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=-0.00935 K(o=0.021,f=-0.65) USER MOD Set 1.2: A 78 LYS NZ :NH3+ -148:sc= 0.0299 (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= -0.263 X(o=-0.26,f=-0.43) USER MOD Set 3.1: A 51 THR OG1 : rot 180:sc= 0.543 USER MOD Set 3.2: A 109 SER OG : rot 83:sc= 0.596 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 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= -0.69 K(o=-0.69,f=0) USER MOD Single : A 55 SER OG : rot -82:sc= 1.29 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 169:sc= -0.0018 (180deg=-0.113) USER MOD Single : A 71 SER OG : rot 180:sc= 0.357 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0.713 K(o=0.71,f=-4.9!) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 66:sc= 0.513 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 102 ASN : amide:sc=-0.00035 X(o=-0.00035,f=-0.45) USER MOD Single : A 108 MET CE :methyl -165:sc= -0.243 (180deg=-0.726) USER MOD Single : A 116 ASN : amide:sc= 0.76 K(o=0.76,f=0) USER MOD Single : A 118 SER OG : rot 18:sc= 0.833 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot 12:sc= 0.463 USER MOD Single : A 127 SER OG : rot 180:sc= 0.0121 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) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot -98:sc= 0.427 USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 0.869 -6.659 9.070 1.00 0.00 N ATOM 49 CA THR A 36 -0.487 -6.400 8.566 1.00 0.00 C ATOM 50 C THR A 36 -0.525 -5.239 7.574 1.00 0.00 C ATOM 51 O THR A 36 0.368 -4.386 7.558 1.00 0.00 O ATOM 52 CB THR A 36 -1.468 -6.230 9.735 1.00 0.00 C ATOM 53 OG1 THR A 36 -2.786 -6.244 9.230 1.00 0.00 O ATOM 54 CG2 THR A 36 -1.248 -4.948 10.541 1.00 0.00 C ATOM 0 HA THR A 36 -0.812 -7.270 7.996 1.00 0.00 H new ATOM 0 HB THR A 36 -1.293 -7.060 10.420 1.00 0.00 H new ATOM 0 HG1 THR A 36 -3.421 -6.138 9.969 1.00 0.00 H new ATOM 0 HG21 THR A 36 -1.977 -4.897 11.349 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.242 -4.950 10.960 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.368 -4.083 9.889 1.00 0.00 H new ATOM 62 N PHE A 37 -1.563 -5.250 6.734 1.00 0.00 N ATOM 63 CA PHE A 37 -1.804 -4.341 5.613 1.00 0.00 C ATOM 64 C PHE A 37 -3.321 -4.192 5.392 1.00 0.00 C ATOM 65 O PHE A 37 -4.015 -5.180 5.143 1.00 0.00 O ATOM 66 CB PHE A 37 -1.094 -4.898 4.369 1.00 0.00 C ATOM 67 CG PHE A 37 -1.217 -4.064 3.106 1.00 0.00 C ATOM 68 CD1 PHE A 37 -0.677 -2.766 3.075 1.00 0.00 C ATOM 69 CD2 PHE A 37 -1.818 -4.591 1.946 1.00 0.00 C ATOM 70 CE1 PHE A 37 -0.718 -2.005 1.894 1.00 0.00 C ATOM 71 CE2 PHE A 37 -1.873 -3.824 0.768 1.00 0.00 C ATOM 72 CZ PHE A 37 -1.327 -2.530 0.742 1.00 0.00 C ATOM 0 H PHE A 37 -2.307 -5.942 6.826 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.403 -3.349 5.822 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.036 -5.017 4.601 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.489 -5.893 4.164 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -0.228 -2.351 3.965 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -2.237 -5.586 1.961 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -0.282 -1.017 1.872 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -2.336 -4.231 -0.119 1.00 0.00 H new ATOM 0 HZ PHE A 37 -1.375 -1.940 -0.161 1.00 0.00 H new ATOM 82 N SER A 38 -3.855 -2.977 5.535 1.00 0.00 N ATOM 83 CA SER A 38 -5.304 -2.698 5.554 1.00 0.00 C ATOM 84 C SER A 38 -5.698 -1.398 4.808 1.00 0.00 C ATOM 85 O SER A 38 -4.838 -0.531 4.604 1.00 0.00 O ATOM 86 CB SER A 38 -5.788 -2.672 7.017 1.00 0.00 C ATOM 87 OG SER A 38 -5.199 -1.612 7.761 1.00 0.00 O ATOM 0 H SER A 38 -3.285 -2.138 5.644 1.00 0.00 H new ATOM 0 HA SER A 38 -5.801 -3.499 5.007 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.873 -2.568 7.037 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.550 -3.623 7.493 1.00 0.00 H new ATOM 0 HG SER A 38 -5.535 -1.632 8.681 1.00 0.00 H new ATOM 93 N PRO A 39 -6.978 -1.211 4.407 1.00 0.00 N ATOM 94 CA PRO A 39 -8.090 -2.168 4.468 1.00 0.00 C ATOM 95 C PRO A 39 -7.910 -3.305 3.457 1.00 0.00 C ATOM 96 O PRO A 39 -7.131 -3.179 2.518 1.00 0.00 O ATOM 97 CB PRO A 39 -9.344 -1.351 4.134 1.00 0.00 C ATOM 98 CG PRO A 39 -8.811 -0.281 3.184 1.00 0.00 C ATOM 99 CD PRO A 39 -7.427 0.017 3.757 1.00 0.00 C ATOM 0 HA PRO A 39 -8.151 -2.640 5.449 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.112 -1.964 3.662 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.790 -0.913 5.027 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.755 -0.643 2.157 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.445 0.605 3.176 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.736 0.314 2.968 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.471 0.840 4.470 1.00 0.00 H new ATOM 107 N ALA A 40 -8.659 -4.402 3.625 1.00 0.00 N ATOM 108 CA ALA A 40 -8.670 -5.524 2.675 1.00 0.00 C ATOM 109 C ALA A 40 -9.247 -5.154 1.290 1.00 0.00 C ATOM 110 O ALA A 40 -8.903 -5.792 0.292 1.00 0.00 O ATOM 111 CB ALA A 40 -9.449 -6.687 3.301 1.00 0.00 C ATOM 0 H ALA A 40 -9.276 -4.538 4.425 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.636 -5.813 2.488 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.466 -7.528 2.608 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.965 -6.991 4.229 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.470 -6.369 3.512 1.00 0.00 H new ATOM 117 N LEU A 41 -10.081 -4.109 1.220 1.00 0.00 N ATOM 118 CA LEU A 41 -10.578 -3.496 -0.013 1.00 0.00 C ATOM 119 C LEU A 41 -10.650 -1.976 0.185 1.00 0.00 C ATOM 120 O LEU A 41 -11.349 -1.496 1.080 1.00 0.00 O ATOM 121 CB LEU A 41 -11.950 -4.099 -0.385 1.00 0.00 C ATOM 122 CG LEU A 41 -12.695 -3.383 -1.537 1.00 0.00 C ATOM 123 CD1 LEU A 41 -11.933 -3.406 -2.870 1.00 0.00 C ATOM 124 CD2 LEU A 41 -14.074 -4.030 -1.734 1.00 0.00 C ATOM 0 H LEU A 41 -10.441 -3.650 2.057 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.901 -3.702 -0.842 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.807 -5.144 -0.661 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.586 -4.087 0.500 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.788 -2.337 -1.244 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.515 -2.886 -3.631 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.970 -2.910 -2.747 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.772 -4.439 -3.179 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.600 -3.526 -2.545 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.949 -5.084 -1.982 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.653 -3.939 -0.815 1.00 0.00 H new ATOM 136 N LEU A 42 -9.959 -1.230 -0.677 1.00 0.00 N ATOM 137 CA LEU A 42 -10.045 0.226 -0.786 1.00 0.00 C ATOM 138 