USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=20 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 45 THR OG1 : rot -40:sc= 0.108 USER MOD Set 1.2: A 145 THR OG1 : rot -69:sc= 0.428 USER MOD Set 2.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc=-0.00211 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.753 K(o=-0.75,f=-0.068) 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 66 ASN : amide:sc= -0.444 X(o=-0.44,f=-0.032) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 174:sc= 0 (180deg=-0.0197) 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 74 ASN : amide:sc=-0.00911 K(o=-0.0091,f=-0.96) USER MOD Single : A 75 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0.0429 X(o=0.043,f=0) USER MOD Single : A 102 ASN : amide:sc= 0.975 K(o=0.98,f=0) USER MOD Single : A 107 HIS : no HD1:sc= -0.212 X(o=-0.21,f=-0.31) USER MOD Single : A 108 MET CE :methyl -171:sc= -1.04 (180deg=-1.34) USER MOD Single : A 116 ASN : amide:sc= 0.0465 K(o=0.046,f=-4.2!) USER MOD Single : A 118 SER OG : rot -149:sc= 0.805 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot 17:sc= 0.611 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 X(o=0,f=-0.43) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 160:sc= 0.167 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 1.086 -5.685 9.242 1.00 0.00 N ATOM 49 CA THR A 36 -0.239 -5.599 8.609 1.00 0.00 C ATOM 50 C THR A 36 -0.324 -4.453 7.599 1.00 0.00 C ATOM 51 O THR A 36 0.526 -3.557 7.574 1.00 0.00 O ATOM 52 CB THR A 36 -1.356 -5.581 9.663 1.00 0.00 C ATOM 53 OG1 THR A 36 -2.588 -5.846 9.025 1.00 0.00 O ATOM 54 CG2 THR A 36 -1.458 -4.259 10.425 1.00 0.00 C ATOM 0 HA THR A 36 -0.391 -6.504 8.021 1.00 0.00 H new ATOM 0 HB THR A 36 -1.112 -6.347 10.399 1.00 0.00 H new ATOM 0 HG1 THR A 36 -3.309 -5.839 9.689 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.268 -4.320 11.152 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.519 -4.064 10.943 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.660 -3.449 9.724 1.00 0.00 H new ATOM 62 N PHE A 37 -1.347 -4.523 6.746 1.00 0.00 N ATOM 63 CA PHE A 37 -1.621 -3.625 5.625 1.00 0.00 C ATOM 64 C PHE A 37 -3.142 -3.515 5.424 1.00 0.00 C ATOM 65 O PHE A 37 -3.812 -4.513 5.152 1.00 0.00 O ATOM 66 CB PHE A 37 -0.913 -4.165 4.373 1.00 0.00 C ATOM 67 CG PHE A 37 -1.004 -3.284 3.141 1.00 0.00 C ATOM 68 CD1 PHE A 37 -0.505 -1.970 3.185 1.00 0.00 C ATOM 69 CD2 PHE A 37 -1.538 -3.781 1.935 1.00 0.00 C ATOM 70 CE1 PHE A 37 -0.513 -1.167 2.034 1.00 0.00 C ATOM 71 CE2 PHE A 37 -1.555 -2.972 0.783 1.00 0.00 C ATOM 72 CZ PHE A 37 -1.039 -1.666 0.831 1.00 0.00 C ATOM 0 H PHE A 37 -2.051 -5.256 6.826 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.240 -2.624 5.825 1.00 0.00 H new ATOM 0 HB2 PHE A 37 0.139 -4.320 4.610 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.333 -5.142 4.132 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -0.113 -1.576 4.111 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.935 -4.785 1.895 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -0.114 -0.164 2.073 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -1.965 -3.356 -0.139 1.00 0.00 H new ATOM 0 HZ PHE A 37 -1.047 -1.048 -0.054 1.00 0.00 H new ATOM 82 N SER A 38 -3.699 -2.315 5.601 1.00 0.00 N ATOM 83 CA SER A 38 -5.153 -2.066 5.663 1.00 0.00 C ATOM 84 C SER A 38 -5.579 -0.763 4.944 1.00 0.00 C ATOM 85 O SER A 38 -4.739 0.126 4.753 1.00 0.00 O ATOM 86 CB SER A 38 -5.597 -2.000 7.138 1.00 0.00 C ATOM 87 OG SER A 38 -5.457 -3.250 7.801 1.00 0.00 O ATOM 0 H SER A 38 -3.145 -1.466 5.708 1.00 0.00 H new ATOM 0 HA SER A 38 -5.639 -2.892 5.144 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.006 -1.247 7.659 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.638 -1.680 7.188 1.00 0.00 H new ATOM 0 HG SER A 38 -5.748 -3.161 8.732 1.00 0.00 H new ATOM 93 N PRO A 39 -6.869 -0.597 4.574 1.00 0.00 N ATOM 94 CA PRO A 39 -7.956 -1.576 4.678 1.00 0.00 C ATOM 95 C PRO A 39 -7.786 -2.705 3.661 1.00 0.00 C ATOM 96 O PRO A 39 -7.158 -2.519 2.623 1.00 0.00 O ATOM 97 CB PRO A 39 -9.242 -0.789 4.403 1.00 0.00 C ATOM 98 CG PRO A 39 -8.776 0.313 3.453 1.00 0.00 C ATOM 99 CD PRO A 39 -7.369 0.628 3.959 1.00 0.00 C ATOM 0 HA PRO A 39 -7.970 -2.050 5.659 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.009 -1.416 3.948 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.667 -0.379 5.319 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.766 -0.025 2.417 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.426 1.187 3.498 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.723 0.943 3.140 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.389 1.445 4.681 1.00 0.00 H new ATOM 107 N ALA A 40 -8.380 -3.871 3.943 1.00 0.00 N ATOM 108 CA ALA A 40 -8.376 -5.019 3.022 1.00 0.00 C ATOM 109 C ALA A 40 -9.088 -4.741 1.681 1.00 0.00 C ATOM 110 O ALA A 40 -8.819 -5.426 0.692 1.00 0.00 O ATOM 111 CB ALA A 40 -9.002 -6.225 3.733 1.00 0.00 C ATOM 0 H ALA A 40 -8.878 -4.047 4.816 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.338 -5.226 2.760 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.005 -7.083 3.060 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.421 -6.464 4.624 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.026 -5.986 4.021 1.00 0.00 H new ATOM 117 N LEU A 41 -9.955 -3.724 1.632 1.00 0.00 N ATOM 118 CA LEU A 41 -10.560 -3.177 0.417 1.00 0.00 C ATOM 119 C LEU A 41 -10.657 -1.654 0.554 1.00 0.00 C ATOM 120 O LEU A 41 -11.337 -1.148 1.450 1.00 0.00 O ATOM 121 CB LEU A 41 -11.936 -3.836 0.176 1.00 0.00 C ATOM 122 CG LEU A 41 -12.797 -3.177 -0.926 1.00 0.00 C ATOM 123 CD1 LEU A 41 -12.128 -3.182 -2.308 1.00 0.00 C ATOM 124 CD2 LEU A 41 -14.151 -3.892 -1.020 1.00 0.00 C ATOM 0 H LEU A 41 -10.266 -3.241 2.475 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.943 -3.398 -0.454 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.779 -4.883 -0.085 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.497 -3.821 1.111 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.925 -2.134 -0.637 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.787 -2.704 -3.033 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -11.186 -2.635 -2.258 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.935 -4.210 -2.615 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.756 -3.425 -1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.992 -4.942 -1.265 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.669 -3.817 -0.064 1.00 0.00 H new ATOM 136 N LEU A 42 -10.007 -0.934 -0.360 1.00 0.00 N ATOM 137 CA LEU A 42 -10.135 0.509 -0.540 1.00 0.00 C ATOM 138 C LEU A 42 -10.873 0.784 -1.856 1.00 0.00 C ATOM 139 O LEU A 42 -10.404 0.372 -2.917 1.00 0.00 O ATOM 140 CB LEU A 42 -8.721 1.118 -0.541 1.00 0.00 C ATOM 141 CG LEU A 42 -8.682 2.648 -0.709 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.395 3.389 0.433 1.00 0.00 C ATOM 143 CD2 LEU A 42 -7.224 3.108 -0.777 1.00 0.00 C ATOM 0 H LEU A 42 -9.353 -1.357 -1.019 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.711 0.963 0.267 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.226 0.856 0.394 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.144 0.662 -1.346 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.211 2.889 -1.631 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.336 4.464 0.262 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.441 3.084 0.468 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.915 3.145 1.381 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -7.189 4.191 -0.896 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.711 2.827 0.143 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.732 2.634 -1.626 1.00 0.00 H new ATOM 155 N VAL A 43 -11.997 1.501 -1.793 1.00 0.00 N ATOM 156 CA VAL A 43 -12.734 1.979 -2.978 1.00 0.00 C ATOM 157 C VAL A 43 -12.503 3.482 -3.118 1.00 0.00 C ATOM 158 O VAL A 43 -12.782 4.243 -2.191 1.00 0.00 O ATOM 159 CB VAL A 43 -14.251 1.666 -2.950 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.909 2.004 -4.297 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.522 0.183 -2.631 1.00 0.00 C ATOM 0 H VAL A 43 -12.431 1.772 -0.911 1.00 0.00 H new ATOM 0 HA VAL A 43 -12.346 1.437 -3.841 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.681 2.285 -2.162 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.974 1.775 -4.250 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.775 3.064 -4.511 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.445 1.413 -5.087 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.597 0.004 -2.620 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -14.057 -0.444 -3.392 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -14.104 -0.061 -1.655 1.00 0.00 H new ATOM 171 N VAL A 44 -12.001 3.897 -4.280 1.00 0.00 N ATOM 172 CA VAL A 44 -11.868 5.313 -4.685 1.00 0.00 C ATOM 173 C VAL A 44 -12.499 5.555 -6.064 1.00 0.00 C ATOM 174 O VAL A 44 -12.929 4.605 -6.712 1.00 0.00 O ATOM 175 CB VAL A 44 -10.395 5.785 -4.689 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.767 5.708 -3.290 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.542 5.013 -5.706 1.00 0.00 C ATOM 0 H VAL A 44 -11.664 3.248 -4.991 1.00 0.00 H new ATOM 0 HA VAL A 44 -12.404 5.901 -3.940 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.410 6.831 -4.995 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.732 6.048 -3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -10.327 6.343 -2.604 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.795 4.678 -2.935 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.516 5.379 -5.673 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.556 3.951 -5.461 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.947 5.160 -6.707 1.00 0.00 H new ATOM 187 N THR A 45 -12.519 6.813 -6.522 1.00 0.00 N ATOM 188 CA THR A 45 -12.984 7.233 -7.855 1.00 0.00 C ATOM 189 C THR A 45 -11.804 7.699 -8.713 1.00 0.00 C ATOM 190 O THR A 45 -10.804 8.187 -8.186 1.00 0.00 O ATOM 191 CB THR A 45 -14.048 8.324 -7.685 1.00 0.00 C ATOM 192 OG1 THR A 45 -15.155 7.749 -7.027 1.00 0.00 O ATOM 193 CG2 THR A 45 -14.580 8.900 -8.993 1.00 0.00 C ATOM 0 H THR A 45 -12.200 7.598 -5.954 1.00 0.00 H new ATOM 0 HA THR A 45 -13.436 6.391 -8.380 1.00 0.00 H new ATOM 0 HB THR A 45 -13.567 9.134 -7.137 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.312 6.847 -7.377 1.00 0.00 H new ATOM 0 HG21 THR A 45 -15.327 9.664 -8.777 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.759 9.344 -9.556 1.00 0.00 H new ATOM 0 HG23 THR A 45 -15.035 8.104 -9.583 1.00 0.00 H new ATOM 201 N GLU A 46 -11.907 7.559 -10.037 1.00 0.00 N ATOM 202 CA GLU A 46 -10.899 7.974 -10.998 1.00 0.00 C ATOM 203 C GLU A 46 -10.513 9.454 -10.833 1.00 0.00 C ATOM 204 O GLU A 46 -11.359 10.354 -10.865 1.00 0.00 O ATOM 205 CB GLU A 46 -11.412 7.698 -12.415 1.00 0.00 C ATOM 206 CG GLU A 46 -11.222 6.242 -12.854 1.00 0.00 C ATOM 207 CD GLU A 46 -11.278 6.080 -14.377 1.00 0.00 C ATOM 208 OE1 GLU A 46 -12.297 6.465 -14.997 1.00 0.00 O ATOM 209 OE2 GLU A 46 -10.299 5.540 -14.944 1.00 0.00 O1- ATOM 0 H GLU A 46 -12.725 7.138 -10.478 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.993 7.396 -10.816 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -12.471 7.951 -12.466 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.894 8.352 -13.116 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.263 5.877 -12.487 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -11.994 5.624 -12.397 1.00 0.00 H new ATOM 216 N GLY A 47 -9.209 9.685 -10.664 1.00 0.00 N ATOM 217 CA GLY A 47 -8.567 10.969 -10.374 1.00 