A 124 8.307 -5.524 3.549 1.00 0.00 C ATOM 1402 O GLY A 124 8.848 -4.564 3.005 1.00 0.00 O ATOM 0 H GLY A 124 6.433 -4.365 2.195 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.679 -6.919 3.581 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.508 -6.820 2.040 1.00 0.00 H new ATOM 1406 N ALA A 125 8.731 -6.014 4.714 1.00 0.00 N ATOM 1407 CA ALA A 125 9.826 -5.436 5.506 1.00 0.00 C ATOM 1408 C ALA A 125 11.043 -6.373 5.609 1.00 0.00 C ATOM 1409 O ALA A 125 10.889 -7.593 5.649 1.00 0.00 O ATOM 1410 CB ALA A 125 9.275 -5.087 6.892 1.00 0.00 C ATOM 0 H ALA A 125 8.317 -6.840 5.145 1.00 0.00 H new ATOM 0 HA ALA A 125 10.190 -4.539 5.005 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.069 -4.655 7.501 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.464 -4.366 6.790 1.00 0.00 H new ATOM 0 HB3 ALA A 125 8.900 -5.991 7.372 1.00 0.00 H new ATOM 1416 N ILE A 126 12.254 -5.809 5.686 1.00 0.00 N ATOM 1417 CA ILE A 126 13.532 -6.542 5.777 1.00 0.00 C ATOM 1418 C ILE A 126 14.610 -5.690 6.476 1.00 0.00 C ATOM 1419 O ILE A 126 14.617 -4.464 6.352 1.00 0.00 O ATOM 1420 CB ILE A 126 13.960 -7.023 4.361 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.078 -8.079 4.447 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.374 -5.860 3.440 1.00 0.00 C ATOM 1423 CD1 ILE A 126 15.456 -8.756 3.125 1.00 0.00 C ATOM 0 H ILE A 126 12.381 -4.797 5.687 1.00 0.00 H new ATOM 0 HA ILE A 126 13.402 -7.428 6.398 1.00 0.00 H new ATOM 0 HB ILE A 126 13.081 -7.486 3.911 1.00 0.00 H new ATOM 0 HG12 ILE A 126 15.969 -7.605 4.859 1.00 0.00 H new ATOM 0 HG13 ILE A 126 14.771 -8.850 5.154 1.00 0.00 H new ATOM 0 HG21 ILE A 126 14.663 -6.253 2.465 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.535 -5.174 3.321 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.217 -5.329 3.881 1.00 0.00 H new ATOM 0 HD11 ILE A 126 16.251 -9.480 3.301 1.00 0.00 H new ATOM 0 HD12 ILE A 126 14.585 -9.267 2.716 1.00 0.00 H new ATOM 0 HD13 ILE A 126 15.801 -8.003 2.416 1.00 0.00 H new ATOM 1435 N SER A 127 15.537 -6.310 7.207 1.00 0.00 N ATOM 1436 CA SER A 127 16.733 -5.615 7.725 1.00 0.00 C ATOM 1437 C SER A 127 17.782 -5.430 6.609 1.00 0.00 C ATOM 1438 O SER A 127 17.864 -6.250 5.694 1.00 0.00 O ATOM 1439 CB SER A 127 17.344 -6.375 8.912 1.00 0.00 C ATOM 1440 OG SER A 127 16.428 -6.463 9.995 1.00 0.00 O ATOM 0 H SER A 127 15.489 -7.297 7.459 1.00 0.00 H new ATOM 0 HA SER A 127 16.421 -4.631 8.076 1.00 0.00 H new ATOM 0 HB2 SER A 127 17.633 -7.377 8.595 1.00 0.00 H new ATOM 0 HB3 SER A 127 18.252 -5.870 9.241 1.00 0.00 H new ATOM 0 HG SER A 127 16.843 -6.953 10.735 1.00 0.00 H new ATOM 1446 N LEU A 128 18.617 -4.380 6.658 1.00 0.00 N ATOM 1447 CA LEU A 128 19.557 -4.082 5.559 1.00 0.00 C ATOM 1448 C LEU A 128 20.780 -5.025 5.457 1.00 0.00 C ATOM 1449 O LEU A 128 21.558 -4.922 4.506 1.00 0.00 O ATOM 1450 CB LEU A 128 19.903 -2.581 5.534 1.00 0.00 C ATOM 1451 CG LEU A 128 20.554 -1.943 6.778 1.00 0.00 C ATOM 1452 CD1 LEU A 128 21.890 -2.582 7.185 1.00 0.00 C ATOM 1453 CD2 LEU A 128 20.776 -0.460 6.454 1.00 0.00 C ATOM 0 H LEU A 128 18.663 -3.726 7.439 1.00 0.00 H new ATOM 0 HA LEU A 128 19.028 -4.310 4.633 1.00 0.00 H new ATOM 0 HB2 LEU A 128 20.571 -2.411 4.690 1.00 0.00 H new ATOM 0 HB3 LEU A 128 18.983 -2.035 5.327 1.00 0.00 H new ATOM 0 HG LEU A 128 19.887 -2.097 7.626 1.00 0.00 H new ATOM 0 HD11 LEU A 128 22.281 -2.076 8.068 1.00 