C LEU A 42 -10.727 0.590 -2.111 1.00 0.00 C ATOM 139 O LEU A 42 -10.259 0.167 -3.167 1.00 0.00 O ATOM 140 CB LEU A 42 -8.615 0.796 -0.708 1.00 0.00 C ATOM 141 CG LEU A 42 -8.521 2.331 -0.799 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.261 3.036 0.347 1.00 0.00 C ATOM 143 CD2 LEU A 42 -7.047 2.752 -0.780 1.00 0.00 C ATOM 0 H LEU A 42 -9.301 -1.637 -1.342 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.639 0.651 0.023 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.162 0.474 0.230 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.022 0.362 -1.513 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.998 2.631 -1.732 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.163 4.116 0.234 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.316 2.763 0.321 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.830 2.730 1.301 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.978 3.838 -0.844 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.584 2.413 0.147 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.530 2.305 -1.629 1.00 0.00 H new ATOM 155 N VAL A 43 -11.794 1.391 -2.068 1.00 0.00 N ATOM 156 CA VAL A 43 -12.418 1.997 -3.259 1.00 0.00 C ATOM 157 C VAL A 43 -12.118 3.497 -3.294 1.00 0.00 C ATOM 158 O VAL A 43 -12.330 4.205 -2.311 1.00 0.00 O ATOM 159 CB VAL A 43 -13.930 1.682 -3.381 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.795 2.223 -2.229 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.488 2.166 -4.728 1.00 0.00 C ATOM 0 H VAL A 43 -12.259 1.644 -1.196 1.00 0.00 H new ATOM 0 HA VAL A 43 -11.972 1.539 -4.142 1.00 0.00 H new ATOM 0 HB VAL A 43 -13.993 0.596 -3.319 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.838 1.955 -2.400 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.458 1.790 -1.287 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.702 3.308 -2.183 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.551 1.932 -4.787 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -14.348 3.244 -4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.961 1.666 -5.541 1.00 0.00 H new ATOM 171 N VAL A 44 -11.610 3.958 -4.436 1.00 0.00 N ATOM 172 CA VAL A 44 -11.383 5.382 -4.750 1.00 0.00 C ATOM 173 C VAL A 44 -11.998 5.770 -6.097 1.00 0.00 C ATOM 174 O VAL A 44 -12.361 4.903 -6.891 1.00 0.00 O ATOM 175 CB VAL A 44 -9.882 5.750 -4.758 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.257 5.532 -3.375 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.094 4.993 -5.842 1.00 0.00 C ATOM 0 H VAL A 44 -11.334 3.337 -5.197 1.00 0.00 H new ATOM 0 HA VAL A 44 -11.875 5.942 -3.955 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.819 6.810 -5.005 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.200 5.798 -3.407 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.767 6.158 -2.643 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.359 4.485 -3.091 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.046 5.289 -5.803 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.175 3.920 -5.668 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.503 5.233 -6.823 1.00 0.00 H new ATOM 187 N THR A 45 -12.065 7.079 -6.367 1.00 0.00 N ATOM 188 CA THR A 45 -12.454 7.638 -7.667 1.00 0.00 C ATOM 189 C THR A 45 -11.219 7.842 -8.551 1.00 0.00 C ATOM 190 O THR A 45 -10.127 8.128 -8.063 1.00 0.00 O ATOM 191 CB THR A 45 -13.225 8.949 -7.466 1.00 0.00 C ATOM 192 OG1 THR A 45 -14.372 8.695 -6.682 1.00 0.00 O ATOM 193 CG2 THR A 45 -13.734 9.530 -8.782 1.00 0.00 C ATOM 0 H THR A 45 -11.846 7.794 -5.673 1.00 0.00 H new ATOM 0 HA THR A 45 -13.113 6.935 -8.177 1.00 0.00 H new ATOM 0 HB THR A 45 -12.535 9.650 -6.996 1.00 0.00 H new ATOM 0 HG1 THR A 45 -14.868 9.529 -6.548 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.273 10.457 -8.586 1.00 0.00 H new ATOM 0 HG22 THR A 45 -12.890 9.733 -9.441 1.00 0.00 H new ATOM 0 HG23 THR A 45 -14.404 8.815 -9.260 1.00 0.00 H new ATOM 201 N GLU A 46 -11.400 7.715 -9.861 1.00 0.00 N ATOM 202 CA GLU A 46 -10.394 7.950 -10.893 1.00 0.00 C ATOM 203 C GLU A 46 -9.827 9.379 -10.802 1.00 0.00 C ATOM 204 O GLU A 46 -10.551 10.367 -10.964 1.00 0.00 O ATOM 205 CB GLU A 46 -11.034 7.652 -12.259 1.00 0.00 C ATOM 206 CG GLU A 46 -10.021 7.592 -13.401 1.00 0.00 C ATOM 207 CD GLU A 46 -10.673 7.244 -14.747 1.00 0.00 C ATOM 208 OE1 GLU A 46 -11.785 7.735 -15.048 1.00 0.00 O1- ATOM 209 OE2 GLU A 46 -10.068 6.455 -15.510 1.00 0.00 O ATOM 0 H GLU A 46 -12.298 7.431 -10.253 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.541 7.287 -10.751 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.566 6.702 -12.204 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.775 8.420 -12.480 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.514 8.554 -13.484 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.258 6.849 -13.167 1.00 0.00 H new ATOM 216 N GLY A 47 -8.521 9.482 -10.528 1.00 0.00 N ATOM 217 CA GLY A 47 -7.796 10.736 -10.299 1.00 0.00 C ATOM 218 C GLY A 47 -7.717 11.171 -8.832 1.00 0.00 C ATOM 219 O GLY A 47 -7.203 12.255 -8.567 1.00 0.00 O ATOM 0 H GLY A 47 -7.918 8.662 -10.457 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.783 10.630 -10.688 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.277 11.528 -10.873 1.00 0.00 H new ATOM 223 N ASP A 48 -8.189 10.360 -7.880 1.00 0.00 N ATOM 224 CA ASP A 48 -8.046 10.593 -6.434 1.00 0.00 C ATOM 225 C ASP A 48 -6.853 9.819 -5.830 1.00 0.00 C ATOM 226 O ASP A 48 -6.388 8.816 -6.379 1.00 0.00 O ATOM 227 CB ASP A 48 -9.366 10.225 -5.730 1.00 0.00 C ATOM 228 CG ASP A 48 -9.461 10.695 -4.267 1.00 0.00 C ATOM 229 OD1 ASP A 48 -8.854 11.735 -3.913 1.00 0.00 O ATOM 230 OD2 ASP A 48 -10.179 10.032 -3.482 1.00 0.00 O1- ATOM 0 H ASP A 48 -8.694 9.501 -8.096 1.00 0.00 H new ATOM 0 HA ASP A 48 -7.832 11.650 -6.275 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.195 10.656 -6.291 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.489 9.142 -5.759 1.00 0.00 H new ATOM 235 N ASN A 49 -6.359 10.281 -4.680 1.00 0.00 N ATOM 236 CA ASN A 49 -5.325 9.618 -3.894 1.00 0.00 C ATOM 237 C ASN A 49 -5.878 8.366 -3.190 1.00 0.00 C ATOM 238 O ASN A 49 -6.919 8.420 -2.530 1.00 0.00 O ATOM 239 CB ASN A 49 -4.747 10.603 -2.864 1.00 0.00 C ATOM 240 CG ASN A 49 -4.176 11.854 -3.522 1.00 0.00 C ATOM 241 OD1 ASN A 49 -4.787 12.917 -3.525 1.00 0.00 O ATOM 242 ND2 ASN A 49 -3.001 11.762 -4.117 1.00 0.00 N ATOM 0 H ASN A 49 -6.679 11.154 -4.260 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.531 9.295 -4.568 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -5.528 10.889 -2.159 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -3.965 10.108 -2.289 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -2.599 