0.00 C ATOM 218 C GLY A 47 -8.266 11.202 -8.892 1.00 0.00 C ATOM 219 O GLY A 47 -7.558 12.159 -8.583 1.00 0.00 O ATOM 0 H GLY A 47 -8.528 8.929 -10.731 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.635 11.031 -10.936 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.210 11.773 -10.733 1.00 0.00 H new ATOM 223 N ASP A 48 -8.749 10.360 -7.973 1.00 0.00 N ATOM 224 CA ASP A 48 -8.507 10.520 -6.532 1.00 0.00 C ATOM 225 C ASP A 48 -7.130 9.974 -6.099 1.00 0.00 C ATOM 226 O ASP A 48 -6.508 9.168 -6.792 1.00 0.00 O ATOM 227 CB ASP A 48 -9.658 9.868 -5.746 1.00 0.00 C ATOM 228 CG ASP A 48 -9.696 10.231 -4.251 1.00 0.00 C ATOM 229 OD1 ASP A 48 -9.220 11.329 -3.874 1.00 0.00 O1- ATOM 230 OD2 ASP A 48 -10.232 9.421 -3.461 1.00 0.00 O ATOM 0 H ASP A 48 -9.319 9.547 -8.205 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.482 11.586 -6.305 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.604 10.160 -6.202 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.579 8.785 -5.842 1.00 0.00 H new ATOM 235 N ASN A 49 -6.649 10.417 -4.934 1.00 0.00 N ATOM 236 CA ASN A 49 -5.441 9.899 -4.284 1.00 0.00 C ATOM 237 C ASN A 49 -5.830 8.764 -3.316 1.00 0.00 C ATOM 238 O ASN A 49 -6.483 9.003 -2.297 1.00 0.00 O ATOM 239 CB ASN A 49 -4.712 11.035 -3.543 1.00 0.00 C ATOM 240 CG ASN A 49 -3.948 12.005 -4.448 1.00 0.00 C ATOM 241 OD1 ASN A 49 -2.842 12.422 -4.131 1.00 0.00 O ATOM 242 ND2 ASN A 49 -4.493 12.406 -5.585 1.00 0.00 N ATOM 0 H ASN A 49 -7.099 11.163 -4.404 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.761 9.499 -5.036 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -5.443 11.600 -2.964 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -4.012 10.596 -2.832 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -3.992 13.057 -6.189 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -5.414 12.064 -5.858 1.00 0.00 H new ATOM 249 N ALA A 50 -5.447 7.525 -3.638 1.00 0.00 N ATOM 250 CA ALA A 50 -5.810 6.327 -2.873 1.00 0.00 C ATOM 251 C ALA A 50 -4.695 5.937 -1.893 1.00 0.00 C ATOM 252 O ALA A 50 -3.591 5.625 -2.348 1.00 0.00 O ATOM 253 CB ALA A 50 -6.093 5.196 -3.871 1.00 0.00 C ATOM 0 H ALA A 50 -4.866 7.322 -4.451 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.698 6.523 -2.273 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.366 4.291 -3.328 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.913 5.487 -4.527 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.201 5.006 -4.468 1.00 0.00 H new ATOM 259 N THR A 51 -4.968 5.930 -0.580 1.00 0.00 N ATOM 260 CA THR A 51 -3.951 5.701 0.463 1.00 0.00 C ATOM 261 C THR A 51 -4.307 4.522 1.364 1.00 0.00 C ATOM 262 O THR A 51 -5.372 4.505 1.981 1.00 0.00 O ATOM 263 CB THR A 51 -3.711 6.967 1.295 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.436 8.036 0.414 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.503 6.826 2.228 1.00 0.00 C ATOM 0 H THR A 51 -5.905 6.084 -0.207 1.00 0.00 H new ATOM 0 HA THR A 51 -3.024 5.449 -0.052 1.00 0.00 H new ATOM 0 HB THR A 51 -4.603 7.140 1.897 1.00 0.00 H new ATOM 0 HG1 THR A 51 -3.282 8.854 0.931 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.373 7.747 2.796 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.669 5.996 2.915 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.607 6.635 1.637 1.00 0.00 H new ATOM 273 N PHE A 52 -3.378 3.569 1.467 1.00 0.00 N ATOM 274 CA PHE A 52 -3.388 2.457 2.425 1.00 0.00 C ATOM 275 C PHE A 52 -2.430 2.737 3.595 1.00 0.00 C ATOM 276 O PHE A 52 -1.483 3.516 3.451 1.00 0.00 O ATOM 277 CB PHE A 52 -2.945 1.169 1.719 1.00 0.00 C ATOM 278 CG PHE A 52 -3.870 0.665 0.632 1.00 0.00 C ATOM 279 CD1 PHE A 52 -4.914 -0.222 0.955 1.00 0.00 C ATOM 280 CD2 PHE A 52 -3.660 1.045 -0.708 1.00 0.00 C ATOM 281 CE1 PHE A 52 -5.747 -0.727 -0.056 1.00 0.00 C ATOM 282 CE2 PHE A 52 -4.491 0.535 -1.721 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.531 -0.352 -1.393 1.00 0.00 C ATOM 0 H PHE A 52 -2.560 3.549 0.858 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.401 2.347 2.813 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.960 1.336 1.284 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.834 0.385 2.468 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -5.075 -0.515 1.982 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.861 1.728 -0.957 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -6.552 -1.402 0.193 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.331 0.824 -2.749 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.167 -0.747 -2.172 1.00 0.00 H new ATOM 293 N THR A 53 -2.632 2.050 4.724 1.00 0.00 N ATOM 294 CA THR A 53 -1.757 2.088 5.909 1.00 0.00 C ATOM 295 C THR A 53 -1.038 0.752 6.071 1.00 0.00 C ATOM 296 O THR A 53 -1.688 -0.293 6.096 1.00 0.00 O ATOM 297 CB THR A 53 -2.565 2.399 7.177 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.380 3.533 6.959 1.00 0.00 O ATOM 299 CG2 THR A 53 -1.645 2.706 8.364 1.00 0.00 C ATOM 0 H THR A 53 -3.434 1.431 4.846 1.00 0.00 H new ATOM 0 HA THR A 53 -1.022 2.880 5.764 1.00 0.00 H new ATOM 0 HB THR A 53 -3.169 1.520 7.403 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.895 3.727 7.770 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.248 2.922 9.246 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.008 1.844 8.563 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.024 3.570 8.129 1.00 0.00 H new ATOM 307 N CYS A 54 0.286 0.783 6.222 1.00 0.00 N ATOM 308 CA CYS A 54 1.142 -0.362 6.568 1.00 0.00 C ATOM 309 C CYS A 54 1.811 -0.177 7.943 1.00 0.00 C ATOM 310 O CYS A 54 2.118 0.950 8.335 1.00 0.00 O ATOM 311 CB CYS A 54 2.221 -0.538 5.484 1.00 0.00 C ATOM 312 SG CYS A 54 3.266 -2.000 5.742 1.00 0.00 S ATOM 0 H CYS A 54 0.820 1.644 6.102 1.00 0.00 H new ATOM 0 HA CYS A 54 0.514 -1.252 6.621 1.00 0.00 H new ATOM 0 HB2 CYS A 54 1.738 -0.612 4.509 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.851 0.351 5.461 1.00 0.00 H new ATOM 317 N SER A 55 2.108 -1.262 8.657 1.00 0.00 N ATOM 318 CA SER A 55 2.940 -1.241 9.871 1.00 0.00 C ATOM 319 C SER A 55 3.739 -2.548 10.026 1.00 0.00 C ATOM 320 O SER A 55 3.256 -3.622 9.661 1.00 0.00 O ATOM 321 CB SER A 55 2.093 -0.944 11.124 1.00 0.00 C ATOM 322 OG SER A 55 1.020 -1.860 11.305 1.00 0.00 O ATOM 0 H SER A 55 1.776 -2.194 8.410 1.00 0.00 H new ATOM 0 HA SER A 55 3.661 -0.430 9.764 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.736 -0.969 12.004 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.691 0.067 11.052 1.00 0.00 H new ATOM 0 HG SER A 55 0.521 -1.623 12.114 1.00 0.00 H new ATOM 328 N PHE A 56 4.977 -2.447 10.536 1.00 0.00 N ATOM 329 CA PHE A 56 5.939 -3.546 10.708 1.00 0.00 C ATOM 330 C PHE A 56 6.580 -3.624 12.099 1.00 0.00 C ATOM 331 O PHE A 56 6.704 -2.635 12.819 1.00 0.00 O ATOM 332 CB PHE A 56 7.054 -3.434 9.652 1.00 0.00 C ATOM 333 CG PHE A 56 6.795 -4.334 8.473 1.00 0.00 C ATOM 334 CD1 PHE A 56 5.832 -3.950 7.533 1.00 0.00 C ATOM 335 CD2 PHE A 56 7.440 -5.581 8.356 1.00 0.00 C ATOM 336 CE1 PHE A 56 5.508 -4.800 6.472 1.00 0.00 C ATOM 337 CE2 PHE A 56 7.105 -6.439 7.292 1.00 0.00 C ATOM 338 CZ PHE A 56 6.137 -6.052 6.349 1.00 0.00 C ATOM 0 H PHE A 56 5.352 -1.553 10.855 1.00 0.00 H new ATOM 0 HA PHE A 56 5.359 -4.460 10.584 1.00 0.00 H new ATOM 0 HB2 PHE A 56 7.131 -2.401 9.312 1.00 0.00 H new ATOM 0 HB3 PHE A 56 8.011 -3.693 10.104 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.338 -2.994 7.628 1.00 0.00 H new ATOM 0 HD2 PHE A 56 8.187 -5.877 9.078 1.00 0.00 H new ATOM 0 HE1 PHE A 56 4.772 -4.494 5.744 1.00 0.00 H new ATOM 0 HE2 PHE A 56 7.593 -7.398 7.200 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.878 -6.712 5.535 1.00 0.00 H new ATOM 424 N PHE A 63 14.950 -1.135 9.639 1.00 0.00 N ATOM 425 CA PHE A 63 14.448 -1.839 8.457 1.00 0.00 C ATOM 426 C PHE A 63 14.100 -0.896 7.292 1.00 0.00 C ATOM 427 O PHE A 63 13.773 0.274 7.491 1.00 0.00 O ATOM 428 CB PHE A 63 13.240 -2.721 8.847 1.00 0.00 C ATOM 429 CG PHE A 63 12.031 -1.981 9.393 1.00 0.00 C ATOM 430 CD1 PHE A 63 11.026 -1.521 8.519 1.00 0.00 C ATOM 431 CD2 PHE A 63 11.892 -1.776 10.780 1.00 0.00 C ATOM 432 CE1 PHE A 63 9.894 -0.862 9.030 1.00 0.00 C ATOM 433 CE2 PHE A 63 10.757 -1.121 11.290 1.00 0.00 C ATOM 434 CZ PHE A 63 9.756 -0.665 10.415 1.00 0.00 C ATOM 0 HA PHE A 63 15.255 -2.474 8.090 1.00 0.00 H new ATOM 0 HB2 PHE A 63 12.930 -3.288 7.969 1.00 0.00 H new ATOM 0 HB3 PHE A 63 13.568 -3.444 9.594 1.00 0.00 H new ATOM 0 HD1 PHE A 63 11.125 -1.675 7.455 1.00 0.00 H new ATOM 0 HD2 PHE A 63 12.661 -2.123 11.454 1.00 0.00 H new ATOM 0 HE1 PHE A 63 9.128 -0.506 8.357 1.00 0.00 H new ATOM 0 HE2 PHE A 63 10.654 -0.968 12.354 1.00 0.00 H new ATOM 0 HZ PHE A 63 8.883 -0.164 10.806 1.00 0.00 H new ATOM 444 N VAL A 64 14.149 -1.441 6.074 1.00 0.00 N ATOM 445 CA VAL A 64 13.638 -0.826 4.838 1.00 0.00 C ATOM 446 C VAL A 64 12.234 -1.381 4.601 1.00 0.00 C ATOM 447 O VAL A 64 12.038 -2.592 4.679 1.00 0.00 O ATOM 448 CB VAL A 64 14.538 -1.140 3.615 1.00 0.00 C ATOM 449 CG1 VAL A 64 13.924 -0.653 2.294 1.00 0.00 C ATOM 450 CG2 VAL A 64 15.925 -0.496 3.785 1.00 0.00 C ATOM 0 H VAL A 64 14.562 -2.360 5.911 1.00 0.00 H new ATOM 0 HA VAL A 64 13.628 0.258 4.953 1.00 0.00 H new ATOM 0 HB VAL A 64 14.629 -2.225 3.570 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.594 -0.897 1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 64 12.962 -1.142 2.138 1.00 0.00 H new ATOM 0 HG13 VAL A 64 13.779 0.427 2.336 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.542 -0.727 2.917 1.00 0.00 H new ATOM 0 HG22 VAL A 64 15.816 0.585 3.875 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.401 -0.889 4.684 1.00 0.00 H new ATOM 460 N LEU A 65 11.277 -0.509 4.283 1.00 0.00 N ATOM 461 CA LEU A 65 9.912 -0.872 3.904 1.00 0.00 C ATOM 462 C LEU A 65 9.762 -0.841 2.376 1.00 0.00 C ATOM 463 O LEU A 65 10.388 -0.021 1.708 1.00 0.00 O ATOM 464 CB LEU A 65 8.943 0.130 4.554 1.00 0.00 C ATOM 465 CG LEU A 65 7.510 -0.422 4.666 1.00 0.00 C ATOM 466 CD1 LEU A 65 7.346 -1.254 5.941 1.00 0.00 C ATOM 467 CD2 LEU A 65 6.525 0.741 4.699 1.00 0.00 C ATOM 0 H LEU A 65 11.435 0.499 4.282 1.00 0.00 H new ATOM 0 HA LEU A 65 9.686 -1.881 4.248 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.307 0.390 5.548 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.930 1.049 3.969 1.00 0.00 H new ATOM 0 HG LEU A 65 7.314 -1.060 3.804 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.326 -1.634 5.999 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.044 -2.091 5.922 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.551 -0.630 6.811 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.509 0.355 4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.740 1.376 5.559 1.00 0.00 H new ATOM 0 HD23 LEU A 65 6.621 1.325 3.784 1.00 0.00 H new ATOM 479 N ASN A 66 8.916 -1.709 1.824 1.00 0.00 N ATOM 480 CA ASN A 66 8.681 -1.880 0.388 1.00 0.00 C ATOM 481 C ASN A 66 7.176 -2.010 0.076 1.00 0.00 C ATOM 482 O ASN A 66 6.399 -2.460 0.922 1.00 0.00 O ATOM 483 CB ASN A 66 9.428 -3.138 -0.092 1.00 0.00 C ATOM 484 CG ASN A 66 10.916 -3.171 0.259 1.00 0.00 C ATOM 485 OD1 ASN A 66 11.406 -4.107 0.879 1.00 0.00 O ATOM 486 ND2 ASN A 66 11.679 -2.160 -0.117 1.00 0.00 N ATOM 0 H ASN A 66 8.349 -2.341 2.389 1.00 0.00 H new ATOM 0 HA ASN A 66 9.052 -0.999 -0.136 1.00 0.00 H new ATOM 0 HB2 ASN A 66 8.947 -4.016 0.339 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.322 -3.216 -1.174 1.00 0.00 H new ATOM 0 HD21 ASN A 66 12.674 -2.160 0.109 1.00 0.00 H new ATOM 0 HD22 ASN A 66 11.273 -1.379 -0.633 1.00 0.00 H new ATOM 493 N TRP A 67 6.763 -1.651 -1.144 1.00 0.00 N ATOM 494 CA TRP A 67 5.373 -1.753 -1.615 1.00 0.00 C ATOM 495 C TRP A 67 5.282 -2.465 -2.973 1.00 0.00 C ATOM 496 O TRP A 67 6.092 -2.199 -3.864 1.00 0.00 O ATOM 497 CB TRP A 67 4.796 -0.333 -1.706 1.00 0.00 C ATOM 498 CG TRP A 67 3.327 -0.203 -1.982 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.375 -1.144 -1.783 1.00 0.00 C ATOM 500 CD2 TRP A 67 2.607 0.986 -2.431 1.00 0.00 C ATOM 501 NE1 TRP A 67 1.135 -0.640 -2.112 1.00 0.00 N ATOM 502 CE2 TRP A 67 1.214 0.679 -2.495 1.00 0.00 C ATOM 503 CE3 TRP A 67 2.988 2.310 -2.741 1.00 0.00 C ATOM 504 CZ2 TRP A 67 0.249 1.630 -2.849 1.00 0.00 C ATOM 505 CZ3 TRP A 67 2.027 3.277 -3.081 1.00 0.00 C ATOM 506 CH2 TRP A 67 0.665 2.939 -3.131 1.00 0.00 C ATOM 0 H TRP A 67 7.397 -1.273 -1.848 1.00 0.00 H new ATOM 0 HA TRP A 67 4.797 -2.353 -0.911 1.00 0.00 H new ATOM 0 HB2 TRP A 67 5.009 0.178 -0.767 1.00 0.00 H new ATOM 0 HB3 TRP A 67 5.335 0.200 -2.489 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.560 -2.144 -1.419 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.269 -1.177 -2.076 1.00 0.00 H new ATOM 0 HE3 TRP A 67 4.033 2.583 -2.716 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -0.795 1.360 -2.904 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 2.338 4.287 -3.305 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -0.066 3.691 -3.388 1.00 0.00 H new ATOM 517 N TYR A 68 4.296 -3.355 -3.144 1.00 0.00 N ATOM 518 CA TYR A 68 4.133 -4.194 -4.333 1.00 0.00 C ATOM 519 C TYR A 68 2.695 -4.244 -4.879 1.00 0.00 C ATOM 520 O TYR A 68 1.728 -4.256 -4.111 1.00 0.00 O ATOM 521 CB TYR A 68 4.568 -5.632 -4.002 1.00 0.00 C ATOM 522 CG TYR A 68 5.967 -5.765 -3.437 1.00 0.00 C ATOM 523 CD1 TYR A 68 7.062 -5.942 -4.302 1.00 0.00 C ATOM 524 CD2 TYR A 68 6.169 -5.706 -2.043 1.00 0.00 C ATOM 525 CE1 TYR A 68 8.365 -6.037 -3.781 1.00 0.00 C ATOM 526 CE2 TYR A 68 7.470 -5.797 -1.517 1.00 0.00 C ATOM 527 CZ TYR A 68 8.572 -5.953 -2.386 1.00 0.00 C ATOM 528 OH TYR A 68 9.833 -6.020 -1.877 1.00 0.00 O ATOM 0 H TYR A 68 3.574 -3.514 -2.441 1.00 0.00 H new ATOM 0 HA TYR A 68 4.754 -3.741 -5.106 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.862 -6.053 -3.286 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.500 -6.234 -4.908 1.00 0.00 H new ATOM 0 HD1 TYR A 68 6.902 -6.005 -5.368 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.325 -5.591 -1.379 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.205 -6.174 -4.446 1.00 0.00 H new ATOM 0 HE2 TYR A 68 7.626 -5.748 -0.449 1.00 0.00 H new ATOM 0 HH TYR A 68 9.796 -5.945 -0.901 1.00 0.00 H new ATOM 538 N ARG A 69 2.574 -4.339 -6.210 1.00 0.00 N ATOM 539 CA ARG A 69 1.332 -4.676 -6.930 1.00 0.00 C ATOM 540 C ARG A 69 1.418 -6.146 -7.354 1.00 0.00 C ATOM 541 O ARG A 69 2.493 -6.594 -7.752 1.00 0.00 O ATOM 542 CB ARG A 69 1.159 -3.776 -8.171 1.00 0.00 C ATOM 543 CG ARG A 69 -0.133 -4.086 -8.951 1.00 0.00 C ATOM 544 CD ARG A 69 -0.323 -3.179 -10.173 1.00 0.00 C ATOM 545 NE ARG A 69 -1.423 -3.670 -11.029 1.00 0.00 N ATOM 546 CZ ARG A 69 -2.721 -3.419 -10.891 1.00 0.00 C ATOM 547 NH1 ARG A 69 -3.184 -2.621 -9.961 1.00 0.00 N ATOM 548 NH2 ARG A 69 -3.600 -3.973 -11.696 1.00 0.00 N1+ ATOM 0 H ARG A 69 3.362 -4.179 -6.838 1.00 0.00 H new ATOM 0 HA ARG A 69 0.471 -4.515 -6.281 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.149 -2.732 -7.859 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.017 -3.904 -8.831 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -0.115 -5.126 -9.276 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.989 -3.975 -8.285 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.538 -2.162 -9.846 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.602 -3.140 -10.749 1.00 0.00 H new ATOM 0 HE ARG A 69 -1.157 -4.267 -11.812 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -2.541 -2.168 -9.311 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -4.187 -2.453 -9.886 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -3.288 -4.603 -12.436 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -4.594 -3.773 -11.581 1.00 0.00 H new ATOM 562 N MET A 70 0.315 -6.892 -7.301 1.00 0.00 N ATOM 563 CA MET A 70 0.260 -8.282 -7.780 1.00 0.00 C ATOM 564 C MET A 70 -0.092 -8.377 -9.270 1.00 0.00 C ATOM 565 O MET A 70 -0.911 -7.616 -9.786 1.00 0.00 O ATOM 566 CB MET A 70 -0.731 -9.106 -6.954 1.00 0.00 C ATOM 567 CG MET A 70 -0.402 -9.050 -5.457 1.00 0.00 C ATOM 568 SD MET A 70 -1.005 -10.466 -4.512 1.00 0.00 S ATOM 569 CE MET A 70 0.274 -11.664 -4.973 1.00 0.00 C ATOM 0 H MET A 70 -0.570 -6.553 -6.925 1.00 0.00 H new ATOM 0 HA MET A 70 1.262 -8.693 -7.653 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.742 -8.733 -7.119 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.714 -10.142 -7.292 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.679 -8.981 -5.337 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.828 -8.139 -5.037 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.136 -12.582 -4.401 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.199 -11.885 -6.038 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.258 -11.247 -4.758 1.00 0.00 H new ATOM 579 N SER A 71 0.501 -9.350 -9.954 1.00 0.00 N ATOM 580 CA SER A 71 0.213 -9.708 -11.353 1.00 0.00 C ATOM 581 C SER A 71 -0.583 -11.029 -11.438 1.00 0.00 C ATOM 582 O SER A 71 -0.385 -11.909 -10.589 1.00 0.00 O ATOM 583 CB SER A 71 1.535 -9.844 -12.124 1.00 0.00 C ATOM 584 OG SER A 71 2.219 -8.601 -12.208 1.00 0.00 O ATOM 0 H SER A 71 1.224 -9.938 -9.540 1.00 0.00 H new ATOM 0 HA SER A 71 -0.396 -8.919 -11.796 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.172 -10.578 -11.630 1.00 0.00 H new ATOM 0 HB3 SER A 71 1.335 -10.219 -13.128 1.00 0.00 H new ATOM 0 HG SER A 71 3.056 -8.721 -12.703 1.00 0.00 H new ATOM 590 N PRO A 72 -1.448 -11.212 -12.464 1.00 0.00 N ATOM 591 CA PRO A 72 -2.360 -12.357 -12.575 1.00 0.00 C ATOM 592 C PRO A 72 -1.652 -13.699 -12.828 1.00 0.00 C ATOM 593 O PRO A 72 -2.241 -14.751 -12.593 1.00 0.00 O ATOM 594 CB PRO A 72 -3.320 -12.002 -13.716 1.00 0.00 C ATOM 595 CG PRO A 72 -2.493 -11.075 -14.602 1.00 0.00 C ATOM 596 CD PRO A 72 -1.661 -10.300 -13.581 1.00 0.00 C ATOM 0 HA PRO A 72 -2.877 -12.515 -11.629 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.645 -12.890 -14.258 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -4.218 -11.508 -13.346 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.866 -11.632 -15.298 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -3.123 -10.414 -15.198 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -0.712 -9.982 -14.012 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -2.182 -9.399 -13.256 1.00 0.00 H new ATOM 604 N SER A 73 -0.380 -13.685 -13.239 1.00 0.00 N ATOM 605 CA SER A 73 0.479 -14.879 -13.362 1.00 0.00 C ATOM 606 C SER A 73 1.011 -15.386 -11.998 1.00 0.00 C ATOM 607 O SER A 73 1.896 -16.242 -11.957 1.00 0.00 O ATOM 608 CB SER A 73 1.659 -14.560 -14.298 1.00 0.00 C ATOM 609 OG SER A 73 1.218 -14.039 -15.549 1.00 0.00 O ATOM 0 H SER A 73 0.098 -12.824 -13.503 1.00 0.00 H new ATOM 0 HA SER A 73 -0.134 -15.680 -13.775 1.00 0.00 H new ATOM 0 HB2 SER A 73 2.320 -13.839 -13.817 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.243 -15.464 -14.467 1.00 0.00 H new ATOM 0 HG SER A 73 1.994 -13.847 -16.115 1.00 0.00 H new ATOM 615 N ASN A 74 0.508 -14.833 -10.883 1.00 0.00 N ATOM 616 CA ASN A 74 0.889 -15.112 -9.490 1.00 0.00 C ATOM 617 C ASN A 74 2.296 -14.563 -9.167 1.00 0.00 C ATOM 618 O ASN A 74 3.152 -15.249 -8.601 1.00 0.00 O ATOM 619 CB ASN A 74 0.685 -16.602 -9.135 1.00 0.00 C ATOM 620 CG ASN A 74 0.738 -16.880 -7.632 1.00 0.00 C ATOM 621 OD1 ASN A 74 0.541 -16.006 -6.795 1.00 0.00 O ATOM 622 ND2 ASN A 74 0.995 -18.117 -7.244 1.00 0.00 N ATOM 0 H ASN A 74 -0.228 -14.129 -10.935 1.00 0.00 H new ATOM 0 HA ASN A 74 0.214 -14.568 -8.830 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -0.278 -16.932 -9.525 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.451 -17.195 -9.634 1.00 0.00 H new ATOM 0 HD21 ASN A 74 1.029 -18.343 -6.250 1.00 0.00 H new ATOM 0 HD22 ASN A 74 1.159 -18.846 -7.939 1.00 0.00 H new ATOM 629 N GLN A 75 2.550 -13.317 -9.584 1.00 0.00 N ATOM 630 CA GLN A 75 3.818 -12.596 -9.401 1.00 0.00 C ATOM 631 C GLN A 75 3.561 -11.206 -8.781 1.00 0.00 C ATOM 632 O GLN A 75 2.411 -10.846 -8.510 1.00 0.00 O ATOM 633 CB GLN A 75 4.553 -12.496 -10.757 1.00 0.00 C ATOM 634 CG GLN A 75 4.942 -13.866 -11.337 1.00 0.00 C ATOM 635 CD GLN A 75 5.718 -13.732 -12.650 1.00 0.00 C ATOM 636 OE1 GLN A 75 5.171 -13.836 -13.742 1.00 0.00 O ATOM 637 NE2 GLN A 75 7.012 -13.478 -12.606 1.00 0.00 N ATOM 0 H GLN A 75 1.852 -12.761 -10.077 1.00 0.00 H new ATOM 0 HA GLN A 75 4.457 -13.144 -8.708 1.00 0.00 H new ATOM 0 HB2 GLN A 75 3.916 -11.974 -11.471 1.00 0.00 H new ATOM 0 HB3 GLN A 75 5.452 -11.893 -10.632 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.548 -14.408 -10.611 1.00 0.00 H new ATOM 0 HG3 GLN A 75 4.042 -14.457 -11.506 1.00 0.00 H new ATOM 0 HE21 GLN A 75 7.484 -13.388 -11.706 1.00 0.00 H new ATOM 0 HE22 GLN A 75 7.541 -13.371 -13.472 1.00 0.00 H new ATOM 646 N THR A 76 4.623 -10.421 -8.561 1.00 0.00 N ATOM 647 CA THR A 76 4.606 -9.109 -7.896 1.00 0.00 C ATOM 648 C THR A 76 5.586 -8.158 -8.568 1.00 0.00 C ATOM 649 O THR A 76 6.596 -8.585 -9.131 1.00 0.00 O ATOM 650 CB THR A 76 4.960 -9.203 -6.401 1.00 0.00 C ATOM 651 OG1 THR A 76 5.995 -10.143 -6.185 1.00 0.00 O ATOM 652 CG2 THR A 76 3.747 -9.593 -5.559 1.00 0.00 C ATOM 0 H THR A 76 5.561 -10.694 -8.854 1.00 0.00 H new ATOM 0 HA THR A 76 3.587 -8.732 -7.985 1.00 0.00 H new ATOM 0 HB THR A 76 5.297 -8.213 -6.093 1.00 0.00 H new ATOM 0 HG1 THR A 76 6.205 -10.185 -5.229 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.036 -9.649 -4.509 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.964 -8.844 -5.680 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.374 -10.564 -5.886 1.00 0.00 H new ATOM 660 N ASP A 77 5.298 -6.861 -8.483 1.00 0.00 N ATOM 661 CA ASP A 77 6.165 -5.784 -8.970 1.00 0.00 C ATOM 662 C ASP A 77 6.349 -4.698 -7.906 1.00 0.00 C ATOM 663 O ASP A 77 5.376 -4.229 -7.313 1.00 0.00 O ATOM 664 CB ASP A 77 5.551 -5.180 -10.233 1.00 0.00 C ATOM 665 CG ASP A 77 6.518 -4.232 -10.963 1.00 0.00 C ATOM 666 OD1 ASP A 77 7.646 -4.664 -11.301 1.00 0.00 O1- ATOM 667 OD2 ASP A 77 6.138 -3.062 -11.210 1.00 0.00 O ATOM 0 H ASP A 77 4.434 -6.519 -8.063 1.00 0.00 H new ATOM 0 HA ASP A 77 7.147 -6.200 -9.196 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.255 -5.982 -10.909 1.00 0.00 H new ATOM 0 HB3 ASP A 77 4.645 -4.636 -9.968 1.00 0.00 H new ATOM 672 N LYS A 78 7.601 -4.297 -7.676 1.00 0.00 N ATOM 673 CA LYS A 78 7.982 -3.298 -6.670 1.00 0.00 C ATOM 674 C LYS A 78 7.679 -1.873 -7.169 1.00 0.00 C ATOM 675 O LYS A 78 8.187 -1.435 -8.205 1.00 0.00 O ATOM 676 CB LYS A 78 9.464 -3.489 -6.289 1.00 0.00 C ATOM 677 CG LYS A 78 9.869 -2.694 -5.032 1.00 0.00 C ATOM 678 CD LYS A 78 11.355 -2.922 -4.709 1.00 0.00 C ATOM 679 CE LYS A 78 11.813 -2.119 -3.479 1.00 0.00 C ATOM 680 NZ LYS A 78 13.280 -2.236 -3.271 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.398 -4.665 -8.195 1.00 0.00 H new ATOM 0 HA LYS A 78 7.385 -3.441 -5.769 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.657 -4.548 -6.120 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.091 -3.180 -7.125 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.684 -1.632 -5.191 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.255 -3.002 -4.186 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.528 -3.984 -4.532 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.960 -2.640 -5.571 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.544 -1.070 -3.607 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.289 -2.477 -2.