0.00 H new ATOM 0 HD12 LEU A 128 21.735 -3.637 7.410 1.00 0.00 H new ATOM 0 HD13 LEU A 128 22.603 -2.487 6.366 1.00 0.00 H new ATOM 0 HD21 LEU A 128 21.237 0.034 7.309 1.00 0.00 H new ATOM 0 HD22 LEU A 128 21.431 -0.371 5.587 1.00 0.00 H new ATOM 0 HD23 LEU A 128 19.818 0.012 6.235 1.00 0.00 H new ATOM 1465 N ALA A 129 20.952 -5.955 6.404 1.00 0.00 N ATOM 1466 CA ALA A 129 21.988 -6.993 6.376 1.00 0.00 C ATOM 1467 C ALA A 129 21.651 -8.119 5.365 1.00 0.00 C ATOM 1468 O ALA A 129 20.473 -8.464 5.214 1.00 0.00 O ATOM 1469 CB ALA A 129 22.151 -7.540 7.802 1.00 0.00 C ATOM 0 H ALA A 129 20.359 -6.007 7.232 1.00 0.00 H new ATOM 0 HA ALA A 129 22.929 -6.561 6.036 1.00 0.00 H new ATOM 0 HB1 ALA A 129 22.917 -8.315 7.809 1.00 0.00 H new ATOM 0 HB2 ALA A 129 22.447 -6.731 8.470 1.00 0.00 H new ATOM 0 HB3 ALA A 129 21.205 -7.962 8.140 1.00 0.00 H new ATOM 1475 N PRO A 130 22.653 -8.748 4.712 1.00 0.00 N ATOM 1476 CA PRO A 130 22.431 -9.774 3.686 1.00 0.00 C ATOM 1477 C PRO A 130 21.852 -11.090 4.239 1.00 0.00 C ATOM 1478 O PRO A 130 21.308 -11.883 3.473 1.00 0.00 O ATOM 1479 CB PRO A 130 23.801 -9.991 3.033 1.00 0.00 C ATOM 1480 CG PRO A 130 24.786 -9.641 4.145 1.00 0.00 C ATOM 1481 CD PRO A 130 24.080 -8.496 4.868 1.00 0.00 C ATOM 0 HA PRO A 130 21.677 -9.439 2.974 1.00 0.00 H new ATOM 0 HB2 PRO A 130 23.926 -11.020 2.695 1.00 0.00 H new ATOM 0 HB3 PRO A 130 23.936 -9.351 2.161 1.00 0.00 H new ATOM 0 HG2 PRO A 130 24.967 -10.488 4.807 1.00 0.00 H new ATOM 0 HG3 PRO A 130 25.753 -9.334 3.748 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.359 -8.467 5.921 1.00 0.00 H new ATOM 0 HD3 PRO A 130 24.356 -7.533 4.439 1.00 0.00 H new ATOM 1489 N LYS A 131 21.931 -11.324 5.556 1.00 0.00 N ATOM 1490 CA LYS A 131 21.353 -12.497 6.231 1.00 0.00 C ATOM 1491 C LYS A 131 19.809 -12.442 6.356 1.00 0.00 C ATOM 1492 O LYS A 131 19.168 -13.463 6.625 1.00 0.00 O ATOM 1493 CB LYS A 131 22.063 -12.612 7.598 1.00 0.00 C ATOM 1494 CG LYS A 131 21.804 -13.944 8.326 1.00 0.00 C ATOM 1495 CD LYS A 131 22.592 -14.075 9.639 1.00 0.00 C ATOM 1496 CE LYS A 131 24.108 -14.170 9.407 1.00 0.00 C ATOM 1497 NZ LYS A 131 24.848 -14.372 10.680 1.00 0.00 N1+ ATOM 0 H LYS A 131 22.409 -10.690 6.197 1.00 0.00 H new ATOM 0 HA LYS A 131 21.523 -13.392 5.632 1.00 0.00 H new ATOM 0 HB2 LYS A 131 23.136 -12.493 7.450 1.00 0.00 H new ATOM 0 HB3 LYS A 131 21.736 -11.791 8.236 1.00 0.00 H new ATOM 0 HG2 LYS A 131 20.739 -14.035 8.538 1.00 0.00 H new ATOM 0 HG3 LYS A 131 22.069 -14.770 7.666 1.00 0.00 H new ATOM 0 HD2 LYS A 131 22.378 -13.216 10.275 1.00 0.00 H new ATOM 0 HD3 LYS A 131 22.253 -14.961 10.176 1.00 0.00 H new ATOM 0 HE2 LYS A 131 24.321 -14.995 8.728 1.00 0.00 H new ATOM 0 HE3 LYS A 131 24.460 -13.259 8.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 25.867 -14.431 10.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 24.665 -13.572 11.