12.577 -4.581 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -2.495 10.876 -4.113 1.00 0.00 H new ATOM 249 N ALA A 50 -5.158 7.249 -3.303 1.00 0.00 N ATOM 250 CA ALA A 50 -5.509 5.964 -2.681 1.00 0.00 C ATOM 251 C ALA A 50 -4.436 5.522 -1.679 1.00 0.00 C ATOM 252 O ALA A 50 -3.317 5.225 -2.104 1.00 0.00 O ATOM 253 CB ALA A 50 -5.688 4.920 -3.793 1.00 0.00 C ATOM 0 H ALA A 50 -4.293 7.208 -3.842 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.439 6.070 -2.123 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.949 3.959 -3.351 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.484 5.238 -4.466 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.758 4.821 -4.353 1.00 0.00 H new ATOM 259 N THR A 51 -4.758 5.463 -0.379 1.00 0.00 N ATOM 260 CA THR A 51 -3.785 5.172 0.688 1.00 0.00 C ATOM 261 C THR A 51 -4.217 3.986 1.544 1.00 0.00 C ATOM 262 O THR A 51 -5.306 3.989 2.120 1.00 0.00 O ATOM 263 CB THR A 51 -3.528 6.414 1.549 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.164 7.480 0.696 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.373 6.207 2.530 1.00 0.00 C ATOM 0 H THR A 51 -5.706 5.616 -0.034 1.00 0.00 H new ATOM 0 HA THR A 51 -2.847 4.894 0.207 1.00 0.00 H new ATOM 0 HB THR A 51 -4.438 6.620 2.113 1.00 0.00 H new ATOM 0 HG1 THR A 51 -2.997 8.284 1.230 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.228 7.113 3.118 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.606 5.376 3.196 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.461 5.984 1.976 1.00 0.00 H new ATOM 273 N PHE A 52 -3.326 2.999 1.650 1.00 0.00 N ATOM 274 CA PHE A 52 -3.397 1.855 2.562 1.00 0.00 C ATOM 275 C PHE A 52 -2.474 2.076 3.772 1.00 0.00 C ATOM 276 O PHE A 52 -1.494 2.820 3.682 1.00 0.00 O ATOM 277 CB PHE A 52 -2.955 0.584 1.819 1.00 0.00 C ATOM 278 CG PHE A 52 -3.861 0.122 0.695 1.00 0.00 C ATOM 279 CD1 PHE A 52 -3.682 0.621 -0.610 1.00 0.00 C ATOM 280 CD2 PHE A 52 -4.852 -0.849 0.942 1.00 0.00 C ATOM 281 CE1 PHE A 52 -4.489 0.150 -1.661 1.00 0.00 C ATOM 282 CE2 PHE A 52 -5.661 -1.314 -0.107 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.477 -0.817 -1.407 1.00 0.00 C ATOM 0 H PHE A 52 -2.488 2.975 1.069 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.424 1.748 2.912 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.959 0.754 1.410 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.868 -0.225 2.544 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -2.924 1.366 -0.804 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -4.989 -1.236 1.941 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.350 0.531 -2.662 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -6.424 -2.053 0.086 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.096 -1.179 -2.214 1.00 0.00 H new ATOM 293 N THR A 53 -2.748 1.378 4.877 1.00 0.00 N ATOM 294 CA THR A 53 -1.905 1.328 6.085 1.00 0.00 C ATOM 295 C THR A 53 -1.131 0.013 6.115 1.00 0.00 C ATOM 296 O THR A 53 -1.714 -1.036 5.851 1.00 0.00 O ATOM 297 CB THR A 53 -2.772 1.452 7.347 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.602 2.592 7.240 1.00 0.00 O ATOM 299 CG2 THR A 53 -1.923 1.612 8.612 1.00 0.00 C ATOM 0 H THR A 53 -3.591 0.811 4.963 1.00 0.00 H new ATOM 0 HA THR A 53 -1.203 2.161 6.061 1.00 0.00 H new ATOM 0 HB THR A 53 -3.359 0.537 7.426 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.156 2.670 8.045 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.576 1.696 9.480 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.275 0.743 8.728 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.312 2.511 8.529 1.00 0.00 H new ATOM 307 N CYS A 54 0.156 0.047 6.473 1.00 0.00 N ATOM 308 CA CYS A 54 0.990 -1.136 6.746 1.00 0.00 C ATOM 309 C CYS A 54 1.741 -1.010 8.084 1.00 0.00 C ATOM 310 O CYS A 54 2.221 0.073 8.428 1.00 0.00 O ATOM 311 CB CYS A 54 1.996 -1.361 5.607 1.00 0.00 C ATOM 312 SG CYS A 54 2.891 -2.928 5.797 1.00 0.00 S ATOM 0 H CYS A 54 0.665 0.924 6.585 1.00 0.00 H new ATOM 0 HA CYS A 54 0.321 -1.994 6.813 1.00 0.00 H new ATOM 0 HB2 CYS A 54 1.471 -1.356 4.652 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.708 -0.536 5.583 1.00 0.00 H new ATOM 317 N SER A 55 1.886 -2.115 8.825 1.00 0.00 N ATOM 318 CA SER A 55 2.474 -2.104 10.177 1.00 0.00 C ATOM 319 C SER A 55 3.386 -3.322 10.428 1.00 0.00 C ATOM 320 O SER A 55 2.960 -4.464 10.235 1.00 0.00 O ATOM 321 CB SER A 55 1.367 -2.081 11.253 1.00 0.00 C ATOM 322 OG SER A 55 0.259 -1.243 10.944 1.00 0.00 O ATOM 0 H SER A 55 1.601 -3.042 8.508 1.00 0.00 H new ATOM 0 HA SER A 55 3.080 -1.200 10.243 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.005 -3.098 11.406 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.802 -1.753 12.197 1.00 0.00 H new ATOM 0 HG SER A 55 0.475 -0.316 11.177 1.00 0.00 H new ATOM 328 N PHE A 56 4.625 -3.079 10.884 1.00 0.00 N ATOM 329 CA PHE A 56 5.633 -4.078 11.275 1.00 0.00 C ATOM 330 C PHE A 56 6.419 -3.691 12.543 1.00 0.00 C ATOM 331 O PHE A 56 6.624 -2.518 12.849 1.00 0.00 O ATOM 332 CB PHE A 56 6.671 -4.240 10.146 1.00 0.00 C ATOM 333 CG PHE A 56 6.295 -5.197 9.041 1.00 0.00 C ATOM 334 CD1 PHE A 56 5.458 -4.761 8.004 1.00 0.00 C ATOM 335 CD2 PHE A 56 6.827 -6.502 9.013 1.00 0.00 C ATOM 336 CE1 PHE A 56 5.170 -5.615 6.931 1.00 0.00 C ATOM 337 CE2 PHE A 56 6.529 -7.358 7.937 1.00 0.00 C ATOM 338 CZ PHE A 56 5.701 -6.914 6.892 1.00 0.00 C ATOM 0 H PHE A 56 4.970 -2.126 10.996 1.00 0.00 H new ATOM 0 HA PHE A 56 5.078 -4.996 11.470 1.00 0.00 H new ATOM 0 HB2 PHE A 56 6.857 -3.260 9.705 1.00 0.00 H new ATOM 0 HB3 PHE A 56 7.610 -4.574 10.587 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.035 -3.767 8.032 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.462 -6.844 9.816 1.00 0.00 H new ATOM 0 HE1 PHE A 56 4.535 -5.271 6.128 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.937 -8.358 7.914 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.474 -7.569 6.063 1.00 0.00 H new ATOM 424 N PHE A 63 14.237 -1.750 9.904 1.00 0.00 N ATOM 425 CA PHE A 63 13.946 -2.442 8.649 1.00 0.00 C ATOM 426 C PHE A 63 13.608 -1.476 7.498 1.00 0.00 C ATOM 427 O PHE A 63 13.250 -0.319 7.722 1.00 0.00 O ATOM 428 CB PHE A 63 12.793 -3.441 8.906 1.00 0.00 C ATOM 429 CG PHE A 63 11.537 -2.852 9.531 1.00 0.00 C ATOM 430 CD1 PHE A 63 10.568 -2.222 8.727 1.00 0.00 C ATOM 431 CD2 PHE A 63 11.335 -2.945 10.923 1.00 0.00 C ATOM 432 CE1 PHE A 63 9.414 -1.672 9.314 1.00 0.00 C ATOM 433 CE2 PHE A 63 10.177 -2.402 11.506 1.00 0.00 C ATOM 434 CZ PHE A 63 9.220 -1.758 10.703 1.00 0.00 C ATOM 0 HA PHE A 63 14.841 -2.973 8.325 1.00 0.00 H new ATOM 0 HB2 PHE A 63 12.521 -3.906 7.958 1.00 0.00 H new ATOM 0 HB3 PHE A 63 13.162 -4.234 9.556 1.00 0.00 H new ATOM 0 