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.557 -1.684 -2.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.531 -3.235 -3.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.779 -1.872 -4.107 1.00 0.00 H new ATOM 694 N LEU A 79 6.846 -1.154 -6.416 1.00 0.00 N ATOM 695 CA LEU A 79 6.304 0.163 -6.766 1.00 0.00 C ATOM 696 C LEU A 79 7.147 1.299 -6.181 1.00 0.00 C ATOM 697 O LEU A 79 7.447 2.273 -6.873 1.00 0.00 O ATOM 698 CB LEU A 79 4.876 0.246 -6.201 1.00 0.00 C ATOM 699 CG LEU A 79 3.910 -0.829 -6.734 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.672 -0.812 -5.835 1.00 0.00 C ATOM 701 CD2 LEU A 79 3.537 -0.578 -8.201 1.00 0.00 C ATOM 0 H LEU A 79 6.516 -1.485 -5.509 1.00 0.00 H new ATOM 0 HA LEU A 79 6.313 0.275 -7.850 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.924 0.166 -5.115 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.466 1.230 -6.430 1.00 0.00 H new ATOM 0 HG LEU A 79 4.387 -1.809 -6.709 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.961 -1.562 -6.181 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.964 -1.035 -4.809 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.208 0.173 -5.874 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.854 -1.357 -8.541 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.053 0.394 -8.292 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.439 -0.593 -8.813 1.00 0.00 H new ATOM 713 N ALA A 80 7.520 1.158 -4.906 1.00 0.00 N ATOM 714 CA ALA A 80 8.163 2.170 -4.072 1.00 0.00 C ATOM 715 C ALA A 80 8.693 1.541 -2.770 1.00 0.00 C ATOM 716 O ALA A 80 8.478 0.354 -2.499 1.00 0.00 O ATOM 717 CB ALA A 80 7.156 3.306 -3.810 1.00 0.00 C ATOM 0 H ALA A 80 7.372 0.284 -4.402 1.00 0.00 H new ATOM 0 HA ALA A 80 9.028 2.590 -4.585 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.623 4.070 -3.188 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.851 3.748 -4.759 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.281 2.906 -3.298 1.00 0.00 H new ATOM 723 N ALA A 81 9.382 2.349 -1.964 1.00 0.00 N ATOM 724 CA ALA A 81 10.055 1.944 -0.733 1.00 0.00 C ATOM 725 C ALA A 81 10.285 3.142 0.207 1.00 0.00 C ATOM 726 O ALA A 81 10.182 4.296 -0.216 1.00 0.00 O ATOM 727 CB ALA A 81 11.378 1.257 -1.118 1.00 0.00 C ATOM 0 H ALA A 81 9.490 3.344 -2.160 1.00 0.00 H new ATOM 0 HA ALA A 81 9.427 1.246 -0.180 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.902 0.944 -0.215 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.168 0.384 -1.737 1.00 0.00 H new ATOM 0 HB3 ALA A 81 12.002 1.956 -1.676 1.00 0.00 H new ATOM 733 N PHE A 82 10.620 2.864 1.469 1.00 0.00 N ATOM 734 CA PHE A 82 11.022 3.869 2.455 1.00 0.00 C ATOM 735 C PHE A 82 11.949 3.262 3.533 1.00 0.00 C ATOM 736 O PHE A 82 11.496 2.398 4.290 1.00 0.00 O ATOM 737 CB PHE A 82 9.781 4.520 3.086 1.00 0.00 C ATOM 738 CG PHE A 82 10.127 5.735 3.922 1.00 0.00 C ATOM 739 CD1 PHE A 82 10.181 7.008 3.323 1.00 0.00 C ATOM 740 CD2 PHE A 82 10.449 5.593 5.285 1.00 0.00 C ATOM 741 CE1 PHE A 82 10.523 8.136 4.090 1.00 0.00 C ATOM 742 CE2 PHE A 82 10.805 6.719 6.049 1.00 0.00 C ATOM 743 CZ PHE A 82 10.832 7.992 5.454 1.00 0.00 C ATOM 0 H PHE A 82 10.619 1.914 1.841 1.00 0.00 H new ATOM 0 HA PHE A 82 11.592 4.643 1.942 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.086 4.811 2.298 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.268 3.788 3.709 1.00 0.00 H new ATOM 0 HD1 PHE A 82 9.959 7.118 2.272 1.00 0.00 H new ATOM 0 HD2 PHE A 82 10.423 4.616 5.745 1.00 0.00 H new ATOM 0 HE1 PHE A 82 10.548 9.113 3.631 1.00 0.00 H new ATOM 0 HE2 PHE A 82 11.058 6.605 7.093 1.00 0.00 H new ATOM 0 HZ PHE A 82 11.090 8.859 6.044 1.00 0.00 H new ATOM 753 N PRO A 83 13.215 3.714 3.657 1.00 0.00 N ATOM 754 CA PRO A 83 13.940 4.570 2.713 1.00 0.00 C ATOM 755 C PRO A 83 13.978 3.966 1.302 1.00 0.00 C ATOM 756 O PRO A 83 13.884 2.751 1.143 1.00 0.00 O ATOM 757 CB PRO A 83 15.358 4.713 3.284 1.00 0.00 C ATOM 758 CG PRO A 83 15.178 4.433 4.774 1.00 0.00 C ATOM 759 CD PRO A 83 14.074 3.379 4.780 1.00 0.00 C ATOM 0 HA PRO A 83 13.445 5.535 2.607 1.00 0.00 H new ATOM 0 HB2 PRO A 83 16.048 4.006 2.824 1.00 0.00 H new ATOM 0 HB3 PRO A 83 15.761 5.711 3.110 1.00 0.00 H new ATOM 0 HG2 PRO A 83 16.095 4.062 5.231 1.00 0.00 H new ATOM 0 HG3 PRO A 83 14.887 5.329 5.323 1.00 0.00 H new ATOM 0 HD2 PRO A 83 14.488 2.376 4.673 1.00 0.00 H new ATOM 0 HD3 PRO A 83 13.519 3.396 5.718 1.00 0.00 H new ATOM 907 N ARG A 94 3.793 8.728 -9.082 1.00 0.00 N ATOM 908 CA ARG A 94 2.436 8.255 -8.772 1.00 0.00 C ATOM 909 C ARG A 94 2.363 7.439 -7.480 1.00 0.00 C ATOM 910 O ARG A 94 1.443 7.657 -6.689 1.00 0.00 O ATOM 911 CB ARG A 94 1.883 7.412 -9.932 1.00 0.00 C ATOM 912 CG ARG A 94 1.788 8.211 -11.243 1.00 0.00 C ATOM 913 CD ARG A 94 0.996 7.454 -12.315 1.00 0.00 C ATOM 914 NE ARG A 94 -0.437 7.392 -11.973 1.00 0.00 N ATOM 915 CZ ARG A 94 -1.160 6.319 -11.673 1.00 0.00 C ATOM 916 NH1 ARG A 94 -0.672 5.096 -11.664 1.00 0.00 N1+ ATOM 917 NH2 ARG A 94 -2.426 6.472 -11.376 1.00 0.00 N ATOM 0 HA ARG A 94 1.829 9.149 -8.630 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.524 6.544 -10.084 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.895 7.036 -9.666 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.311 9.172 -11.049 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.791 8.422 -11.613 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.122 7.946 -13.279 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.392 6.444 -12.419 1.00 0.00 H new ATOM 0 HE ARG A 94 -0.934 8.283 -11.966 1.00 0.00 H new ATOM 0 HH11 ARG A 94 0.308 4.936 -11.895 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -1.274 4.308 -11.426 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -2.841 7.404 -11.378 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.997 5.660 -11.143 1.00 0.00 H new ATOM 931 N PHE A 95 3.299 6.511 -7.263 1.00 0.00 N ATOM 932 CA PHE A 95 3.352 5.633 -6.091 1.00 0.00 C ATOM 933 C PHE A 95 4.327 6.206 -5.052 1.00 0.00 C ATOM 934 O PHE A 95 5.526 6.324 -5.320 1.00 0.00 O ATOM 935 CB PHE A 95 3.754 4.214 -6.533 1.00 0.00 C ATOM 936 CG PHE A 95 2.759 3.560 -7.477 1.00 0.00 C ATOM 937 CD1 PHE A 95 1.609 2.931 -6.961 1.00 0.00 C ATOM 938 CD2 PHE A 95 2.963 3.595 -8.869 1.00 0.00 C ATOM 939 CE1 PHE A 95 0.665 2.358 -7.831 1.00 0.00 C ATOM 940 CE2 PHE A 95 2.019 3.021 -9.740 1.00 0.00 C ATOM 941 CZ PHE A 95 0.865 2.406 -9.222 1.00 0.00 C ATOM 0 H PHE A 95 4.064 6.345 -7.917 1.00 0.00 H new ATOM 0 HA PHE A 95 2.370 5.575 -5.622 1.00 0.00 H new ATOM 0 HB2 PHE A 95 4.728 4.258 -7.020 1.00 0.00 H new ATOM 0 HB3 PHE A 95 3.868 3.587 -5.649 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.452 2.889 -5.893 1.00 0.00 H new ATOM 0 HD2 PHE A 95 3.849 4.065 -9.271 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -0.216 1.880 -7.430 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.181 3.053 -10.807 1.00 0.00 H new ATOM 0 HZ PHE A 95 0.135 1.972 -9.890 1.00 0.00 H new ATOM 951 N ARG A 96 3.810 6.575 -3.873 1.00 0.00 N ATOM 952 CA ARG A 96 4.552 7.287 -2.817 1.00 0.00 C ATOM 953 C ARG A 96 4.377 6.603 -1.453 1.00 0.00 C ATOM 954 O ARG A 96 3.276 6.153 -1.135 1.00 0.00 O ATOM 955 CB ARG A 96 4.070 8.751 -2.744 1.00 0.00 C ATOM 956 CG ARG A 96 4.172 9.488 -4.092 1.00 0.00 C ATOM 957 CD ARG A 96 3.820 10.972 -3.949 1.00 0.00 C ATOM 958 NE ARG A 96 3.730 11.617 -5.269 1.00 0.00 N ATOM 959 CZ ARG A 96 3.552 12.907 -5.518 1.00 0.00 C ATOM 960 NH1 ARG A 96 3.508 13.814 -4.564 1.00 0.00 N1+ ATOM 961 NH2 ARG A 96 3.403 13.289 -6.766 1.00 0.00 N ATOM 0 H ARG A 96 2.841 6.384 -3.618 1.00 0.00 H new ATOM 0 HA ARG A 96 5.613 7.264 -3.067 1.00 0.00 H new ATOM 0 HB2 ARG A 96 3.035 8.770 -2.404 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.660 9.285 -1.999 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.183 9.389 -4.486 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.502 9.022 -4.814 1.00 0.00 H new ATOM 0 HD2 ARG A 96 2.871 11.076 -3.423 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.576 11.473 -3.345 1.00 0.00 H new ATOM 0 HE ARG A 96 3.814 11.005 -6.081 1.00 0.00 H new ATOM 0 HH11 ARG A 96 3.613 13.534 -3.589 1.00 0.00 H new ATOM 0 HH12 ARG A 96 3.369 14.796 -4.800 1.00 0.00 H new ATOM 0 HH21 ARG A 96 3.426 12.599 -7.517 1.00 0.00 H new ATOM 0 HH22 ARG A 96 3.265 14.276 -6.984 1.00 0.00 H new ATOM 975 N VAL A 97 5.439 6.544 -0.645 1.00 0.00 N ATOM 976 CA VAL A 97 5.444 5.952 0.712 1.00 0.00 C ATOM 977 C VAL A 97 5.994 6.972 1.720 1.00 0.00 C ATOM 978 O VAL A 97 7.096 7.488 1.523 1.00 0.00 O ATOM 979 CB VAL A 97 6.269 4.641 0.776 1.00 0.00 C ATOM 980 CG1 VAL A 97 6.205 3.995 2.172 1.00 0.00 C ATOM 981 CG2 VAL A 97 5.781 3.610 -0.259 1.00 0.00 C ATOM 0 H VAL A 97 6.349 6.915 -0.917 1.00 0.00 H new ATOM 0 HA VAL A 97 4.415 5.699 0.966 1.00 0.00 H new ATOM 0 HB VAL A 97 7.298 4.922 0.552 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.795 3.079 2.176 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.605 4.688 2.912 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.169 3.760 2.417 1.00 0.00 H new ATOM 0 HG21 VAL A 97 6.384 2.705 -0.183 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.736 3.367 -0.066 1.00 0.00 H new ATOM 0 HG23 VAL A 97 5.877 4.027 -1.261 1.00 0.00 H new ATOM 991 N THR A 98 5.232 7.250 2.789 1.00 0.00 N ATOM 992 CA THR A 98 5.557 8.257 3.821 1.00 0.00 C ATOM 993 C THR A 98 5.417 7.660 5.220 1.00 0.00 C ATOM 994 O THR A 98 4.389 7.062 5.526 1.00 0.00 O ATOM 995 CB THR A 98 4.631 9.474 3.667 1.00 0.00 C ATOM 996 OG1 THR A 98 4.792 10.002 2.365 1.00 0.00 O ATOM 997 CG2 THR A 98 4.955 10.594 4.659 1.00 0.00 C ATOM 0 H THR A 98 4.350 6.771 2.968 1.00 0.00 H new ATOM 0 HA THR A 98 6.591 8.574 3.688 1.00 0.00 H new ATOM 0 HB THR A 98 3.614 9.131 3.856 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.205 10.779 2.252 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.269 11.427 4.504 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.847 10.220 5.677 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.979 10.933 4.503 1.00 0.00 H new ATOM 1005 N GLN A 99 6.417 7.844 6.084 1.00 0.00 N ATOM 1006 CA GLN A 99 6.387 7.391 7.482 1.00 0.00 C ATOM 1007 C GLN A 99 5.580 8.348 8.379 1.00 0.00 C ATOM 1008 O GLN A 99 5.672 9.571 8.249 1.00 0.00 O ATOM 1009 CB GLN A 99 7.833 7.223 7.982 1.00 0.00 C ATOM 1010 CG GLN A 99 7.924 6.676 9.418 1.00 0.00 C ATOM 1011 CD GLN A 99 9.367 6.402 9.842 1.00 0.00 C ATOM 1012 OE1 GLN A 99 10.190 7.300 9.974 1.00 0.00 O ATOM 1013 NE2 GLN A 99 9.741 5.158 10.066 1.00 0.00 N ATOM 0 H GLN A 99 7.284 8.318 5.832 1.00 0.00 H new ATOM 0 HA GLN A 99 5.876 6.429 7.533 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.366 6.550 7.310 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.340 8.187 7.936 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.475 7.392 10.107 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.345 5.756 9.492 1.00 0.00 H new ATOM 0 HE21 GLN A 99 9.070 4.397 9.961 1.00 0.00 H new ATOM 0 HE22 GLN A 99 10.701 4.956 10.344 1.00 0.00 H new ATOM 1022 N LEU A 100 4.813 7.783 9.318 1.00 0.00 N ATOM 1023 CA LEU A 100 3.991 8.504 10.297 1.00 0.00 C ATOM 1024 C LEU A 100 4.735 8.692 11.639 1.00 0.00 C ATOM 1025 O LEU A 100 5.606 7.878 11.970 1.00 0.00 O ATOM 1026 CB LEU A 100 2.671 7.730 10.530 1.00 0.00 C ATOM 1027 CG LEU A 100 1.882 7.343 9.264 1.00 0.00 C ATOM 1028 CD1 LEU A 100 0.522 6.750 9.656 1.00 0.00 C ATOM 1029 CD2 LEU A 100 1.656 8.521 8.308 1.00 0.00 C ATOM 0 H LEU A 100 4.745 6.770 9.421 1.00 0.00 H new ATOM 0 HA LEU A 100 