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 24.530 -15.254 11.130 1.00 0.00 H new ATOM 1511 N ALA A 132 19.201 -11.265 6.169 1.00 0.00 N ATOM 1512 CA ALA A 132 17.762 -11.022 6.331 1.00 0.00 C ATOM 1513 C ALA A 132 16.893 -11.654 5.216 1.00 0.00 C ATOM 1514 O ALA A 132 17.393 -12.076 4.169 1.00 0.00 O ATOM 1515 CB ALA A 132 17.560 -9.506 6.433 1.00 0.00 C ATOM 0 H ALA A 132 19.713 -10.428 5.892 1.00 0.00 H new ATOM 0 HA ALA A 132 17.420 -11.517 7.240 1.00 0.00 H new ATOM 0 HB1 ALA A 132 16.499 -9.288 6.555 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.110 -9.123 7.292 1.00 0.00 H new ATOM 0 HB3 ALA A 132 17.927 -9.028 5.525 1.00 0.00 H new ATOM 1521 N GLN A 133 15.575 -11.682 5.432 1.00 0.00 N ATOM 1522 CA GLN A 133 14.556 -12.169 4.497 1.00 0.00 C ATOM 1523 C GLN A 133 13.291 -11.296 4.646 1.00 0.00 C ATOM 1524 O GLN A 133 13.021 -10.775 5.730 1.00 0.00 O ATOM 1525 CB GLN A 133 14.280 -13.660 4.797 1.00 0.00 C ATOM 1526 CG GLN A 133 13.989 -14.503 3.546 1.00 0.00 C ATOM 1527 CD GLN A 133 12.708 -14.096 2.822 1.00 0.00 C ATOM 1528 OE1 GLN A 133 12.733 -13.373 1.831 1.00 0.00 O ATOM 1529 NE2 GLN A 133 11.546 -14.468 3.317 1.00 0.00 N ATOM 0 H GLN A 133 15.169 -11.349 6.307 1.00 0.00 H new ATOM 0 HA GLN A 133 14.893 -12.094 3.463 1.00 0.00 H new ATOM 0 HB2 GLN A 133 15.141 -14.082 5.315 1.00 0.00 H new ATOM 0 HB3 GLN A 133 13.432 -13.733 5.478 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.829 -14.418 2.857 1.00 0.00 H new ATOM 0 HG3 GLN A 133 13.917 -15.552 3.833 1.00 0.00 H new ATOM 0 HE21 GLN A 133 11.511 -15.069 4.140 1.00 0.00 H new ATOM 0 HE22 GLN A 133 10.681 -14.155 2.877 1.00 0.00 H new ATOM 1538 N ILE A 134 12.519 -11.107 3.570 1.00 0.00 N ATOM 1539 CA ILE A 134 11.346 -10.217 3.547 1.00 0.00 C ATOM 1540 C ILE A 134 10.156 -10.858 4.279 1.00 0.00 C ATOM 1541 O ILE A 134 9.664 -11.916 3.880 1.00 0.00 O ATOM 1542 CB ILE A 134 10.944 -9.815 2.101 1.00 0.00 C ATOM 1543 CG1 ILE A 134 12.144 -9.309 1.265 1.00 0.00 C ATOM 1544 CG2 ILE A 134 9.840 -8.735 2.157 1.00 0.00 C ATOM 1545 CD1 ILE A 134 11.813 -8.992 -0.199 1.00 0.00 C ATOM 0 H ILE A 134 12.691 -11.572 2.679 1.00 0.00 H new ATOM 0 HA ILE A 134 11.629 -9.305 4.072 1.00 0.00 H new ATOM 0 HB ILE A 134 10.571 -10.710 1.603 1.00 0.00 H new ATOM 0 HG12 ILE A 134 12.545 -8.412 1.736 1.00 0.00 H new ATOM 0 HG13 ILE A 134 12.932 -10.062 1.291 1.00 0.00 H new ATOM 0 HG21 ILE A 134 9.557 -8.452 1.143 1.00 0.00 H new ATOM 0 HG22 ILE A 134 8.970 -9.131 2.680 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.214 -7.859 2.687 1.00 0.00 H new ATOM 0 HD11 ILE A 134 12.712 -8.644 -0.708 1.00 0.00 H new ATOM 0 HD12 ILE A 134 11.442 -9.891 -0.691 1.00 0.00 H new ATOM 0 HD13 ILE A 134 11.050 -8.215 -0.239 1.00 0.00 H new ATOM 1557 N LYS A 135 9.643 -10.185 5.312 1.00 0.00 N ATOM 1558 CA LYS A 135 8.378 -10.536 5.963 1.00 0.00 C ATOM 1559 C LYS A 135 7.198 -9.961 5.154 1.00 0.00 C ATOM 1560 O LYS A 135 7.043 -8.743 5.061 1.00 0.00 O ATOM 1561 CB LYS A 135 8.403 -10.046 7.428 1.00 0.00 C ATOM 1562 CG LYS A 135 7.063 -10.162 8.182 1.00 0.00 C ATOM 1563 CD LYS A 135 6.432 -11.564 8.168 1.00 0.00 C ATOM 1564 CE LYS A 135 5.037 -11.525 8.811 1.00 0.00 C ATOM 1565 NZ LYS A 135 4.207 -12.682 8.381 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.100 -9.372 5.725 1.00 0.00 H new ATOM 0 HA LYS A 135 8.245 -11.618 5.987 1.00 0.00 H new ATOM 0 HB2 LYS A 135 9.158 -10.614 7.972 1.00 0.00 H new ATOM 0 HB3 LYS A 135 8.719 -9.003 7.440 1.00 0.00 H new ATOM 0 HG2 LYS A 135 7.218 -9.860 9.218 1.00 0.00 H new ATOM 0 HG3 LYS A 135 6.355 -9.457 7.746 1.00 0.00 H new ATOM 0 HD2 LYS A 135 6.358 -11.927 7.143 1.00 0.00 H new ATOM 0 HD3 LYS A 135 7.070 -12.263 8.708 1.00 0.00 H new ATOM 0 HE2 LYS A 135 5.135 -11.530 9.897 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.536 -10.596 8.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.318 -12.692 8.