HD1 PHE A 63 10.711 -2.161 7.658 1.00 0.00 H new ATOM 0 HD2 PHE A 63 12.072 -3.435 11.543 1.00 0.00 H new ATOM 0 HE1 PHE A 63 8.676 -1.183 8.696 1.00 0.00 H new ATOM 0 HE2 PHE A 63 10.022 -2.480 12.572 1.00 0.00 H new ATOM 0 HZ PHE A 63 8.337 -1.330 11.153 1.00 0.00 H new ATOM 444 N VAL A 64 13.684 -1.984 6.264 1.00 0.00 N ATOM 445 CA VAL A 64 13.179 -1.326 5.048 1.00 0.00 C ATOM 446 C VAL A 64 11.790 -1.899 4.798 1.00 0.00 C ATOM 447 O VAL A 64 11.636 -3.119 4.720 1.00 0.00 O ATOM 448 CB VAL A 64 14.064 -1.573 3.797 1.00 0.00 C ATOM 449 CG1 VAL A 64 13.528 -0.799 2.580 1.00 0.00 C ATOM 450 CG2 VAL A 64 15.519 -1.141 4.054 1.00 0.00 C ATOM 0 H VAL A 64 14.111 -2.891 6.075 1.00 0.00 H new ATOM 0 HA VAL A 64 13.178 -0.248 5.206 1.00 0.00 H new ATOM 0 HB VAL A 64 14.034 -2.643 3.591 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.166 -0.990 1.717 1.00 0.00 H new ATOM 0 HG12 VAL A 64 12.512 -1.127 2.359 1.00 0.00 H new ATOM 0 HG13 VAL A 64 13.525 0.269 2.800 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.116 -1.325 3.161 1.00 0.00 H new ATOM 0 HG22 VAL A 64 15.546 -0.078 4.296 1.00 0.00 H new ATOM 0 HG23 VAL A 64 15.927 -1.713 4.888 1.00 0.00 H new ATOM 460 N LEU A 65 10.785 -1.029 4.687 1.00 0.00 N ATOM 461 CA LEU A 65 9.417 -1.414 4.349 1.00 0.00 C ATOM 462 C LEU A 65 9.134 -1.105 2.879 1.00 0.00 C ATOM 463 O LEU A 65 9.470 -0.029 2.393 1.00 0.00 O ATOM 464 CB LEU A 65 8.436 -0.692 5.285 1.00 0.00 C ATOM 465 CG LEU A 65 7.023 -1.303 5.231 1.00 0.00 C ATOM 466 CD1 LEU A 65 7.002 -2.723 5.809 1.00 0.00 C ATOM 467 CD2 LEU A 65 6.055 -0.432 6.028 1.00 0.00 C ATOM 0 H LEU A 65 10.901 -0.026 4.831 1.00 0.00 H new ATOM 0 HA LEU A 65 9.288 -2.487 4.488 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.811 -0.738 6.307 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.385 0.362 5.012 1.00 0.00 H new ATOM 0 HG LEU A 65 6.721 -1.349 4.185 1.00 0.00 H new ATOM 0 HD11 LEU A 65 5.989 -3.123 5.755 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.675 -3.360 5.235 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.327 -2.697 6.849 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.056 -0.867 5.988 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.385 -0.377 7.065 1.00 0.00 H new ATOM 0 HD23 LEU A 65 6.031 0.571 5.601 1.00 0.00 H new ATOM 479 N ASN A 66 8.514 -2.052 2.181 1.00 0.00 N ATOM 480 CA ASN A 66 8.344 -2.043 0.730 1.00 0.00 C ATOM 481 C ASN A 66 6.891 -2.355 0.347 1.00 0.00 C ATOM 482 O ASN A 66 6.221 -3.164 0.998 1.00 0.00 O ATOM 483 CB ASN A 66 9.266 -3.099 0.096 1.00 0.00 C ATOM 484 CG ASN A 66 10.714 -3.057 0.576 1.00 0.00 C ATOM 485 OD1 ASN A 66 11.574 -2.430 -0.027 1.00 0.00 O ATOM 486 ND2 ASN A 66 11.026 -3.758 1.651 1.00 0.00 N ATOM 0 H ASN A 66 8.102 -2.874 2.623 1.00 0.00 H new ATOM 0 HA ASN A 66 8.600 -1.049 0.362 1.00 0.00 H new ATOM 0 HB2 ASN A 66 8.858 -4.088 0.303 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.253 -2.969 -0.986 1.00 0.00 H new ATOM 0 HD21 ASN A 66 11.990 -3.779 1.984 1.00 0.00 H new ATOM 0 HD22 ASN A 66 10.303 -4.278 2.148 1.00 0.00 H new ATOM 493 N TRP A 67 6.417 -1.738 -0.735 1.00 0.00 N ATOM 494 CA TRP A 67 5.074 -1.931 -1.279 1.00 0.00 C ATOM 495 C TRP A 67 5.117 -2.654 -2.629 1.00 0.00 C ATOM 496 O TRP A 67 5.988 -2.367 -3.455 1.00 0.00 O ATOM 497 CB TRP A 67 4.433 -0.551 -1.430 1.00 0.00 C ATOM 498 CG TRP A 67 2.969 -0.518 -1.739 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.060 -1.492 -1.503 1.00 0.00 C ATOM 500 CD2 TRP A 67 2.207 0.611 -2.247 1.00 0.00 C ATOM 501 NE1 TRP A 67 0.803 -1.059 -1.862 1.00 0.00 N ATOM 502 CE2 TRP A 67 0.825 0.253 -2.273 1.00 0.00 C ATOM 503 CE3 TRP A 67 2.546 1.930 -2.610 1.00 0.00 C ATOM 504 CZ2 TRP A 67 -0.177 1.167 -2.617 1.00 0.00 C ATOM 505 CZ3 TRP A 67 1.547 2.856 -2.947 1.00 0.00 C ATOM 506 CH2 TRP A 67 0.193 2.482 -2.933 1.00 0.00 C ATOM 0 H TRP A 67 6.972 -1.072 -1.272 1.00 0.00 H new ATOM 0 HA TRP A 67 4.488 -2.555 -0.604 1.00 0.00 H new ATOM 0 HB2 TRP A 67 4.598 0.003 -0.506 1.00 0.00 H new ATOM 0 HB3 TRP A 67 4.959 -0.016 -2.221 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.287 -2.465 -1.094 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -0.037 -1.637 -1.827 1.00 0.00 H new ATOM 0 HE3 TRP A 67 3.583 2.230 -2.629 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -1.214 0.866 -2.639 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 1.821 3.864 -3.219 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -0.568 3.212 -3.167 1.00 0.00 H new ATOM 517 N TYR A 68 4.173 -3.568 -2.872 1.00 0.00 N ATOM 518 CA TYR A 68 4.134 -4.405 -4.074 1.00 0.00 C ATOM 519 C TYR A 68 2.747 -4.483 -4.729 1.00 0.00 C ATOM 520 O TYR A 68 1.733 -4.628 -4.040 1.00 0.00 O ATOM 521 CB TYR A 68 4.592 -5.832 -3.731 1.00 0.00 C ATOM 522 CG TYR A 68 5.956 -5.946 -3.076 1.00 0.00 C ATOM 523 CD1 TYR A 68 6.079 -5.835 -1.676 1.00 0.00 C ATOM 524 CD2 TYR A 68 7.101 -6.177 -3.861 1.00 0.00 C ATOM 525 CE1 TYR A 68 7.341 -5.943 -1.064 1.00 0.00 C ATOM 526 CE2 TYR A 68 8.367 -6.278 -3.256 1.00 0.00 C ATOM 527 CZ TYR A 68 8.493 -6.152 -1.855 1.00 0.00 C ATOM 528 OH TYR A 68 9.724 -6.234 -1.277 1.00 0.00 O ATOM 0 H TYR A 68 3.403 -3.750 -2.229 1.00 0.00 H new ATOM 0 HA TYR A 68 4.806 -3.932 -4.790 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.853 -6.282 -3.068 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.599 -6.422 -4.648 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.201 -5.666 -1.071 1.00 0.00 H new ATOM 0 HD2 TYR A 68 7.007 -6.277 -4.932 1.00 0.00 H new ATOM 0 HE1 TYR A 68 7.429 -5.866 0.010 1.00 0.00 H new ATOM 0 HE2 TYR A 68 9.243 -6.452 -3.863 1.00 0.00 H new ATOM 0 HH TYR A 68 10.402 -6.381 -1.970 1.00 0.00 H new ATOM 538 N ARG A 69 2.714 -4.458 -6.069 1.00 0.00 N ATOM 539 CA ARG A 69 1.524 -4.777 -6.875 1.00 0.00 C ATOM 540 C ARG A 69 1.608 -6.237 -7.318 1.00 0.00 C ATOM 541 O ARG A 69 2.694 -6.699 -7.672 1.00 0.00 O ATOM 542 CB ARG A 69 1.420 -3.854 -8.101 1.00 0.00 C ATOM 543 CG ARG A 69 0.128 -4.119 -8.888 1.00 0.00 C ATOM 544 CD ARG A 69 -0.114 -3.080 -9.987 1.00 0.00 C ATOM 545 NE ARG A 69 -1.484 -3.189 -10.520 1.00 0.00 N ATOM 546 CZ ARG A 69 -2.015 -2.457 -11.494 1.00 0.00 C ATOM 547 NH1 ARG A 69 -1.321 -1.559 -12.162 1.00 0.00 N1+ ATOM 548 NH2 ARG A 69 -3.274 -2.612 -11.828 1.00 0.00 N ATOM 0 H ARG A 69 3.527 -4.211 -6.634 1.00 0.00 H new ATOM 0 HA ARG A 69 0.631 -4.621 -6.270 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.446 -2.813 -7.779 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.282 -4.008 -8.750 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.176 -5.112 -9.336 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.718 -4.120 -8.201 