3.776 9.495 9.897 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.900 6.820 11.084 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.025 8.336 11.166 1.00 0.00 H new ATOM 0 HG LEU A 100 2.489 6.607 8.736 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.030 6.479 8.756 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.675 5.862 10.269 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.047 7.488 10.222 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.095 8.181 7.438 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.094 9.302 8.820 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.619 8.918 7.986 1.00 0.00 H new ATOM 1041 N PRO A 101 4.354 9.695 12.460 1.00 0.00 N ATOM 1042 CA PRO A 101 4.924 9.914 13.792 1.00 0.00 C ATOM 1043 C PRO A 101 4.515 8.855 14.836 1.00 0.00 C ATOM 1044 O PRO A 101 4.994 8.916 15.968 1.00 0.00 O ATOM 1045 CB PRO A 101 4.459 11.319 14.195 1.00 0.00 C ATOM 1046 CG PRO A 101 3.126 11.472 13.467 1.00 0.00 C ATOM 1047 CD PRO A 101 3.387 10.743 12.151 1.00 0.00 C ATOM 0 HA PRO A 101 6.010 9.823 13.757 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.340 11.409 15.275 1.00 0.00 H new ATOM 0 HB3 PRO A 101 5.174 12.082 13.889 1.00 0.00 H new ATOM 0 HG2 PRO A 101 2.304 11.022 14.025 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.868 12.519 13.307 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.466 10.319 11.750 1.00 0.00 H new ATOM 0 HD3 PRO A 101 3.779 11.426 11.397 1.00 0.00 H new ATOM 1055 N ASN A 102 3.658 7.880 14.491 1.00 0.00 N ATOM 1056 CA ASN A 102 3.203 6.828 15.418 1.00 0.00 C ATOM 1057 C ASN A 102 4.302 5.795 15.795 1.00 0.00 C ATOM 1058 O ASN A 102 4.120 5.000 16.720 1.00 0.00 O ATOM 1059 CB ASN A 102 1.939 6.178 14.831 1.00 0.00 C ATOM 1060 CG ASN A 102 1.167 5.368 15.872 1.00 0.00 C ATOM 1061 OD1 ASN A 102 0.464 5.916 16.712 1.00 0.00 O ATOM 1062 ND2 ASN A 102 1.273 4.052 15.853 1.00 0.00 N ATOM 0 H ASN A 102 3.259 7.798 13.556 1.00 0.00 H new ATOM 0 HA ASN A 102 2.962 7.293 16.374 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.290 6.953 14.423 1.00 0.00 H new ATOM 0 HB3 ASN A 102 2.219 5.528 14.002 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.769 3.490 16.539 1.00 0.00 H new ATOM 0 HD22 ASN A 102 1.859 3.598 15.153 1.00 0.00 H new ATOM 1069 N GLY A 103 5.465 5.837 15.126 1.00 0.00 N ATOM 1070 CA GLY A 103 6.699 5.113 15.489 1.00 0.00 C ATOM 1071 C GLY A 103 7.085 3.932 14.594 1.00 0.00 C ATOM 1072 O GLY A 103 8.282 3.731 14.377 1.00 0.00 O ATOM 0 H GLY A 103 5.579 6.399 14.282 1.00 0.00 H new ATOM 0 HA2 GLY A 103 7.525 5.825 15.490 1.00 0.00 H new ATOM 0 HA3 GLY A 103 6.592 4.747 16.510 1.00 0.00 H new ATOM 1076 N ARG A 104 6.122 3.182 14.041 1.00 0.00 N ATOM 1077 CA ARG A 104 6.380 2.170 12.996 1.00 0.00 C ATOM 1078 C ARG A 104 5.129 1.954 12.151 1.00 0.00 C ATOM 1079 O ARG A 104 4.490 0.903 12.144 1.00 0.00 O ATOM 1080 CB ARG A 104 6.917 0.867 13.635 1.00 0.00 C ATOM 1081 CG ARG A 104 6.248 0.364 14.938 1.00 0.00 C ATOM 1082 CD ARG A 104 4.980 -0.498 14.813 1.00 0.00 C ATOM 1083 NE ARG A 104 3.728 0.283 14.790 1.00 0.00 N ATOM 1084 CZ ARG A 104 2.567 -0.048 15.343 1.00 0.00 C ATOM 1085 NH1 ARG A 104 2.439 -1.054 16.184 1.00 0.00 N ATOM 1086 NH2 ARG A 104 1.493 0.643 15.033 1.00 0.00 N1+ ATOM 0 H ARG A 104 5.139 3.257 14.303 1.00 0.00 H new ATOM 0 HA ARG A 104 7.155 2.527 12.318 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.837 0.074 12.892 1.00 0.00 H new ATOM 0 HB3 ARG A 104 7.979 1.008 13.838 1.00 0.00 H new ATOM 0 HG2 ARG A 104 6.989 -0.211 15.493 1.00 0.00 H new ATOM 0 HG3 ARG A 104 6.001 1.235 15.544 1.00 0.00 H new ATOM 0 HD2 ARG A 104 5.044 -1.091 13.901 1.00 0.00 H new ATOM 0 HD3 ARG A 104 4.945 -1.199 15.647 1.00 0.00 H new ATOM 0 HE ARG A 104 3.758 1.174 14.295 1.00 0.00 H new ATOM 0 HH11 ARG A 104 3.253 -1.616 16.435 1.00 0.00 H new ATOM 0 HH12 ARG A 104 1.526 -1.271 16.584 1.00 0.00 H new ATOM 0 HH21 ARG A 104 1.559 1.421 14.376 1.00 0.00 H new ATOM 0 HH22 ARG A 104 0.594 0.402 15.449 1.00 0.00 H new ATOM 1100 N ASP A 105 4.857 2.944 11.319 1.00 0.00 N ATOM 1101 CA ASP A 105 3.605 3.114 10.601 1.00 0.00 C ATOM 1102 C ASP A 105 3.843 3.987 9.367 1.00 0.00 C ATOM 1103 O ASP A 105 4.633 4.933 9.420 1.00 0.00 O ATOM 1104 CB ASP A 105 2.621 3.813 11.542 1.00 0.00 C ATOM 1105 CG ASP A 105 2.184 2.946 12.729 1.00 0.00 C ATOM 1106 OD1 ASP A 105 2.880 2.956 13.772 1.00 0.00 O ATOM 1107 OD2 ASP A 105 1.142 2.262 12.647 1.00 0.00 O1- ATOM 0 H ASP A 105 5.531 3.683 11.116 1.00 0.00 H new ATOM 0 HA ASP A 105 3.209 2.150 10.281 1.00 0.00 H new ATOM 0 HB2 ASP A 105 3.080 4.727 11.920 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.738 4.110 10.976 1.00 0.00 H new ATOM 1112 N PHE A 106 3.171 3.668 8.260 1.00 0.00 N ATOM 1113 CA PHE A 106 3.462 4.255 6.954 1.00 0.00 C ATOM 1114 C PHE A 106 2.207 4.344 6.080 1.00 0.00 C ATOM 1115 O PHE A 106 1.458 3.376 5.956 1.00 0.00 O ATOM 1116 CB PHE A 106 4.535 3.409 6.240 1.00 0.00 C ATOM 1117 CG PHE A 106 5.783 3.088 7.047 1.00 0.00 C ATOM 1118 CD1 PHE A 106 5.792 1.979 7.919 1.00 0.00 C ATOM 1119 CD2 PHE A 106 6.957 3.846 6.880 1.00 0.00 C ATOM 1120 CE1 PHE A 106 6.951 1.650 8.642 1.00 0.00 C ATOM 1121 CE2 PHE A 106 8.123 3.506 7.592 1.00 0.00 C ATOM 1122 CZ PHE A 106 8.120 2.412 8.476 1.00 0.00 C ATOM 0 H PHE A 106 2.407 2.992 8.245 1.00 0.00 H new ATOM 0 HA PHE A 106 3.828 5.269 7.113 1.00 0.00 H new ATOM 0 HB2 PHE A 106 4.079 2.470 5.927 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.838 3.934 5.334 1.00 0.00 H new ATOM 0 HD1 PHE A 106 4.901 1.378 8.032 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.963 4.689 6.205 1.00 0.00 H new ATOM 0 HE1 PHE A 106 6.943 0.813 9.324 1.00 0.00 H new ATOM 0 HE2 PHE A 106 9.023 4.087 7.459 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.014 2.158 9.026 1.00 0.00 H new ATOM 1132 N HIS A 107 2.012 5.487 5.426 1.00 0.00 N ATOM 1133 CA HIS A 107 1.003 5.671 4.380 1.00 0.00 C ATOM 1134 C HIS A 107 1.582 5.360 2.991 1.00 0.00 C ATOM 1135 O HIS A 107 2.690 5.789 2.662 1.00 0.00 O ATOM 1136 CB HIS A 107 0.452 7.106 4.435 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.639 7.329 5.452 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.320 6.337 6.164 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -1.164 8.544 5.783 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.228 6.983 6.913 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -2.156 8.310 6.709 1.00 0.00 N ATOM 0 H HIS A 107 2.560 6.328 5.610 1.00 0.00 H new ATOM 0 HA HIS A 107 0.186 4.972 4.558 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.275 7.787 4.651 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.069 7.371 3.449 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -0.860 9.504 5.394 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -2.921 6.502 7.587 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -2.734 9.019 7.161 1.00 0.00 H new ATOM 1149 N MET A 108 0.818 4.634 2.173 1.00 0.00 N ATOM 1150 CA MET A 108 1.163 4.222 0.808 1.00 0.00 C ATOM 1151 C MET A 108 0.115 4.762 -0.165 1.00 0.00 C ATOM 1152 O MET A 108 -1.016 4.283 -0.183 1.00 0.00 O ATOM 1153 CB MET A 108 1.228 2.692 0.742 1.00 0.00 C ATOM 1154 CG MET A 108 2.342 2.155 1.637 1.00 0.00 C ATOM 1155 SD MET A 108 2.707 0.409 1.370 1.00 0.00 S ATOM 1156 CE MET A 108 4.355 0.430 2.093 1.00 0.00 C ATOM 0 H MET A 108 -0.103 4.300 2.457 1.00 0.00 H new ATOM 0 HA MET A 108 2.137 4.626 0.530 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.272 2.270 1.052 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.398 2.375 -0.287 1.00 0.00 H new ATOM 0 HG2 MET A 108 3.247 2.737 1.464 1.00 0.00 H new ATOM 0 HG3 MET A 108 2.062 2.303 2.680 1.00 0.00 H new ATOM 0 HE1 MET A 108 4.850 -0.521 1.897 1.00 0.00 H new ATOM 0 HE2 MET A 108 4.936 1.240 1.651 1.00 0.00 H new ATOM 0 HE3 MET A 108 4.278 0.584 3.169 1.00 0.00 H new ATOM 1166 N SER A 109 0.467 5.789 -0.935 1.00 0.00 N ATOM 1167 CA SER A 109 -0.471 6.568 -1.754 1.00 0.00 C ATOM 1168 C SER A 109 -0.283 6.357 -3.267 1.00 0.00 C ATOM 1169 O SER A 109 0.828 6.500 -3.784 1.00 0.00 O ATOM 1170 CB SER A 109 -0.324 8.058 -1.423 1.00 0.00 C ATOM 1171 OG SER A 109 -1.274 8.830 -2.145 1.00 0.00 O ATOM 0 H SER A 109 1.431 6.113 -1.012 1.00 0.00 H new ATOM 0 HA SER A 109 -1.472 6.212 -1.509 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.460 8.213 -0.353 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.684 8.392 -1.667 1.00 0.00 H new ATOM 0 HG SER A 109 -1.165 9.777 -1.919 1.00 0.00 H new ATOM 1177 N VAL A 110 -1.375 6.047 -3.975 1.00 0.00 N ATOM 1178 CA VAL A 110 -1.479 6.045 -5.443 1.00 0.00 C ATOM 1179 C VAL A 110 -2.092 7.390 -5.840 1.00 0.00 C ATOM 1180 O VAL A 110 -3.302 7.589 -5.716 1.00 0.00 O ATOM 1181 CB VAL A 110 -2.343 4.887 -6.008 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -2.270 4.865 -7.547 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -1.923 3.516 -5.462 1.00 0.00 C ATOM 0 H VAL A 110 -2.249 5.779 -3.523 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.484 5.895 -5.862 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.366 5.075 -5.683 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.881 4.047 -7.929 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.641 5.811 -7.942 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.236 4.722 -7.860 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.561 2.743 -5.890 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.885 3.320 -5.730 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -2.025 3.510 -4.377 1.00 0.00 H new ATOM 1193 N VAL A 111 -1.253 8.321 -6.287 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.666 9.667 -6.713 1.00 0.00 C ATOM 1195 C VAL A 111 -2.367 9.592 -8.075 1.00 0.00 C ATOM 1196 O VAL A 111 -1.828 9.006 -9.016 1.00 0.00 O ATOM 1197 CB VAL A 111 -0.463 10.641 -6.764 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.856 12.043 -7.258 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.194 10.763 -5.378 1.00 0.00 C ATOM 0 H VAL A 111 -0.248 8.164 -6.367 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.367 10.058 -5.976 1.00 0.00 H new ATOM 0 HB VAL A 111 0.243 10.218 -7.479 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.026 12.684 -7.274 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.270 11.972 -8.264 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.602 12.469 -6.587 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.037 11.452 -5.434 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.536 11.140 -4.661 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.547 9.783 -5.055 1.00 0.00 H new ATOM 1209 N ARG A 112 -3.560 10.199 -8.171 1.00 0.00 N ATOM 1210 CA ARG A 112 -4.332 10.360 -9.416 1.00 0.00 C ATOM 1211 C ARG A 112 -4.687 8.988 -10.027 1.00 0.00 C ATOM 1212 O ARG A 112 -4.272 8.656 -11.141 1.00 0.00 O ATOM 1213 CB ARG A 112 -3.548 11.282 -10.379 1.00 0.00 C ATOM 1214 CG ARG A 112 -4.424 11.942 -11.459 1.00 0.00 C ATOM 1215 CD ARG A 112 -4.672 13.431 -11.175 1.00 0.00 C ATOM 1216 NE ARG A 112 -5.468 13.640 -9.950 1.00 0.00 N ATOM 1217 CZ ARG A 112 -5.421 14.678 -9.125 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -4.604 15.695 -9.307 1.00 0.00 N1+ ATOM 1219 NH2 ARG A 112 -6.221 14.692 -8.084 1.00 0.00 N ATOM 0 H ARG A 112 -4.029 10.604 -7.361 1.00 0.00 H new ATOM 0 HA ARG A 112 -5.288 10.840 -9.208 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -3.054 12.061 -9.799 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -2.764 10.701 -10.865 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -3.942 11.835 -12.431 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -5.380 