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 3.994 -12.599 7.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 4.727 -13.566 8.554 1.00 0.00 H new ATOM 1579 N GLU A 136 6.368 -10.846 4.599 1.00 0.00 N ATOM 1580 CA GLU A 136 5.117 -10.551 3.888 1.00 0.00 C ATOM 1581 C GLU A 136 3.900 -10.990 4.727 1.00 0.00 C ATOM 1582 O GLU A 136 4.010 -11.831 5.623 1.00 0.00 O ATOM 1583 CB GLU A 136 5.104 -11.273 2.529 1.00 0.00 C ATOM 1584 CG GLU A 136 6.117 -10.691 1.533 1.00 0.00 C ATOM 1585 CD GLU A 136 6.200 -11.566 0.273 1.00 0.00 C ATOM 1586 OE1 GLU A 136 5.340 -11.423 -0.628 1.00 0.00 O1- ATOM 1587 OE2 GLU A 136 7.122 -12.410 0.179 1.00 0.00 O ATOM 0 H GLU A 136 6.560 -11.847 4.634 1.00 0.00 H new ATOM 0 HA GLU A 136 5.056 -9.475 3.724 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.320 -12.330 2.683 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.104 -11.211 2.100 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.825 -9.677 1.260 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.099 -10.625 2.002 1.00 0.00 H new ATOM 1594 N SER A 137 2.727 -10.423 4.445 1.00 0.00 N ATOM 1595 CA SER A 137 1.453 -10.780 5.094 1.00 0.00 C ATOM 1596 C SER A 137 0.261 -10.715 4.113 1.00 0.00 C ATOM 1597 O SER A 137 0.446 -10.651 2.892 1.00 0.00 O ATOM 1598 CB SER A 137 1.244 -9.907 6.344 1.00 0.00 C ATOM 1599 OG SER A 137 0.282 -10.500 7.206 1.00 0.00 O ATOM 0 H SER A 137 2.627 -9.687 3.746 1.00 0.00 H new ATOM 0 HA SER A 137 1.505 -11.820 5.415 1.00 0.00 H new ATOM 0 HB2 SER A 137 2.189 -9.785 6.873 1.00 0.00 H new ATOM 0 HB3 SER A 137 0.913 -8.911 6.049 1.00 0.00 H new ATOM 0 HG SER A 137 0.162 -11.442 6.964 1.00 0.00 H new ATOM 1605 N LEU A 138 -0.967 -10.777 4.639 1.00 0.00 N ATOM 1606 CA LEU A 138 -2.219 -10.888 3.886 1.00 0.00 C ATOM 1607 C LEU A 138 -2.433 -9.686 2.948 1.00 0.00 C ATOM 1608 O LEU A 138 -2.563 -8.545 3.399 1.00 0.00 O ATOM 1609 CB LEU A 138 -3.384 -11.043 4.883 1.00 0.00 C ATOM 1610 CG LEU A 138 -3.342 -12.307 5.770 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -4.519 -12.274 6.755 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -3.401 -13.604 4.947 1.00 0.00 C ATOM 0 H LEU A 138 -1.121 -10.750 5.647 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.172 -11.768 3.244 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -3.402 -10.167 5.531 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.319 -11.045 4.323 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.392 -12.302 6.304 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -4.493 -13.165 7.383 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -4.444 -11.386 7.382 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.457 -12.248 6.200 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.368 -14.462 5.618 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -4.326 -13.628 4.372 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -2.550 -13.642 4.267 1.00 0.00 H new ATOM 1624 N ARG A 139 -2.481 -9.961 1.638 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.565 -8.970 0.558 1.00 0.00 C ATOM 1626 C ARG A 139 -3.890 -8.182 0.544 1.00 0.00 C ATOM 1627 O ARG A 139 -4.913 -8.632 1.067 1.00 0.00 O ATOM 1628 CB ARG A 139 -2.262 -9.661 -0.787 1.00 0.00 C ATOM 1629 CG ARG A 139 -3.339 -10.676 -1.209 1.00 0.00 C ATOM 1630 CD ARG A 139 -2.944 -11.511 -2.433 1.00 0.00 C ATOM 1631 NE ARG A 139 -1.879 -12.489 -2.142 1.00 0.00 N ATOM 1632 CZ ARG A 139 -1.282 -13.272 -3.034 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -1.618 -13.275 -4.307 1.00 0.00 N ATOM 1634 NH2 ARG A 139 -0.314 -14.080 -2.664 1.00 0.00 N1+ ATOM 0 H ARG A 139 -2.462 -10.919 1.288 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.809 -8.206 0.740 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -2.165 -8.902 -1.563 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -1.301 -10.170 -0.717 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -3.544 -11.345 -0.373 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -4.265 -10.143 -1.426 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -3.822 -12.038 -2.806 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -2.611 -10.845 -3.229 1.00 0.00 H new ATOM 0 HE ARG A 139 -1.574 -12.571 -1.172 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -2.361 -12.661 -4.640 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -1.135 -13.891 -4.961 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -0.018 -14.108 -1.688 1.00 0.00 H new ATOM 0 HH22 ARG A 139 0.141 -14.679 -3.352 1.00 0.00 H new ATOM 1648 N ALA A 140 -3.856 -7.005 -0.077 1.00 0.00 N ATOM 1649 CA ALA A 140 -4.934 -6.015 -0.152 1.00 0.00 C ATOM 1650 C ALA A 140 -5.310 -5.696 -1.617 1.00 0.00 C ATOM 1651 O ALA A 140 -4.568 -6.036 -2.537 1.00 0.00 O ATOM 1652 CB ALA A 140 -4.433 -4.771 0.595 1.00 0.00 C ATOM 0 H ALA A 140 -3.021 -6.695 -0.574 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.847 -6.396 0.305 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.201 -3.998 0.570 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.214 -5.032 1.630 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -3.528 -4.399 0.116 1.00 0.00 H new ATOM 1658 N GLU A 141 -6.451 -5.044 -1.850 1.00 0.00 N ATOM 1659 CA GLU A 141 -6.966 -4.714 -3.188 1.00 0.00 C ATOM 1660 C GLU A 141 -7.313 -3.225 -3.316 1.00 0.00 C ATOM 1661 O GLU A 141 -7.840 -2.618 -2.385 1.00 0.00 O ATOM 1662 CB GLU A 141 -8.219 -5.553 -3.498 1.00 0.00 C ATOM 1663 CG GLU A 141 -7.951 -7.063 -3.486 1.00 0.00 C ATOM 1664 CD GLU A 141 -9.179 -7.845 -3.976 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -9.348 -8.002 -5.208 1.00 0.00 O1- ATOM 1666 OE2 GLU A 141 -9.977 -8.322 -3.134 1.00 0.00 O ATOM 0 H GLU A 141 -7.060 -4.721 -1.098 1.00 0.00 H new ATOM 0 HA GLU A 141 -6.176 -4.944 -3.903 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -8.994 -5.322 -2.767 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.608 -5.267 -4.475 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -7.095 -7.289 -4.121 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -7.692 -7.382 -2.476 1.00 0.00 H new ATOM 1673 N LEU A 142 -7.053 -2.654 -4.495 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.434 -1.300 -4.903 1.00 0.00 C ATOM 1675 C LEU A 142 -8.466 -1.365 -6.031 1.00 0.00 C ATOM 1676 O LEU A 142 -8.280 -2.094 -7.008 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.168 -0.558 -5.384 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.388 0.889 -5.874 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -7.009 1.791 -4.799 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.042 1.479 -6.316 1.00 0.00 C ATOM 0 H LEU A 142 -6.545 -3.149 -5.228 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.877 -0.768 -4.061 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.447 -0.540 -4.567 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.718 -1.132 -6.194 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.090 0.849 -6.707 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.141 2.796 -5.199 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.978 1.389 -4.502 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.350 1.829 -3.931 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.190 2.501 -6.664 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.350 1.478 -5.474 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.629 0.877 -7.125 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.504 -0.534 -5.927 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.492 -0.266 -6.969 1.00 0.00 C ATOM 1694 C ARG A 143 -10.590 1.245 -7.206 1.00 0.00 C ATOM 1695 O ARG A 143 -10.887 2.011 -6.287 1.00 0.00 O ATOM 1696 CB ARG A 143 -11.845 -0.854 -6.532 1.00 0.00 C ATOM 1697 CG ARG A 143 -12.942 -0.677 -7.592 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.277 -1.245 -7.100 1.00 0.00 C ATOM 1699 NE ARG A 143 -15.332 -1.070 -8.114 1.00 0.00 N ATOM 1700 CZ ARG A 143 -16.644 -1.121 -7.910 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -17.161 -1.361 -6.723 1.00 0.00 N1+ ATOM 1702 NH2 ARG A 143 -17.468 -0.929 -8.918 1.00 0.00 N ATOM 0 H ARG A 143 -9.686 -0.006 -5.074 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.195 -0.734 -7.907 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.722 -1.915 -6.317 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.161 -0.376 -5.605 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.058 0.381 -7.828 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -12.647 -1.179 -8.514 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.162 -2.304 -6.869 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.570 -0.747 -6.176 1.00 0.00 H new ATOM 0 HE ARG A 143 -15.024 -0.892 -9.070 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.549 -1.515 -5.922 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.174 -1.393 -6.605 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.099 -0.742 -9.850 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -18.476 -0.967 -8.767 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.370 1.671 -8.442 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.637 3.037 -8.907 1.00 0.00 C ATOM 1718 C VAL A 144 -11.934 2.992 -9.718 1.00 0.00 C ATOM 1719 O VAL A 144 -12.034 2.208 -10.659 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.472 3.598 -9.748 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -9.745 5.056 -10.148 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.141 3.512 -8.982 1.00 0.00 C ATOM 0 H VAL A 144 -9.992 1.067 -9.171 1.00 0.00 H new ATOM 0 HA VAL A 144 -10.738 3.708 -8.054 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.394 2.989 -10.649 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -8.911 5.433 -10.741 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.661 5.106 -10.737 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -9.857 5.665 -9.251 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.339 3.915 -9.600 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.214 4.089 -8.060 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -7.926 2.471 -8.742 1.00 0.00 H new ATOM 1732 N THR A 145 -12.924 3.806 -9.346 1.00 0.00 N ATOM 1733 CA THR A 