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.047 -2.078 -9.588 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.606 -3.222 -10.793 1.00 0.00 H new ATOM 0 HE ARG A 69 -2.085 -3.897 -10.099 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -0.338 -1.405 -11.939 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -1.767 -1.018 -12.903 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -3.851 -3.297 -11.339 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -3.676 -2.048 -12.576 1.00 0.00 H new ATOM 562 N MET A 70 0.490 -6.961 -7.306 1.00 0.00 N ATOM 563 CA MET A 70 0.449 -8.387 -7.648 1.00 0.00 C ATOM 564 C MET A 70 0.035 -8.642 -9.102 1.00 0.00 C ATOM 565 O MET A 70 -0.803 -7.932 -9.659 1.00 0.00 O ATOM 566 CB MET A 70 -0.486 -9.151 -6.706 1.00 0.00 C ATOM 567 CG MET A 70 -0.230 -8.816 -5.231 1.00 0.00 C ATOM 568 SD MET A 70 -0.896 -9.997 -4.046 1.00 0.00 S ATOM 569 CE MET A 70 0.293 -11.348 -4.273 1.00 0.00 C ATOM 0 H MET A 70 -0.421 -6.574 -7.057 1.00 0.00 H new ATOM 0 HA MET A 70 1.468 -8.754 -7.528 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.521 -8.915 -6.955 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.357 -10.222 -6.860 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.846 -8.737 -5.075 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.655 -7.835 -5.019 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.157 -12.088 -3.485 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.130 -11.817 -5.243 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.307 -10.951 -4.228 1.00 0.00 H new ATOM 579 N SER A 71 0.594 -9.685 -9.712 1.00 0.00 N ATOM 580 CA SER A 71 0.147 -10.206 -11.014 1.00 0.00 C ATOM 581 C SER A 71 -1.023 -11.209 -10.849 1.00 0.00 C ATOM 582 O SER A 71 -1.225 -11.733 -9.743 1.00 0.00 O ATOM 583 CB SER A 71 1.343 -10.839 -11.751 1.00 0.00 C ATOM 584 OG SER A 71 1.562 -12.197 -11.386 1.00 0.00 O ATOM 0 H SER A 71 1.379 -10.202 -9.317 1.00 0.00 H new ATOM 0 HA SER A 71 -0.234 -9.381 -11.615 1.00 0.00 H new ATOM 0 HB2 SER A 71 1.174 -10.780 -12.826 1.00 0.00 H new ATOM 0 HB3 SER A 71 2.242 -10.261 -11.538 1.00 0.00 H new ATOM 0 HG SER A 71 2.330 -12.550 -11.883 1.00 0.00 H new ATOM 590 N PRO A 72 -1.778 -11.538 -11.922 1.00 0.00 N ATOM 591 CA PRO A 72 -2.798 -12.590 -11.879 1.00 0.00 C ATOM 592 C PRO A 72 -2.196 -13.997 -11.706 1.00 0.00 C ATOM 593 O PRO A 72 -2.897 -14.910 -11.275 1.00 0.00 O ATOM 594 CB PRO A 72 -3.577 -12.458 -13.191 1.00 0.00 C ATOM 595 CG PRO A 72 -2.555 -11.857 -14.153 1.00 0.00 C ATOM 596 CD PRO A 72 -1.743 -10.932 -13.249 1.00 0.00 C ATOM 0 HA PRO A 72 -3.446 -12.467 -11.011 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.939 -13.424 -13.542 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -4.449 -11.814 -13.077 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.931 -12.624 -14.612 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -3.036 -11.310 -14.964 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -0.718 -10.836 -13.608 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -2.170 -9.929 -13.232 1.00 0.00 H new ATOM 604 N SER A 73 -0.900 -14.180 -11.985 1.00 0.00 N ATOM 605 CA SER A 73 -0.144 -15.411 -11.687 1.00 0.00 C ATOM 606 C SER A 73 0.375 -15.461 -10.232 1.00 0.00 C ATOM 607 O SER A 73 1.066 -16.410 -9.854 1.00 0.00 O ATOM 608 CB SER A 73 1.033 -15.553 -12.669 1.00 0.00 C ATOM 609 OG SER A 73 0.598 -15.535 -14.026 1.00 0.00 O ATOM 0 H SER A 73 -0.331 -13.462 -12.434 1.00 0.00 H new ATOM 0 HA SER A 73 -0.835 -16.246 -11.806 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.743 -14.742 -12.505 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.562 -16.485 -12.470 1.00 0.00 H new ATOM 0 HG SER A 73 1.373 -15.626 -14.619 1.00 0.00 H new ATOM 615 N ASN A 74 0.070 -14.440 -9.416 1.00 0.00 N ATOM 616 CA ASN A 74 0.440 -14.275 -7.999 1.00 0.00 C ATOM 617 C ASN A 74 1.920 -13.898 -7.783 1.00 0.00 C ATOM 618 O ASN A 74 2.471 -14.113 -6.699 1.00 0.00 O ATOM 619 CB ASN A 74 -0.031 -15.456 -7.123 1.00 0.00 C ATOM 620 CG ASN A 74 -1.527 -15.723 -7.251 1.00 0.00 C ATOM 621 OD1 ASN A 74 -2.349 -15.038 -6.651 1.00 0.00 O ATOM 622 ND2 ASN A 74 -1.924 -16.717 -8.026 1.00 0.00 N ATOM 0 H ASN A 74 -0.481 -13.650 -9.752 1.00 0.00 H new ATOM 0 HA ASN A 74 -0.115 -13.405 -7.649 1.00 0.00 H new ATOM 0 HB2 ASN A 74 0.520 -16.354 -7.404 1.00 0.00 H new ATOM 0 HB3 ASN A 74 0.209 -15.248 -6.080 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.919 -16.918 -8.128 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -1.236 -17.283 -8.522 1.00 0.00 H new ATOM 629 N GLN A 75 2.569 -13.324 -8.802 1.00 0.00 N ATOM 630 CA GLN A 75 3.887 -12.695 -8.663 1.00 0.00 C ATOM 631 C GLN A 75 3.716 -11.253 -8.144 1.00 0.00 C ATOM 632 O GLN A 75 2.585 -10.794 -7.964 1.00 0.00 O ATOM 633 CB GLN A 75 4.662 -12.751 -9.994 1.00 0.00 C ATOM 634 CG GLN A 75 4.839 -14.184 -10.529 1.00 0.00 C ATOM 635 CD GLN A 75 5.634 -14.213 -11.835 1.00 0.00 C ATOM 636 OE1 GLN A 75 5.085 -14.288 -12.928 1.00 0.00 O ATOM 637 NE2 GLN A 75 6.951 -14.140 -11.786 1.00 0.00 N ATOM 0 H GLN A 75 2.194 -13.283 -9.749 1.00 0.00 H new ATOM 0 HA GLN A 75 4.481 -13.246 -7.934 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.137 -12.154 -10.739 1.00 0.00 H new ATOM 0 HB3 GLN A 75 5.643 -12.297 -9.856 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.349 -14.790 -9.780 1.00 0.00 H new ATOM 0 HG3 GLN A 75 3.860 -14.634 -10.690 1.00 0.00 H new ATOM 0 HE21 GLN A 75 7.425 -14.077 -10.885 1.00 0.00 H new ATOM 0 HE22 GLN A 75 7.495 -14.147 -12.649 1.00 0.00 H new ATOM 646 N THR A 76 4.819 -10.532 -7.895 1.00 0.00 N ATOM 647 CA THR A 76 4.836 -9.231 -7.203 1.00 0.00 C ATOM 648 C THR A 76 5.898 -8.312 -7.790 1.00 0.00 C ATOM 649 O THR A 76 7.015 -8.754 -8.056 1.00 0.00 O ATOM 650 CB THR A 76 5.097 -9.392 -5.694 1.00 0.00 C ATOM 651 OG1 THR A 76 6.152 -10.305 -5.459 1.00 0.00 O ATOM 652 CG2 THR A 76 3.859 -9.883 -4.944 1.00 0.00 C ATOM 0 H THR A 76 5.749 -10.844 -8.176 1.00 0.00 H new ATOM 0 HA THR A 76 3.850 -8.789 -7.347 1.00 0.00 H new ATOM 0 HB THR A 76 5.365 -8.403 -5.323 1.00 0.00 H new ATOM 0 HG1 THR A 76 6.302 -10.391 -4.494 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.091 -9.981 -3.884 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.048 -9.167 -5.073 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.554 -10.852 -5.340 1.00 0.00 H new ATOM 660 N ASP A 77 5.568 -7.029 -7.945 1.00 0.00 N ATOM 661 CA ASP A 77 6.505 -5.986 -8.390 1.00 0.00 C ATOM 662 C ASP A 77 6.607 -4.850 -7.368 1.00 0.00 C ATOM 663 O ASP A 77 5.586 -4.310 -6.940 1.00 0.00 O ATOM 664 CB ASP A 77 6.027 -5.424 -9.730 1.00 0.00 C ATOM 665 CG ASP A 77 7.099 -4.572 -10.432 1.00 0.00 C ATOM 666 OD1 ASP A 77 8.237 -5.064 -10.615 1.00 0.00 O1- ATOM 667 OD2 ASP A 77 6.790 -3.421 -10.819 1.00 0.00 O ATOM 0 H ASP A 77 4.629 -6.676 -7.763 1.00 0.00 H new ATOM 0 HA ASP A 77 7.493 -6.434 -8.495 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.738 -6.248 -10.383 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.135 -4.818 -9.568 1.00 0.00 H new ATOM 672 N LYS A 78 7.834 -4.472 -6.995 1.00 0.00 N ATOM 673 CA LYS A 78 8.089 -3.408 -6.012 1.00 0.00 C ATOM 674 C LYS A 78 7.792 -2.019 -6.611 1.00 0.00 C ATOM 675 O LYS A 78 8.310 -1.653 -7.670 1.00 0.00 O ATOM 676 CB LYS A 78 9.524 -3.506 -5.447 1.00 0.00 C ATOM 677 CG LYS A 78 9.713 -2.577 -4.229 1.00 0.00 C ATOM 678 CD LYS A 78 11.154 -2.529 -3.693 1.00 0.00 C ATOM 679 CE LYS A 78 11.565 -3.779 -2.897 1.00 0.00 C ATOM 680 NZ LYS A 78 12.995 -3.723 -2.496 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.684 -4.896 -7.367 1.00 0.00 H new ATOM 0 HA LYS A 78 7.407 -3.547 -5.173 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.733 -4.536 -5.157 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.242 -3.241 -6.224 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.405 -1.568 -4.504 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.050 -2.906 -3.429 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.839 -2.403 -4.531 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.265 -1.652 -3.056 1.00 0.00 H new ATOM 0 HE2 LYS A 78 10.940 -3.868 -2.008 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.390 -4.670 -3.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.386 -4.686 -2.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.526 -3.152 -3.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.074 -3.292 -1.553 1.00 0.00 H new ATOM 694 N LEU A 79 6.960 -1.246 -5.912 1.00 0.00 N ATOM 695 CA LEU A 79 6.431 0.052 -6.343 1.00 0.00 C ATOM 696 C LEU A 79 7.219 1.221 -5.742 1.00 0.00 C ATOM 697 O LEU A 79 7.584 2.159 -6.452 1.00 0.00 O ATOM 698 CB LEU A 79 4.967 0.128 -5.877 1.00 0.00 C ATOM 699 CG LEU A 79 4.051 -0.962 -6.466 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.773 -0.980 -5.623 1.00 0.00 C ATOM 701 CD2 LEU A 79 3.752 -0.693 -7.947 1.00 0.00 C ATOM 0 H LEU A 79 6.621 -1.518 -4.989 1.00 0.00 H new ATOM 0 HA LEU A 79 6.515 0.132 -7.427 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.941 0.058 -4.790 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.565 1.105 -6.143 1.00 0.00 H new ATOM 0 HG LEU A 79 4.538 -1.937 -6.430 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.094 -1.741 -6.008 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.024 -1.208 -4.587 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.290 -0.004 -5.673 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.104 -1.478 -8.336 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.255 0.272 -8.048 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.685 -0.681 -8.510 1.00 0.00 H new ATOM 713 N ALA A 80 7.479 1.142 -4.436 1.00 0.00 N ATOM 714 CA ALA A 80 8.100 2.164 -3.596 1.00 0.00 C ATOM 715 C ALA A 80 8.487 1.556 -2.236 1.00 0.00 C ATOM 716 O ALA A 80 8.060 0.446 -1.899 1.00 0.00 O ATOM 717 CB ALA A 80 7.132 3.354 -3.456 1.00 0.00 C ATOM 0 H ALA A 80 7.245 0.305 -3.902 1.00 0.00 H new ATOM 0 HA ALA A 80 9.018 2.532 -4.054 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.587 4.122 -2.830 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.919 3.768 -4.442 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.203 3.015 -2.997 1.00 0.00 H new ATOM 723 N ALA A 81 9.285 2.284 -1.452 1.00 0.00 N ATOM 724 CA ALA A 81 9.816 1.832 -0.166 1.00 0.00 C ATOM 725 C ALA A 81 10.201 3.004 0.753 1.00 0.00 C ATOM 726 O ALA A 81 10.433 4.122 0.282 1.00 0.00 O ATOM 727 CB ALA A 81 11.021 0.914 -0.431 1.00 0.00 C ATOM 0 H ALA A 81 9.586 3.226 -1.700 1.00 0.00 H new ATOM 0 HA ALA A 81 9.037 1.282 0.361 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.430 0.567 0.518 1.00 0.00 H new ATOM 0 HB2 ALA A 81 10.702 0.057 -1.023 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.787 1.467 -0.976 1.00 0.00 H new ATOM 733 N PHE A 82 10.301 2.728 2.056 1.00 0.00 N ATOM 734 CA PHE A 82 10.840 3.640 3.065 1.00 0.00 C ATOM 735 C PHE A 82 11.830 2.891 3.988 1.00 0.00 C ATOM 736 O PHE A 82 11.467 1.826 4.503 1.00 0.00 O ATOM 737 CB PHE A 82 9.696 4.279 3.866 1.00 0.00 C ATOM 738 CG PHE A 82 10.148 5.476 4.680 1.00 0.00 C ATOM 739 CD1 PHE A 82 10.776 5.296 5.928 1.00 0.00 C ATOM 740 CD2 PHE A 82 9.998 6.776 4.160 1.00 0.00 C ATOM 741 CE1 PHE A 82 11.253 6.406 6.647 1.00 0.00 C ATOM 742 CE2 PHE A 82 10.465 7.887 4.883 1.00 0.00 C ATOM 743 CZ PHE A 82 11.097 7.701 6.125 1.00 0.00 C ATOM 0 H PHE A 82 10.000 1.836 2.449 1.00 0.00 H new ATOM 0 HA PHE A 82 11.388 4.441 2.569 1.00 0.00 H new ATOM 0 HB2 PHE A 82 8.907 4.588 3.181 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.265 3.533 4.533 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.891 4.302 6.334 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.522 6.920 3.201 1.00 0.00 H new ATOM 0 HE1 PHE A 82 11.739 6.263 7.601 1.00 0.00 H new ATOM 0 HE2 PHE A 82 10.338 8.883 4.485 1.00 0.00 H new ATOM 0 HZ PHE A 82 11.463 8.554 6.678 1.00 0.00 H new ATOM 753 N PRO A 83 13.049 3.417 4.237 1.00 0.00 N ATOM 754 CA PRO A 83 13.614 4.635 3.654 1.00 0.00 C ATOM 755 C PRO A 83 13.849 4.479 2.144 1.00 0.00 C ATOM 756 O PRO A 83 14.078 3.376 1.647 1.00 0.00 O ATOM 757 CB PRO A 83 14.919 4.890 4.416 1.00 0.00 C ATOM 758 CG PRO A 83 15.352 3.491 4.850 1.00 0.00 C ATOM 759 CD PRO A 83 14.020 2.796 5.127 1.00 0.00 C ATOM 0 HA PRO A 83 12.933 5.480 3.750 1.00 0.00 H new ATOM 0 HB2 PRO A 83 15.668 5.365 3.783 1.00 0.00 H new ATOM 0 HB3 PRO A 83 14.763 5.546 5.272 1.00 0.00 H new ATOM 0 HG2 PRO A 83 15.919 2.983 4.070 1.00 0.00 H new ATOM 0 HG3 PRO A 83 15.985 3.520 5.737 1.00 0.00 H new ATOM 0 HD2 PRO A 83 14.092 1.725 4.939 1.00 0.00 H new ATOM 0 HD3 PRO A 83 13.726 2.917 6.170 1.00 0.00 H new ATOM 907 N ARG A 94 4.266 7.932 -9.141 1.00 0.00 N ATOM 908 CA ARG A 94 2.892 7.483 -8.898 1.00 0.00 C ATOM 909 C ARG A 94 2.638 6.864 -7.518 1.00 0.00 C ATOM 910 O ARG A 94 1.559 7.068 -6.962 1.00 0.00 O ATOM 911 CB ARG A 94 2.444 6.550 -10.023 1.00 0.00 C ATOM 912 CG ARG A 94 2.088 7.311 -11.307 1.00 0.00 C ATOM 913 CD ARG A 94 2.344 6.486 -12.574 1.00 0.00 C ATOM 914 NE ARG A 94 1.822 5.103 -12.550 1.00 0.00 N ATOM 915 CZ ARG A 94 0.576 4.664 -12.390 1.00 0.00 C ATOM 916 NH1 ARG A 94 -0.446 5.447 -12.117 1.00 0.00 N ATOM 917 NH2 ARG A 94 0.342 3.380 -12.510 1.00 0.00 N1+ ATOM 0 HA ARG A 94 2.281 8.386 -8.896 1.00 0.00 H new ATOM 0 HB2 ARG A 94 3.238 5.835 -10.236 1.00 0.00 H new ATOM 0 HB3 ARG A 94 1.578 5.976 -9.692 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.038 