11.421 -11.518 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -3.716 13.945 -11.077 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -5.189 13.880 -12.023 1.00 0.00 H new ATOM 0 HE ARG A 112 -6.130 12.902 -9.710 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -3.973 15.705 -10.108 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -4.602 16.472 -8.646 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -6.862 13.915 -7.923 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -6.202 15.480 -7.437 1.00 0.00 H new ATOM 1233 N ALA A 113 -5.369 8.140 -9.254 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.639 6.741 -9.599 1.00 0.00 C ATOM 1235 C ALA A 113 -6.677 6.583 -10.728 1.00 0.00 C ATOM 1236 O ALA A 113 -7.492 7.469 -10.975 1.00 0.00 O ATOM 1237 CB ALA A 113 -6.029 5.993 -8.316 1.00 0.00 C ATOM 0 H ALA A 113 -5.758 8.412 -8.351 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.733 6.297 -10.012 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -6.234 4.949 -8.552 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.210 6.049 -7.599 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.920 6.450 -7.885 1.00 0.00 H new ATOM 1243 N ARG A 114 -6.620 5.444 -11.419 1.00 0.00 N ATOM 1244 CA ARG A 114 -7.322 5.147 -12.678 1.00 0.00 C ATOM 1245 C ARG A 114 -7.977 3.764 -12.591 1.00 0.00 C ATOM 1246 O ARG A 114 -7.502 2.926 -11.824 1.00 0.00 O ATOM 1247 CB ARG A 114 -6.285 5.115 -13.821 1.00 0.00 C ATOM 1248 CG ARG A 114 -5.311 6.318 -13.863 1.00 0.00 C ATOM 1249 CD ARG A 114 -4.033 6.037 -14.659 1.00 0.00 C ATOM 1250 NE ARG A 114 -3.320 4.849 -14.145 1.00 0.00 N ATOM 1251 CZ ARG A 114 -2.719 3.897 -14.847 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -2.602 3.949 -16.156 1.00 0.00 N1+ ATOM 1253 NH2 ARG A 114 -2.242 2.844 -14.226 1.00 0.00 N ATOM 0 H ARG A 114 -6.053 4.658 -11.102 1.00 0.00 H new ATOM 0 HA ARG A 114 -8.082 5.907 -12.859 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -5.701 4.199 -13.735 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -6.817 5.066 -14.771 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -5.822 7.175 -14.301 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -5.042 6.594 -12.843 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -4.284 5.885 -15.709 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -3.376 6.905 -14.611 1.00 0.00 H new ATOM 0 HE ARG A 114 -3.286 4.749 -13.130 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -2.981 4.744 -16.671 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -2.132 3.195 -16.656 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -2.335 2.763 -13.213 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -1.778 2.106 -14.756 1.00 0.00 H new ATOM 1267 N ARG A 115 -8.968 3.439 -13.428 1.00 0.00 N ATOM 1268 CA ARG A 115 -9.514 2.065 -13.514 1.00 0.00 C ATOM 1269 C ARG A 115 -8.437 0.998 -13.815 1.00 0.00 C ATOM 1270 O ARG A 115 -8.550 -0.138 -13.356 1.00 0.00 O ATOM 1271 CB ARG A 115 -10.675 2.016 -14.522 1.00 0.00 C ATOM 1272 CG ARG A 115 -11.994 2.391 -13.821 1.00 0.00 C ATOM 1273 CD ARG A 115 -13.182 2.575 -14.771 1.00 0.00 C ATOM 1274 NE ARG A 115 -13.416 1.384 -15.612 1.00 0.00 N ATOM 1275 CZ ARG A 115 -14.427 0.520 -15.555 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -15.468 0.660 -14.760 1.00 0.00 N1+ ATOM 1277 NH2 ARG A 115 -14.402 -0.539 -16.335 1.00 0.00 N ATOM 0 H ARG A 115 -9.414 4.104 -14.060 1.00 0.00 H new ATOM 0 HA ARG A 115 -9.901 1.809 -12.528 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -10.482 2.704 -15.345 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -10.753 1.017 -14.952 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -12.240 1.615 -13.096 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -11.845 3.314 -13.261 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -14.079 2.789 -14.190 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -13.003 3.439 -15.411 1.00 0.00 H new ATOM 0 HE ARG A 115 -12.713 1.200 -16.328 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -15.531 1.468 -14.140 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -16.211 -0.039 -14.764 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -13.617 -0.687 -16.969 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -15.168 -1.212 -16.306 1.00 0.00 H new ATOM 1291 N ASN A 116 -7.345 1.373 -14.494 1.00 0.00 N ATOM 1292 CA ASN A 116 -6.167 0.522 -14.723 1.00 0.00 C ATOM 1293 C ASN A 116 -5.320 0.240 -13.452 1.00 0.00 C ATOM 1294 O ASN A 116 -4.584 -0.747 -13.420 1.00 0.00 O ATOM 1295 CB ASN A 116 -5.322 1.183 -15.827 1.00 0.00 C ATOM 1296 CG ASN A 116 -4.139 0.329 -16.280 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -2.983 0.650 -16.030 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -4.388 -0.776 -16.962 1.00 0.00 N ATOM 0 H ASN A 116 -7.253 2.300 -14.910 1.00 0.00 H new ATOM 0 HA ASN A 116 -6.517 -0.464 -15.029 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -5.960 1.392 -16.686 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.951 2.142 -15.465 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -3.617 -1.363 -17.281 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -5.351 -1.041 -17.169 1.00 0.00 H new ATOM 1305 N ASP A 117 -5.424 1.061 -12.395 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.752 0.834 -11.103 1.00 0.00 C ATOM 1307 C ASP A 117 -5.531 -0.126 -10.183 1.00 0.00 C ATOM 1308 O ASP A 117 -4.992 -0.567 -9.174 1.00 0.00 O ATOM 1309 CB ASP A 117 -4.511 2.161 -10.361 1.00 0.00 C ATOM 1310 CG ASP A 117 -3.604 3.131 -11.115 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -2.431 2.812 -11.408 1.00 0.00 O ATOM 1312 OD2 ASP A 117 -4.059 4.252 -11.425 1.00 0.00 O1- ATOM 0 H ASP A 117 -5.984 1.913 -12.413 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.797 0.367 -11.343 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -5.471 2.644 -10.177 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.070 1.948 -9.387 1.00 0.00 H new ATOM 1317 N SER A 118 -6.773 -0.501 -10.500 1.00 0.00 N ATOM 1318 CA SER A 118 -7.495 -1.517 -9.719 1.00 0.00 C ATOM 1319 C SER A 118 -6.749 -2.869 -9.716 1.00 0.00 C ATOM 1320 O SER A 118 -6.248 -3.322 -10.752 1.00 0.00 O ATOM 1321 CB SER A 118 -8.924 -1.706 -10.243 1.00 0.00 C ATOM 1322 OG SER A 118 -9.698 -0.518 -10.121 1.00 0.00 O ATOM 0 H SER A 118 -7.300 -0.121 -11.287 1.00 0.00 H new ATOM 0 HA SER A 118 -7.545 -1.154 -8.692 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.889 -2.010 -11.289 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.408 -2.512 -9.692 1.00 0.00 H new ATOM 0 HG SER A 118 -10.639 -0.754 -9.980 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.648 -3.513 -8.549 1.00 0.00 N ATOM 1329 CA GLY A 119 -5.966 -4.803 -8.365 1.00 0.00 C ATOM 1330 C GLY A 119 -5.579 -5.083 -6.911 1.00 0.00 C ATOM 1331 O GLY A 119 -5.961 -4.327 -6.014 1.00 0.00 O ATOM 0 H GLY A 119 -7.046 -3.146 -7.685 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.615 -5.603 -8.721 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -5.068 -4.822 -8.983 1.00 0.00 H new ATOM 1335 N THR A 120 -4.825 -6.162 -6.677 1.00 0.00 N ATOM 1336 CA THR A 120 -4.303 -6.525 -5.347 1.00 0.00 C ATOM 1337 C THR A 120 -2.930 -5.908 -5.142 1.00 0.00 C ATOM 1338 O THR A 120 -2.096 -5.890 -6.047 1.00 0.00 O ATOM 1339 CB THR A 120 -4.219 -8.041 -5.135 1.00 0.00 C ATOM 1340 OG1 THR A 120 -5.395 -8.647 -5.634 1.00 0.00 O ATOM 1341 CG2 THR A 120 -4.093 -8.412 -3.652 1.00 0.00 C ATOM 0 H THR A 120 -4.555 -6.817 -7.410 1.00 0.00 H new ATOM 0 HA THR A 120 -5.008 -6.133 -4.614 1.00 0.00 H new ATOM 0 HB THR A 120 -3.331 -8.393 -5.660 1.00 0.00 H new ATOM 0 HG1 THR A 120 -5.345 -9.617 -5.502 1.00 0.00 H new ATOM 0 HG21 THR A 120 -4.037 -9.496 -3.552 1.00 0.00 H new ATOM 0 HG22 THR A 120 -3.190 -7.962 -3.240 1.00 0.00 H new ATOM 0 HG23 THR A 120 -4.963 -8.042 -3.109 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.692 -5.441 -3.924 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.450 -4.830 -3.462 1.00 0.00 C ATOM 1351 C TYR A 121 -1.037 -5.407 -2.098 1.00 0.00 C ATOM 1352 O TYR A 121 -1.877 -5.934 -1.361 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.652 -3.306 -3.346 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.765 -2.555 -4.662 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.956 -2.592 -5.417 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.677 -1.789 -5.122 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -3.038 -1.914 -6.647 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.771 -1.072 -6.329 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.945 -1.145 -7.104 1.00 0.00 C ATOM 1360 OH TYR A 121 -2.010 -0.483 -8.293 1.00 0.00 O ATOM 0 H TYR A 121 -3.399 -5.480 -3.190 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.658 -5.046 -4.179 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.555 -3.121 -2.764 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.818 -2.889 -2.781 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.809 -3.143 -5.049 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.235 -1.752 -4.545 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -3.937 -1.982 -7.242 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.058 -0.465 -6.662 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.945 -0.413 -8.578 1.00 0.00 H new ATOM 1370 N LEU A 122 0.242 -5.269 -1.733 1.00 0.00 N ATOM 1371 CA LEU A 122 0.780 -5.684 -0.433 1.00 0.00 C ATOM 1372 C LEU A 122 2.050 -4.921 -0.049 1.00 0.00 C ATOM 1373 O LEU A 122 2.847 -4.526 -0.898 1.00 0.00 O ATOM 1374 CB LEU A 122 0.976 -7.215 -0.339 1.00 0.00 C ATOM 1375 CG LEU A 122 2.082 -7.850 -1.209 1.00 0.00 C ATOM 1376 CD1 LEU A 122 2.366 -9.270 -0.697 1.00 0.00 C ATOM 1377 CD2 LEU A 122 1.688 -7.935 -2.691 1.00 0.00 C ATOM 0 H LEU A 122 0.946 -4.857 -2.345 1.00 0.00 H new ATOM 0 HA LEU A 122 0.023 -5.416 0.304 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.183 -7.464 0.702 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.030 -7.691 -0.598 1.00 0.00 H new ATOM 0 HG LEU A 122 2.964 -7.214 -1.133 1.00 0.00 H new ATOM 0 HD11 LEU A 122 3.146 -9.727 -1.306 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.696 -9.223 0.341 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.458 -9.869 -0.762 1.00 0.00 H new ATOM 0 HD21 LEU A 122 2.501 -8.389 -3.258 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.789 -8.543 -2.794 1.00 0.00 H new ATOM 0 HD23 LEU A 122 1.494 -6.933 -3.074 1.00 0.00 H new ATOM 1389 N CYS A 123 2.236 -4.746 1.256 1.00 0.00 N ATOM 1390 CA CYS A 123 3.436 -4.169 1.867 1.00 0.00 C ATOM 1391 C CYS A 123 4.481 -5.265 2.182 1.00 0.00 C ATOM 1392 O CYS A 123 4.139 -6.444 2.308 1.00 0.00 O ATOM 1393 CB CYS A 123 2.969 -3.409 3.115 1.00 0.00 C ATOM 1394 SG CYS A 123 4.190 -2.389 3.970 1.00 0.00 S ATOM 0 H CYS A 123 1.532 -5.011 1.945 1.00 0.00 H new ATOM 0 HA CYS A 123 3.942 -3.483 1.188 1.00 0.00 H new ATOM 0 HB2 CYS A 123 2.136 -2.768 2.827 1.00 0.00 H new ATOM 0 HB3 CYS A 123 2.580 -4.137 3.827 1.00 0.00 H new ATOM 1399 N GLY A 124 5.754 -4.890 2.324 1.00 0.00 N ATOM 1400 CA GLY A 124 6.863 -5.762 2.742 1.00 0.00 C ATOM 1401 C GLY A 124 7.943 -4.999 3.508 1.00 0.00 C ATOM 1402 O GLY A 124 7.937 -3.768 3.518 1.00 0.00 O ATOM 0 H GLY A 124 6.057 -3.933 2.145 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.475 -6.565 3.369 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.306 -6.230 1.863 1.00 0.00 H new ATOM 1406 N ALA A 125 8.901 -5.711 4.107 1.00 0.00 N ATOM 1407 CA ALA A 125 10.067 -5.103 4.757 1.00 0.00 C ATOM 1408 C ALA A 125 11.272 -6.043 4.869 1.00 