145 -14.219 3.944 -10.037 1.00 0.00 C ATOM 1734 C THR A 145 -14.243 5.202 -10.904 1.00 0.00 C ATOM 1735 O THR A 145 -13.495 6.148 -10.658 1.00 0.00 O ATOM 1736 CB THR A 145 -15.371 3.957 -9.019 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.185 5.002 -8.090 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.456 2.633 -8.254 1.00 0.00 C ATOM 0 H THR A 145 -12.849 4.410 -8.528 1.00 0.00 H new ATOM 0 HA THR A 145 -14.351 3.084 -10.693 1.00 0.00 H new ATOM 0 HB THR A 145 -16.297 4.105 -9.575 1.00 0.00 H new ATOM 0 HG1 THR A 145 -15.924 5.003 -7.447 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.281 2.676 -7.543 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.625 1.817 -8.957 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.523 2.462 -7.717 1.00 0.00 H new ATOM 1746 N GLU A 146 -15.082 5.217 -11.942 1.00 0.00 N ATOM 1747 CA GLU A 146 -15.237 6.364 -12.846 1.00 0.00 C ATOM 1748 C GLU A 146 -15.671 7.648 -12.114 1.00 0.00 C ATOM 1749 O GLU A 146 -16.382 7.612 -11.104 1.00 0.00 O ATOM 1750 CB GLU A 146 -16.235 6.070 -13.982 1.00 0.00 C ATOM 1751 CG GLU A 146 -15.801 4.968 -14.955 1.00 0.00 C ATOM 1752 CD GLU A 146 -16.271 3.579 -14.505 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -15.590 2.976 -13.646 1.00 0.00 O1- ATOM 1754 OE2 GLU A 146 -17.307 3.085 -15.009 1.00 0.00 O ATOM 0 H GLU A 146 -15.680 4.426 -12.183 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.247 6.530 -13.270 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -17.192 5.789 -13.542 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -16.401 6.988 -14.546 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -16.202 5.182 -15.946 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -14.715 4.971 -15.043 1.00 0.00 H new ATOM 1761 N ARG A 147 -15.269 8.800 -12.663 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.568 10.126 -12.114 1.00 0.00 C ATOM 1763 C ARG A 147 -17.030 10.474 -12.415 1.00 0.00 C ATOM 1764 O ARG A 147 -17.481 10.353 -13.559 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.592 11.177 -12.687 1.00 0.00 C ATOM 1766 CG ARG A 147 -14.083 12.200 -11.653 1.00 0.00 C ATOM 1767 CD ARG A 147 -15.132 13.089 -10.969 1.00 0.00 C ATOM 1768 NE ARG A 147 -16.018 13.780 -11.924 1.00 0.00 N ATOM 1769 CZ ARG A 147 -15.756 14.858 -12.651 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -14.592 15.473 -12.623 1.00 0.00 N1+ ATOM 1771 NH2 ARG A 147 -16.705 15.326 -13.430 1.00 0.00 N ATOM 0 H ARG A 147 -14.715 8.836 -13.519 1.00 0.00 H new ATOM 0 HA ARG A 147 -15.433 10.123 -11.032 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.736 10.661 -13.122 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -15.087 11.712 -13.497 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -13.544 11.656 -10.877 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -13.361 12.849 -12.148 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -15.737 12.477 -10.299 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -14.624 13.830 -10.352 1.00 0.00 H new ATOM 0 HE ARG A 147 -16.949 13.379 -12.040 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -13.845 15.123 -12.024 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -14.438 16.299 -13.201 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -17.613 14.862 -13.463 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -16.534 16.154 -14.001 1.00 0.00 H new