7.601 -11.273 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.671 8.231 -11.353 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.901 7.008 -13.422 1.00 0.00 H new ATOM 0 HD3 ARG A 94 3.419 6.447 -12.750 1.00 0.00 H new ATOM 0 HE ARG A 94 2.524 4.374 -12.675 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -0.306 6.452 -12.016 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -1.378 5.049 -12.006 1.00 0.00 H new ATOM 0 HH21 ARG A 94 1.107 2.740 -12.722 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -0.605 3.021 -12.391 1.00 0.00 H new ATOM 931 N PHE A 95 3.600 6.137 -6.958 1.00 0.00 N ATOM 932 CA PHE A 95 3.493 5.377 -5.712 1.00 0.00 C ATOM 933 C PHE A 95 4.483 5.895 -4.654 1.00 0.00 C ATOM 934 O PHE A 95 5.627 6.224 -4.977 1.00 0.00 O ATOM 935 CB PHE A 95 3.742 3.893 -6.027 1.00 0.00 C ATOM 936 CG PHE A 95 2.791 3.313 -7.062 1.00 0.00 C ATOM 937 CD1 PHE A 95 3.057 3.472 -8.437 1.00 0.00 C ATOM 938 CD2 PHE A 95 1.625 2.638 -6.657 1.00 0.00 C ATOM 939 CE1 PHE A 95 2.169 2.951 -9.394 1.00 0.00 C ATOM 940 CE2 PHE A 95 0.730 2.128 -7.615 1.00 0.00 C ATOM 941 CZ PHE A 95 1.003 2.282 -8.985 1.00 0.00 C ATOM 0 H PHE A 95 4.524 6.056 -7.381 1.00 0.00 H new ATOM 0 HA PHE A 95 2.495 5.501 -5.293 1.00 0.00 H new ATOM 0 HB2 PHE A 95 4.766 3.774 -6.382 1.00 0.00 H new ATOM 0 HB3 PHE A 95 3.655 3.317 -5.106 1.00 0.00 H new ATOM 0 HD1 PHE A 95 3.946 3.996 -8.756 1.00 0.00 H new ATOM 0 HD2 PHE A 95 1.416 2.511 -5.605 1.00 0.00 H new ATOM 0 HE1 PHE A 95 2.383 3.065 -10.446 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -0.167 1.618 -7.298 1.00 0.00 H new ATOM 0 HZ PHE A 95 0.319 1.887 -9.721 1.00 0.00 H new ATOM 951 N ARG A 96 4.043 5.952 -3.391 1.00 0.00 N ATOM 952 CA ARG A 96 4.790 6.522 -2.258 1.00 0.00 C ATOM 953 C ARG A 96 4.615 5.676 -0.986 1.00 0.00 C ATOM 954 O ARG A 96 3.518 5.177 -0.736 1.00 0.00 O ATOM 955 CB ARG A 96 4.263 7.950 -2.023 1.00 0.00 C ATOM 956 CG ARG A 96 5.172 8.788 -1.108 1.00 0.00 C ATOM 957 CD ARG A 96 4.546 10.148 -0.777 1.00 0.00 C ATOM 958 NE ARG A 96 3.467 10.010 0.220 1.00 0.00 N ATOM 959 CZ ARG A 96 2.154 10.090 0.031 1.00 0.00 C ATOM 960 NH1 ARG A 96 1.618 10.335 -1.146 1.00 0.00 N1+ ATOM 961 NH2 ARG A 96 1.349 9.900 1.052 1.00 0.00 N ATOM 0 H ARG A 96 3.128 5.592 -3.119 1.00 0.00 H new ATOM 0 HA ARG A 96 5.855 6.533 -2.490 1.00 0.00 H new ATOM 0 HB2 ARG A 96 4.160 8.455 -2.983 1.00 0.00 H new ATOM 0 HB3 ARG A 96 3.267 7.895 -1.583 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.362 8.241 -0.185 1.00 0.00 H new ATOM 0 HG3 ARG A 96 6.136 8.940 -1.593 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.313 10.821 -0.395 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.149 10.600 -1.686 1.00 0.00 H new ATOM 0 HE ARG A 96 3.768 9.830 1.178 1.00 0.00 H new ATOM 0 HH11 ARG A 96 2.217 10.472 -1.960 1.00 0.00 H new ATOM 0 HH12 ARG A 96 0.604 10.387 -1.244 1.00 0.00 H new ATOM 0 HH21 ARG A 96 1.734 9.694 1.974 1.00 0.00 H new ATOM 0 HH22 ARG A 96 0.339 9.958 0.923 1.00 0.00 H new ATOM 975 N VAL A 97 5.661 5.560 -0.165 1.00 0.00 N ATOM 976 CA VAL A 97 5.608 4.984 1.198 1.00 0.00 C ATOM 977 C VAL A 97 6.104 6.042 2.193 1.00 0.00 C ATOM 978 O VAL A 97 7.179 6.609 1.992 1.00 0.00 O ATOM 979 CB VAL A 97 6.443 3.685 1.330 1.00 0.00 C ATOM 980 CG1 VAL A 97 6.302 3.062 2.732 1.00 0.00 C ATOM 981 CG2 VAL A 97 6.027 2.637 0.285 1.00 0.00 C ATOM 0 H VAL A 97 6.597 5.869 -0.428 1.00 0.00 H new ATOM 0 HA VAL A 97 4.576 4.708 1.413 1.00 0.00 H new ATOM 0 HB VAL A 97 7.481 3.971 1.163 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.901 2.153 2.788 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.649 3.772 3.482 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.256 2.819 2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 97 6.634 1.740 0.408 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.975 2.385 0.421 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.177 3.042 -0.716 1.00 0.00 H new ATOM 991 N THR A 98 5.318 6.316 3.243 1.00 0.00 N ATOM 992 CA THR A 98 5.566 7.379 4.236 1.00 0.00 C ATOM 993 C THR A 98 5.444 6.822 5.655 1.00 0.00 C ATOM 994 O THR A 98 4.488 6.110 5.954 1.00 0.00 O ATOM 995 CB THR A 98 4.556 8.516 4.019 1.00 0.00 C ATOM 996 OG1 THR A 98 4.702 9.019 2.707 1.00 0.00 O ATOM 997 CG2 THR A 98 4.750 9.695 4.974 1.00 0.00 C ATOM 0 H THR A 98 4.465 5.790 3.434 1.00 0.00 H new ATOM 0 HA THR A 98 6.578 7.764 4.109 1.00 0.00 H new ATOM 0 HB THR A 98 3.571 8.087 4.200 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.443 8.329 2.061 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.003 10.460 4.764 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.639 9.352 6.003 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.747 10.114 4.837 1.00 0.00 H new ATOM 1005 N GLN A 99 6.386 7.163 6.539 1.00 0.00 N ATOM 1006 CA GLN A 99 6.328 6.811 7.966 1.00 0.00 C ATOM 1007 C GLN A 99 5.402 7.756 8.753 1.00 0.00 C ATOM 1008 O GLN A 99 5.369 8.965 8.507 1.00 0.00 O ATOM 1009 CB GLN A 99 7.738 6.740 8.584 1.00 0.00 C ATOM 1010 CG GLN A 99 8.469 8.090 8.719 1.00 0.00 C ATOM 1011 CD GLN A 99 9.832 7.991 9.416 1.00 0.00 C ATOM 1012 OE1 GLN A 99 10.259 6.958 9.918 1.00 0.00 O ATOM 1013 NE2 GLN A 99 10.574 9.079 9.488 1.00 0.00 N ATOM 0 H GLN A 99 7.218 7.695 6.285 1.00 0.00 H new ATOM 0 HA GLN A 99 5.892 5.814 8.038 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.661 6.288 9.573 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.350 6.074 7.976 1.00 0.00 H new ATOM 0 HG2 GLN A 99 8.610 8.517 7.726 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.836 8.781 9.276 1.00 0.00 H new ATOM 0 HE21 GLN A 99 10.241 9.952 9.078 1.00 0.00 H new ATOM 0 HE22 GLN A 99 11.481 9.048 9.954 1.00 0.00 H new ATOM 1022 N LEU A 100 4.653 7.207 9.713 1.00 0.00 N ATOM 1023 CA LEU A 100 3.741 7.947 10.593 1.00 0.00 C ATOM 1024 C LEU A 100 4.425 8.344 11.919 1.00 0.00 C ATOM 1025 O LEU A 100 5.376 7.669 12.337 1.00 0.00 O ATOM 1026 CB LEU A 100 2.489 7.080 10.855 1.00 0.00 C ATOM 1027 CG LEU A 100 1.740 6.630 9.585 1.00 0.00 C ATOM 1028 CD1 LEU A 100 0.488 5.827 9.955 1.00 0.00 C ATOM 1029 CD2 LEU A 100 1.337 7.811 8.694 1.00 0.00 C ATOM 0 H LEU A 100 4.664 6.206 9.906 1.00 0.00 H new ATOM 0 HA LEU A 100 3.449 8.875 10.101 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.788 6.195 11.417 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.801 7.641 11.487 1.00 0.00 H new ATOM 0 HG LEU A 100 2.431 6.003 9.021 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.028 5.518 9.046 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.777 4.945 10.526 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.177 6.447 10.557 