0.00 C ATOM 1409 O ALA A 125 11.126 -7.262 4.868 1.00 0.00 O ATOM 1410 CB ALA A 125 9.687 -4.590 6.152 1.00 0.00 C ATOM 0 H ALA A 125 8.890 -6.730 4.155 1.00 0.00 H new ATOM 0 HA ALA A 125 10.372 -4.277 4.115 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.560 -4.141 6.625 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.898 -3.843 6.063 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.332 -5.421 6.761 1.00 0.00 H new ATOM 1416 N ILE A 126 12.461 -5.466 5.040 1.00 0.00 N ATOM 1417 CA ILE A 126 13.730 -6.166 5.290 1.00 0.00 C ATOM 1418 C ILE A 126 14.564 -5.387 6.317 1.00 0.00 C ATOM 1419 O ILE A 126 14.652 -4.161 6.248 1.00 0.00 O ATOM 1420 CB ILE A 126 14.475 -6.395 3.952 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.720 -7.279 4.151 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.865 -5.081 3.252 1.00 0.00 C ATOM 1423 CD1 ILE A 126 16.354 -7.767 2.843 1.00 0.00 C ATOM 0 H ILE A 126 12.576 -4.453 5.007 1.00 0.00 H new ATOM 0 HA ILE A 126 13.540 -7.149 5.720 1.00 0.00 H new ATOM 0 HB ILE A 126 13.772 -6.913 3.300 1.00 0.00 H new ATOM 0 HG12 ILE A 126 16.464 -6.718 4.717 1.00 0.00 H new ATOM 0 HG13 ILE A 126 15.446 -8.144 4.755 1.00 0.00 H new ATOM 0 HG21 ILE A 126 15.384 -5.305 2.320 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.966 -4.503 3.037 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.521 -4.503 3.903 1.00 0.00 H new ATOM 0 HD11 ILE A 126 17.225 -8.383 3.068 1.00 0.00 H new ATOM 0 HD12 ILE A 126 15.627 -8.357 2.284 1.00 0.00 H new ATOM 0 HD13 ILE A 126 16.661 -6.909 2.245 1.00 0.00 H new ATOM 1435 N SER A 127 15.152 -6.078 7.289 1.00 0.00 N ATOM 1436 CA SER A 127 15.976 -5.460 8.343 1.00 0.00 C ATOM 1437 C SER A 127 17.312 -4.904 7.809 1.00 0.00 C ATOM 1438 O SER A 127 17.784 -5.294 6.738 1.00 0.00 O ATOM 1439 CB SER A 127 16.217 -6.456 9.484 1.00 0.00 C ATOM 1440 OG SER A 127 14.985 -6.975 9.975 1.00 0.00 O ATOM 0 H SER A 127 15.074 -7.091 7.375 1.00 0.00 H new ATOM 0 HA SER A 127 15.417 -4.606 8.726 1.00 0.00 H new ATOM 0 HB2 SER A 127 16.846 -7.274 9.131 1.00 0.00 H new ATOM 0 HB3 SER A 127 16.757 -5.964 10.293 1.00 0.00 H new ATOM 0 HG SER A 127 15.163 -7.609 10.701 1.00 0.00 H new ATOM 1446 N LEU A 128 17.946 -3.996 8.563 1.00 0.00 N ATOM 1447 CA LEU A 128 19.155 -3.272 8.130 1.00 0.00 C ATOM 1448 C LEU A 128 20.417 -4.140 7.948 1.00 0.00 C ATOM 1449 O LEU A 128 21.381 -3.697 7.321 1.00 0.00 O ATOM 1450 CB LEU A 128 19.372 -2.050 9.056 1.00 0.00 C ATOM 1451 CG LEU A 128 20.015 -2.217 10.457 1.00 0.00 C ATOM 1452 CD1 LEU A 128 19.468 -3.376 11.298 1.00 0.00 C ATOM 1453 CD2 LEU A 128 21.549 -2.307 10.413 1.00 0.00 C ATOM 0 H LEU A 128 17.634 -3.739 9.499 1.00 0.00 H new ATOM 0 HA LEU A 128 18.973 -2.924 7.113 1.00 0.00 H new ATOM 0 HB2 LEU A 128 19.985 -1.337 8.506 1.00 0.00 H new ATOM 0 HB3 LEU A 128 18.398 -1.584 9.205 1.00 0.00 H new ATOM 0 HG LEU A 128 19.720 -1.295 10.957 1.00 0.00 H new ATOM 0 HD11 LEU A 128 19.984 -3.404 12.258 1.00 0.00 H new ATOM 0 HD12 LEU A 128 18.400 -3.233 11.464 1.00 0.00 H new ATOM 0 HD13 LEU A 128 19.630 -4.316 10.771 1.00 0.00 H new ATOM 0 HD21 LEU A 128 21.936 -2.423 11.425 1.00 0.00 H new ATOM 0 HD22 LEU A 128 21.846 -3.165 9.811 1.00 0.00 H new ATOM 0 HD23 LEU A 128 21.954 -1.396 9.972 1.00 0.00 H new ATOM 1465 N ALA A 129 20.425 -5.364 8.487 1.00 0.00 N ATOM 1466 CA ALA A 129 21.565 -6.286 8.452 1.00 0.00 C ATOM 1467 C ALA A 129 21.704 -7.003 7.086 1.00 0.00 C ATOM 1468 O ALA A 129 20.685 -7.297 6.451 1.00 0.00 O ATOM 1469 CB ALA A 129 21.397 -7.284 9.608 1.00 0.00 C ATOM 0 H ALA A 129 19.616 -5.751 8.973 1.00 0.00 H new ATOM 0 HA ALA A 129 22.491 -5.724 8.575 1.00 0.00 H new ATOM 0 HB1 ALA A 129 22.232 -7.985 9.608 1.00 0.00 H new ATOM 0 HB2 ALA A 129 21.376 -6.744 10.555 1.00 0.00 H new ATOM 0 HB3 ALA A 129 20.463 -7.832 9.483 1.00 0.00 H new ATOM 1475 N PRO A 130 22.931 -7.357 6.644 1.00 0.00 N ATOM 1476 CA PRO A 130 23.157 -8.031 5.362 1.00 0.00 C ATOM 1477 C PRO A 130 22.598 -9.465 5.327 1.00 0.00 C ATOM 1478 O PRO A 130 22.308 -9.978 4.248 1.00 0.00 O ATOM 1479 CB PRO A 130 24.675 -8.008 5.157 1.00 0.00 C ATOM 1480 CG PRO A 130 25.230 -7.973 6.579 1.00 0.00 C ATOM 1481 CD PRO A 130 24.200 -7.122 7.321 1.00 0.00 C ATOM 0 HA PRO A 130 22.627 -7.520 4.558 1.00 0.00 H new ATOM 0 HB2 PRO A 130 25.019 -8.888 4.614 1.00 0.00 H new ATOM 0 HB3 PRO A 130 24.989 -7.136 4.583 1.00 0.00 H new ATOM 0 HG2 PRO A 130 25.313 -8.972 7.006 1.00 0.00 H new ATOM 0 HG3 PRO A 130 26.224 -7.528 6.615 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.141 -7.406 8.372 1.00 0.00 H new ATOM 0 HD3 PRO A 130 24.470 -6.066 7.291 1.00 0.00 H new ATOM 1489 N LYS A 131 22.409 -10.105 6.489 1.00 0.00 N ATOM 1490 CA LYS A 131 21.809 -11.444 6.618 1.00 0.00 C ATOM 1491 C LYS A 131 20.264 -11.472 6.524 1.00 0.00 C ATOM 1492 O LYS A 131 19.664 -12.550 6.598 1.00 0.00 O ATOM 1493 CB LYS A 131 22.327 -12.087 7.922 1.00 0.00 C ATOM 1494 CG LYS A 131 21.826 -11.394 9.205 1.00 0.00 C ATOM 1495 CD LYS A 131 22.436 -11.991 10.483 1.00 0.00 C ATOM 1496 CE LYS A 131 22.014 -13.451 10.704 1.00 0.00 C ATOM 1497 NZ LYS A 131 22.570 -14.000 11.969 1.00 0.00 N1+ ATOM 0 H LYS A 131 22.674 -9.699 7.386 1.00 0.00 H new ATOM 0 HA LYS A 131 22.125 -12.031 5.756 1.00 0.00 H new ATOM 0 HB2 LYS A 131 22.023 -13.134 7.944 1.00 0.00 H new ATOM 0 HB3 LYS A 131 23.417 -12.071 7.915 1.00 0.00 H new ATOM 0 HG2 LYS A 131 22.066 -10.332 9.156 1.00 0.00 H new ATOM 0 HG3 LYS A 131 20.740 -11.474 9.255 1.00 0.00 H new ATOM 0 HD2 LYS A 131 23.523 -11.934 10.425 1.00 0.00 H new ATOM 0 HD3 LYS A 131 22.131 -11.393 11.342 1.00 0.00 H new ATOM 0 HE2 LYS A 131 20.926 -13.516 10.727 1.00 0.00 H new ATOM 0 HE3 LYS A 131 22.352 -14.058 9.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 22.263 -14.987 12.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 23.609 -13.962 11.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 22.227 -13.436 12.773 1.00 0.00 H new ATOM 1511 N ALA A 132 19.607 -10.312 6.399 1.00 0.00 N ATOM 1512 CA ALA A 132 18.148 -10.180 6.335 1.00 0.00 C ATOM 1513 C ALA A 132 17.540 -10.735 5.026 1.00 0.00 C ATOM 1514 O ALA A 132 18.242 -10.988 4.044 1.00 0.00 O ATOM 1515 CB ALA A 132 17.793 -8.702 6.556 1.00 0.00 C ATOM 0 H ALA A 132 20.090 -9.416 6.338 1.00 0.00 H new ATOM 0 HA ALA A 132 17.706 -10.792 7.121 1.00 0.00 H new ATOM 0 HB1 ALA A 132 16.711 -8.577 6.513 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.156 -8.383 7.533 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.259 -8.096 5.779 1.00 0.00 H new ATOM 1521 N GLN A 133 16.213 -10.880 5.007 1.00 0.00 N ATOM 1522 CA GLN A 133 15.400 -11.260 3.848 1.00 0.00 C ATOM 1523 C GLN A 133 14.033 -10.558 3.933 1.00 0.00 C ATOM 1524 O GLN A 133 13.642 -10.083 5.002 1.00 0.00 O ATOM 1525 CB GLN A 133 15.267 -12.792 3.763 1.00 0.00 C ATOM 1526 CG GLN A 133 14.552 -13.439 4.968 1.00 0.00 C ATOM 1527 CD GLN A 133 14.427 -14.965 4.865 1.00 0.00 C ATOM 1528 OE1 GLN A 133 14.836 -15.611 3.905 1.00 0.00 O ATOM 1529 NE2 GLN A 133 13.852 -15.612 5.860 1.00 0.00 N ATOM 0 H GLN A 133 15.647 -10.728 5.842 1.00 0.00 H new ATOM 0 HA GLN A 133 15.888 -10.935 2.929 1.00 0.00 H new ATOM 0 HB2 GLN A 133 14.723 -13.047 2.854 1.00 0.00 H new ATOM 0 HB3 GLN A 133 16.263 -13.226 3.671 1.00 0.00 H new ATOM 0 HG2 GLN A 133 15.096 -13.189 5.879 1.00 0.00 H new ATOM 0 HG3 GLN A 133 13.556 -13.007 5.063 1.00 0.00 H new ATOM 0 HE21 GLN A 133 13.504 -15.098 6.669 1.00 0.00 H new ATOM 0 HE22 GLN A 133 13.756 -16.627 5.820 1.00 0.00 H new ATOM 1538 N ILE A 134 13.304 -10.463 2.815 1.00 0.00 N ATOM 1539 CA ILE A 134 12.037 -9.711 2.764 1.00 0.00 C ATOM 1540 C ILE A 134 10.891 -10.513 3.400 1.00 0.00 C ATOM 1541 O ILE A 134 10.513 -11.583 2.915 1.00 0.00 O ATOM 1542 CB ILE A 134 11.677 -9.239 1.331 1.00 0.00 C ATOM 1543 CG1 ILE A 134 12.865 -8.502 0.666 1.00 0.00 C ATOM 1544 CG2 ILE A 134 10.426 -8.333 1.387 1.00 0.00 C ATOM 1545 CD1 ILE A 134 12.560 -7.903 -0.711 1.00 0.00 C ATOM 0 H ILE A 134 13.567 -10.897 1.930 1.00 0.00 H new ATOM 0 HA ILE A 134 12.184 -8.807 3.355 1.00 0.00 H new ATOM 0 HB ILE A 134 11.458 -10.114 0.719 1.00 0.00 H new ATOM 0 HG12 ILE A 134 13.196 -7.703 1.329 1.00 0.00 H new ATOM 0 HG13 ILE A 134 13.697 -9.199 0.567 1.00 0.00 H new ATOM 0 HG21 ILE A 134 10.172 -8.001 0.380 1.00 0.00 H new ATOM 0 HG22 ILE A 134 9.590 -8.893 1.806 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.633 -7.466 2.014 1.00 0.00 H new ATOM 0 HD11 ILE A 134 13.451 -7.407 -1.098 1.00 0.00 H new ATOM 0 HD12 ILE A 134 12.261 -8.697 -1.395 1.00 0.00 H new ATOM 0 HD13 ILE A 134 11.751 -7.178 -0.621 1.00 0.00 H new ATOM 1557 N LYS A 135 10.301 -9.961 4.461 1.00 0.00 N ATOM 1558 CA LYS A 135 9.054 -10.424 5.072 1.00 0.00 C ATOM 1559 C LYS A 135 7.862 -9.713 4.405 1.00 0.00 C ATOM 1560 O LYS A 135 7.844 -8.483 4.306 1.00 0.00 O ATOM 1561 CB LYS A 135 9.130 -10.169 6.590 1.00 0.00 C ATOM 1562 CG LYS A 135 7.864 -10.633 7.335 1.00 0.00 C ATOM 1563 CD LYS A 135 8.055 -10.687 8.860 1.00 0.00 C ATOM 1564 CE LYS A 135 8.357 -9.314 9.479 1.00 0.00 C ATOM 1565 NZ LYS A 135 8.620 -9.423 10.939 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.693 -9.148 4.937 1.00 0.00 H new ATOM 0 HA LYS A 135 8.910 -11.494 4.920 1.00 0.00 H new ATOM 0 HB2 LYS A 135 9.997 -10.688 6.998 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.282 -9.104 6.768 1.00 0.00 H new ATOM 0 HG2 LYS A 135 7.042 -9.957 7.100 1.00 0.00 H new ATOM 0 HG3 LYS A 135 7.577 -11.621 6.974 1.00 0.00 H new ATOM 0 HD2 LYS A 135 7.154 -11.095 9.319 1.00 0.00 H new ATOM 0 HD3 LYS A 135 8.870 -11.372 9.094 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.222 -8.872 8.984 1.00 0.00 H new ATOM 0 HE3 LYS A 135 7.515 -8.643 9.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 8.820 -8.479 11.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 7.785 -9.822 11.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 9.439 -10.044 11.099 1.00 0.00 H new ATOM 1579 N GLU A 136 6.872 -10.478 3.945 1.00 0.00 N ATOM 1580 CA GLU A 136 5.653 -9.962 3.310 1.00 0.00 C ATOM 1581 C GLU A 136 4.581 -9.642 4.363 1.00 0.00 C ATOM 1582 O GLU A 136 4.452 -10.338 5.370 1.00 0.00 O ATOM 1583 CB GLU A 136 5.108 -10.989 2.302 1.00 0.00 C ATOM 1584 CG GLU A 136 6.031 -11.169 1.088 1.00 0.00 C ATOM 1585 CD GLU A 136 5.580 -12.355 0.219 1.00 0.00 C ATOM 1586 OE1 GLU A 136 5.868 -13.519 0.587 1.00 0.00 O ATOM 1587 OE2 GLU A 136 4.950 -12.134 -0.841 1.00 0.00 O1- ATOM 0 H GLU A 136 6.893 -11.496 4.003 1.00 0.00 H new ATOM 0 HA GLU A 136 5.905 -9.041 2.784 1.00 0.00 H new ATOM 0 HB2 GLU A 136 4.978 -11.949 2.801 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.123 -10.671 1.961 1.00 0.00 H new ATOM 0 HG2 GLU A 136 6.033 -10.257 0.491 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.054 -11.331 1.426 1.00 0.00 H new ATOM 1594 N SER A 137 3.791 -8.599 4.122 1.00 0.00 N ATOM 1595 CA SER A 137 2.613 -8.247 4.924 1.00 0.00 C ATOM 1596 C SER A 137 1.309 -8.834 4.337 1.00 0.00 C ATOM 1597 O SER A 137 1.324 -9.697 3.451 1.00 0.00 O ATOM 1598 CB SER A 137 2.541 -6.718 5.034 1.00 0.00 C ATOM 1599 OG SER A 137 1.709 -6.322 6.110 1.00 0.00 O ATOM 0 H SER A 137 3.952 -7.957 3.346 1.00 0.00 H new ATOM 0 HA SER A 137 2.715 -8.685 5.917 1.00 0.00 H new ATOM 0 HB2 SER A 137 3.543 -6.313 5.177 1.00 0.00 H new ATOM 0 HB3 SER A 137 2.159 -6.301 4.102 1.00 0.00 H new ATOM 0 HG SER A 137 1.921 -5.400 6.365 1.00 0.00 H new ATOM 1605 N LEU A 138 0.160 -8.355 4.826 1.00 0.00 N ATOM 1606 CA LEU A 138 -1.176 -8.692 4.332 1.00 0.00 C ATOM 1607 C LEU A 138 -1.418 -8.131 2.918 1.00 0.00 C ATOM 1608 O LEU A 138 -0.852 -7.105 2.529 1.00 0.00 O ATOM 1609 CB LEU A 138 -2.226 -8.164 5.336 1.00 0.00 C ATOM 1610 CG LEU A 138 -2.531 -9.065 6.555 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -3.340 -10.304 6.139 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -1.288 -9.508 7.342 1.00 0.00 C ATOM 0 H LEU A 138 0.136 -7.698 5.606 1.00 0.00 H new ATOM 0 HA LEU A 138 -1.264 -9.775 4.252 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -1.889 -7.195 5.704 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -3.158 -7.993 4.797 1.00 0.00 H new ATOM 0 HG LEU A 138 -3.119 -8.438 7.225 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.540 -10.919 7.016 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -4.284 -9.990 5.694 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -2.771 -10.883 5.412 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.592 -10.136 8.179 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -0.625 -10.073 6.687 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -0.764 -8.630 7.719 1.00 0.00 H new ATOM 1624 N ARG A 139 -2.299 -8.798 2.164 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.802 -8.359 0.857 1.00 0.00 C ATOM 1626 C ARG A 139 -4.082 -7.528 1.014 1.00 0.00 C ATOM 1627 O ARG A 139 -4.904 -7.798 1.895 1.00 0.00 O ATOM 1628 CB ARG A 139 -3.059 -9.590 -0.027 1.00 0.00 C ATOM 1629 CG ARG A 139 -1.742 -10.201 -0.537 1.00 0.00 C ATOM 1630 CD ARG A 139 -1.893 -11.661 -0.987 1.00 0.00 C ATOM 1631 NE ARG A 139 -2.785 -11.804 -2.153 1.00 0.00 N ATOM 1632 CZ ARG A 139 -4.006 -12.326 -2.188 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -4.622 -12.758 -1.107 1.00 0.00 N1+ ATOM 1634 NH2 ARG A 139 -4.634 -12.423 -3.339 1.00 0.00 N ATOM 0 H ARG A 139 -2.696 -9.691 2.458 1.00 0.00 H new ATOM 0 HA ARG A 139 -2.053 -7.725 0.382 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -3.613 -10.338 0.540 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -3.683 -9.307 -0.875 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -1.371 -9.606 -1.371 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -0.992 -10.145 0.252 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -0.911 -12.065 -1.233 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -2.284 -12.254 -0.160 1.00 0.00 H new ATOM 0 HE ARG A 139 -2.420 -11.460 -3.041 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -4.161 -12.698 -0.199 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -5.560 -13.152 -1.178 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -4.183 -12.099 -4.195 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -5.572 -12.822 -3.376 1.00 0.00 H new ATOM 1648 N ALA A 140 -4.269 -6.544 0.135 1.00 0.00 N ATOM 1649 CA ALA A 140 -5.433 -5.657 0.094 1.00 0.00 C ATOM 1650 C ALA A 140 -5.841 -5.316 -1.347 1.00 0.00 C ATOM 1651 O ALA A 140 -4.998 -5.255 -2.241 1.00 0.00 O ATOM 1652 CB ALA A 140 -5.096 -4.382 0.871 1.00 0.00 C ATOM 0 H ALA A 140 -3.589 -6.334 -0.596 1.00 0.00 H new ATOM 0 HA ALA A 140 -6.282 -6.166 0.550 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.952 -3.707 0.852 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.858 -4.637 1.904 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -4.238 -3.892 0.411 1.00 0.00 H new ATOM 1658 N GLU A 141 -7.132 -5.074 -1.568 1.00 0.00 N ATOM 1659 CA GLU A 141 -7.693 -4.675 -2.858 1.00 0.00 C ATOM 1660 C GLU A 141 -7.781 -3.151 -2.994 1.00 0.00 C ATOM 1661 O GLU A 141 -8.310 -2.464 -2.117 1.00 0.00 O ATOM 1662 CB GLU A 141 -9.114 -5.233 -3.022 1.00 0.00 C ATOM 1663 CG GLU A 141 -9.196 -6.762 -3.089 1.00 0.00 C ATOM 1664 CD GLU A 141 -10.633 -7.229 -3.385 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -11.273 -6.705 -4.330 1.00 0.00 O ATOM 1666 OE2 GLU A 141 -11.133 -8.136 -2.678 1.00 0.00 O1- ATOM 0 H GLU A 141 -7.836 -5.152 -0.834 1.00 0.00 H new ATOM 0 HA GLU A 141 -7.026 -5.074 -3.622 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -9.725 -4.886 -2.189 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -9.550 -4.819 -3.931 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -8.524 -7.131 -3.863 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -8.859 -7.189 -2.144 1.00 0.00 H new ATOM 1673 N LEU A 142 -7.319 -2.636 -4.134 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.556 -1.273 -4.602 1.00 0.00 C ATOM 1675 C LEU A 142 -8.616 -1.360 -5.699 1.00 0.00 C ATOM 1676 O LEU A 142 -8.444 -2.103 -6.668 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.245 -0.670 -5.140 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.393 0.735 -5.762 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -6.998 1.767 -4.799 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.015 1.219 -6.223 1.00 0.00 C ATOM 0 H LEU A 142 -6.747 -3.179 -4.781 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.901 -0.626 -3.795 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.523 -0.618 -4.325 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.831 -1.344 -5.890 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.084 0.646 -6.600 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.074 2.732 -5.300 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.991 1.439 -4.491 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.359 1.863 -3.921 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.107 2.211 -6.665 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.340 1.263 -5.368 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.616 0.527 -6.965 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.692 -0.590 -5.556 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.817 -0.566 -6.486 1.00 0.00 C ATOM 1694 C ARG A 143 -11.099 0.883 -6.890 1.00 0.00 C ATOM 1695 O ARG A 143 -11.537 1.695 -6.074 1.00 0.00 O ATOM 1696 CB ARG A 143 -12.006 -1.264 -5.801 1.00 0.00 C ATOM 1697 CG ARG A 143 -13.096 -1.692 -6.792 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.217 -2.492 -6.108 1.00 0.00 C ATOM 1699 NE ARG A 143 -13.744 -3.780 -5.555 1.00 0.00 N ATOM 1700 CZ ARG A 143 -14.463 -4.636 -4.837 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -15.735 -4.419 -4.565 1.00 0.00 N ATOM 1702 NH2 ARG A 143 -13.916 -5.738 -4.371 1.00 0.00 N1+ ATOM 0 H ARG A 143 -9.808 0.050 -4.771 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.607 -1.105 -7.410 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.646 -2.141 -5.263 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.439 -0.591 -5.060 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.520 -0.808 -7.268 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -12.650 -2.296 -7.582 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.647 -1.893 -5.306 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -15.014 -2.681 -6.827 1.00 0.00 H new ATOM 0 HE ARG A 143 -12.774 -4.035 -5.743 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.193 -3.575 -4.909 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -16.261 -5.095 -4.011 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -12.934 -5.940 -4.560 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -14.474 -6.391 -3.820 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.807 1.223 -8.141 1.00 0.00 N ATOM 1717 CA VAL A 144 -11.052 2.556 -8.705 1.00 0.00 C ATOM 1718 C VAL A 144 -12.308 2.497 -9.578 1.00 0.00 C ATOM 1719 O VAL A 144 -12.359 1.741 -10.548 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.845 3.088 -9.507 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -10.104 4.552 -9.893 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.527 3.001 -8.716 1.00 0.00 C ATOM 0 H VAL A 144 -10.387 0.574 -8.806 1.00 0.00 H new ATOM 0 HA VAL A 144 -11.201 3.257 -7.884 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.738 2.462 -10.393 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -9.255 4.934 -10.460 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -11.005 4.613 -10.503 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -10.236 5.148 -8.990 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.710 3.388 -9.326 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.610 3.592 -7.804 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -8.326 1.961 -8.457 1.00 0.00 H new ATOM 1732 N THR A 145 -13.319 3.289 -9.215 1.00 0.00 N ATOM 1733 CA THR A 145 -14.601 3.431 -9.917 1.00 0.00 C ATOM 1734 C THR A 145 -14.530 4.602 -10.898 1.00 0.00 C ATOM 1735 O THR A 145 -13.807 5.569 -10.661 1.00 0.00 O ATOM 1736 CB THR A 145 -15.746 3.592 -8.899 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.597 4.785 -8.159 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.802 2.418 -7.917 1.00 0.00 C ATOM 0 H THR A 145 -13.266 3.878 -8.384 1.00 0.00 H new ATOM 0 HA THR A 145 -14.806 2.531 -10.496 1.00 0.00 H new ATOM 0 HB THR A 145 -16.672 3.622 -9.474 1.00 0.00 H new ATOM 0 HG1 THR A 145 -14.821 4.707 -7.565 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.623 2.569 -7.216 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.961 1.491 -8.467 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.862 2.358 -7.368 1.00 0.00 H new ATOM 1746 N GLU A 146 -15.238 4.519 -12.024 1.00 0.00 N ATOM 1747 CA GLU A 146 -15.254 5.564 -13.057 1.00 0.00 C ATOM 1748 C GLU A 146 -15.706 6.931 -12.509 1.00 0.00 C ATOM 1749 O GLU A 146 -16.493 7.023 -11.561 1.00 0.00 O ATOM 1750 CB GLU A 146 -16.060 5.153 -14.304 1.00 0.00 C ATOM 1751 CG GLU A 146 -17.537 4.803 -14.065 1.00 0.00 C ATOM 1752 CD GLU A 146 -17.783 3.422 -13.425 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -16.825 2.623 -13.276 1.00 0.00 O ATOM 1754 OE2 GLU A 146 -18.948 3.130 -13.069 1.00 0.00 O1- ATOM 0 H GLU A 146 -15.825 3.716 -12.251 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.219 5.680 -13.377 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -16.012 5.967 -15.028 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -15.572 4.292 -14.760 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -17.977 5.567 -13.425 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -18.064 4.844 -15.018 1.00 0.00 H new ATOM 1761 N ARG A 147 -15.195 8.006 -13.122 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.301 9.373 -12.606 1.00 0.00 C ATOM 1763 C ARG A 147 -16.758 9.836 -12.582 1.00 0.00 C ATOM 1764 O ARG A 147 -17.418 9.925 -13.623 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.365 10.326 -13.365 1.00 0.00 C ATOM 1766 CG ARG A 147 -14.217 11.657 -12.610 1.00 0.00 C ATOM 1767 CD ARG A 147 -13.033 12.475 -13.142 1.00 0.00 C ATOM 1768 NE ARG A 147 -12.941 13.786 -12.475 1.00 0.00 N ATOM 1769 CZ ARG A 147 -12.425 14.045 -11.276 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -11.897 13.113 -10.509 1.00 0.00 N ATOM 1771 NH2 ARG A 147 -12.435 15.280 -10.824 1.00 0.00 N1+ ATOM 0 H ARG A 147 -14.688 7.947 -14.005 1.00 0.00 H new ATOM 0 HA ARG A 147 -14.963 9.385 -11.570 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.387 9.861 -13.488 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -14.758 10.511 -14.365 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -15.135 12.237 -12.708 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -14.077 11.460 -11.547 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -12.107 11.921 -12.987 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -13.142 12.619 -14.217 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.314 14.584 -12.990 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.872 12.144 -10.827 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -11.513 13.360 -9.597 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -12.835 16.027 -11.391 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.042 15.490 -9.906 1.00 0.00 H new