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.813 7.440 7.813 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.682 8.480 9.251 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.230 8.353 8.383 1.00 0.00 H new ATOM 1041 N PRO A 101 3.915 9.372 12.634 1.00 0.00 N ATOM 1042 CA PRO A 101 4.404 9.757 13.961 1.00 0.00 C ATOM 1043 C PRO A 101 4.159 8.693 15.048 1.00 0.00 C ATOM 1044 O PRO A 101 4.646 8.853 16.167 1.00 0.00 O ATOM 1045 CB PRO A 101 3.704 11.084 14.286 1.00 0.00 C ATOM 1046 CG PRO A 101 2.404 11.003 13.491 1.00 0.00 C ATOM 1047 CD PRO A 101 2.841 10.272 12.224 1.00 0.00 C ATOM 0 HA PRO A 101 5.489 9.859 13.947 1.00 0.00 H new ATOM 0 HB2 PRO A 101 3.516 11.188 15.355 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.307 11.941 13.984 1.00 0.00 H new ATOM 0 HG2 PRO A 101 1.631 10.455 14.030 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.000 11.991 13.271 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.011 9.717 11.787 1.00 0.00 H new ATOM 0 HD3 PRO A 101 3.188 10.975 11.467 1.00 0.00 H new ATOM 1055 N ASN A 102 3.461 7.589 14.737 1.00 0.00 N ATOM 1056 CA ASN A 102 3.346 6.418 15.620 1.00 0.00 C ATOM 1057 C ASN A 102 4.698 5.694 15.847 1.00 0.00 C ATOM 1058 O ASN A 102 4.841 4.929 16.803 1.00 0.00 O ATOM 1059 CB ASN A 102 2.315 5.453 15.015 1.00 0.00 C ATOM 1060 CG ASN A 102 0.931 6.086 14.891 1.00 0.00 C ATOM 1061 OD1 ASN A 102 0.571 6.634 13.855 1.00 0.00 O ATOM 1062 ND2 ASN A 102 0.131 6.055 15.942 1.00 0.00 N ATOM 0 H ASN A 102 2.956 7.484 13.857 1.00 0.00 H new ATOM 0 HA ASN A 102 3.023 6.764 16.602 1.00 0.00 H new ATOM 0 HB2 ASN A 102 2.655 5.133 14.030 1.00 0.00 H new ATOM 0 HB3 ASN A 102 2.249 4.560 15.636 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -0.791 6.488 15.894 1.00 0.00 H new ATOM 0 HD22 ASN A 102 0.436 5.598 16.801 1.00 0.00 H new ATOM 1069 N GLY A 103 5.692 5.930 14.977 1.00 0.00 N ATOM 1070 CA GLY A 103 7.099 5.517 15.122 1.00 0.00 C ATOM 1071 C GLY A 103 7.445 4.204 14.414 1.00 0.00 C ATOM 1072 O GLY A 103 8.542 4.086 13.866 1.00 0.00 O ATOM 0 H GLY A 103 5.529 6.440 14.109 1.00 0.00 H new ATOM 0 HA2 GLY A 103 7.740 6.307 14.731 1.00 0.00 H new ATOM 0 HA3 GLY A 103 7.329 5.416 16.183 1.00 0.00 H new ATOM 1076 N ARG A 104 6.500 3.257 14.369 1.00 0.00 N ATOM 1077 CA ARG A 104 6.554 2.032 13.556 1.00 0.00 C ATOM 1078 C ARG A 104 5.158 1.737 12.997 1.00 0.00 C ATOM 1079 O ARG A 104 4.447 0.835 13.438 1.00 0.00 O ATOM 1080 CB ARG A 104 7.108 0.836 14.354 1.00 0.00 C ATOM 1081 CG ARG A 104 8.585 0.991 14.737 1.00 0.00 C ATOM 1082 CD ARG A 104 9.145 -0.343 15.242 1.00 0.00 C ATOM 1083 NE ARG A 104 10.513 -0.203 15.771 1.00 0.00 N ATOM 1084 CZ ARG A 104 11.646 -0.107 15.084 1.00 0.00 C ATOM 1085 NH1 ARG A 104 11.679 -0.066 13.766 1.00 0.00 N1+ ATOM 1086 NH2 ARG A 104 12.781 -0.054 15.742 1.00 0.00 N ATOM 0 H ARG A 104 5.643 3.324 14.918 1.00 0.00 H new ATOM 0 HA ARG A 104 7.244 2.192 12.728 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.517 0.709 15.261 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.987 -0.072 13.764 1.00 0.00 H new ATOM 0 HG2 ARG A 104 9.158 1.331 13.874 1.00 0.00 H new ATOM 0 HG3 ARG A 104 8.690 1.753 15.509 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.494 -0.738 16.022 1.00 0.00 H new ATOM 0 HD3 ARG A 104 9.144 -1.068 14.428 1.00 0.00 H new ATOM 0 HE ARG A 104 10.601 -0.177 16.787 1.00 0.00 H new ATOM 0 HH11 ARG A 104 10.811 -0.108 13.233 1.00 0.00 H new ATOM 0 HH12 ARG A 104 12.573 0.008 13.280 1.00 0.00 H new ATOM 0 HH21 ARG A 104 12.781 -0.087 16.761 1.00 0.00 H new ATOM 0 HH22 ARG A 104 13.662 0.020 15.234 1.00 0.00 H new ATOM 1100 N ASP A 105 4.770 2.539 12.011 1.00 0.00 N ATOM 1101 CA ASP A 105 3.507 2.475 11.275 1.00 0.00 C ATOM 1102 C ASP A 105 3.651 3.323 10.010 1.00 0.00 C ATOM 1103 O ASP A 105 4.354 4.340 10.027 1.00 0.00 O ATOM 1104 CB ASP A 105 2.335 2.971 12.142 1.00 0.00 C ATOM 1105 CG ASP A 105 0.966 2.369 11.781 1.00 0.00 C ATOM 1106 OD1 ASP A 105 0.914 1.321 11.097 1.00 0.00 O ATOM 1107 OD2 ASP A 105 -0.059 2.927 12.237 1.00 0.00 O1- ATOM 0 H ASP A 105 5.365 3.300 11.682 1.00 0.00 H new ATOM 0 HA ASP A 105 3.287 1.442 11.007 1.00 0.00 H new ATOM 0 HB2 ASP A 105 2.552 2.744 13.186 1.00 0.00 H new ATOM 0 HB3 ASP A 105 2.273 4.056 12.058 1.00 0.00 H new ATOM 1112 N PHE A 106 3.026 2.894 8.916 1.00 0.00 N ATOM 1113 CA PHE A 106 3.289 3.465 7.593 1.00 0.00 C ATOM 1114 C PHE A 106 2.035 3.577 6.723 1.00 0.00 C ATOM 1115 O PHE A 106 1.150 2.724 6.760 1.00 0.00 O ATOM 1116 CB PHE A 106 4.345 2.607 6.874 1.00 0.00 C ATOM 1117 CG PHE A 106 5.708 2.540 7.549 1.00 0.00 C ATOM 1118 CD1 PHE A 106 5.927 1.664 8.633 1.00 0.00 C ATOM 1119 CD2 PHE A 106 6.775 3.320 7.066 1.00 0.00 C ATOM 1120 CE1 PHE A 106 7.191 1.584 9.242 1.00 0.00 C ATOM 1121 CE2 PHE A 106 8.043 3.231 7.668 1.00 0.00 C ATOM 1122 CZ PHE A 106 8.252 2.369 8.758 1.00 0.00 C ATOM 0 H PHE A 106 2.330 2.149 8.918 1.00 0.00 H new ATOM 0 HA PHE A 106 3.653 4.481 7.747 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.958 1.593 6.776 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.478 2.997 5.865 1.00 0.00 H new ATOM 0 HD1 PHE A 106 5.117 1.050 8.998 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.620 3.988 6.232 1.00 0.00 H new ATOM 0 HE1 PHE A 106 7.347 0.921 10.080 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.860 3.828 7.291 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.225 2.310 9.223 1.00 0.00 H new ATOM 1132 N HIS A 107 2.008 4.611 5.883 1.00 0.00 N ATOM 1133 CA HIS A 107 1.037 4.795 4.804 1.00 0.00 C ATOM 1134 C HIS A 107 1.675 4.504 3.436 1.00 0.00 C ATOM 1135 O HIS A 107 2.806 4.909 3.164 1.00 0.00 O ATOM 1136 CB HIS A 107 0.466 6.225 4.852 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.718 6.403 5.770 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.384 5.394 6.470 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -1.350 7.589 6.007 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.390 5.999 7.119 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -2.395 7.320 6.862 1.00 0.00 N ATOM 0 H HIS A 107 2.686 5.371 5.937 1.00 0.00 H new ATOM 0 HA HIS A 107 0.220 4.087 4.944 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.257 6.907 5.166 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.174 6.518 3.844 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -1.082 8.553 5.602 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -3.099 5.495 7.760 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -3.056 8.001 7.235 1.00 0.00 H new ATOM 1149 N MET A 108 0.929 3.820 2.569 1.00 0.00 N ATOM 1150 CA MET A 108 1.314 3.438 1.207 1.00 0.00 C ATOM 1151 C MET A 108 0.291 4.042 0.245 1.00 0.00 C ATOM 1152 O MET A 108 -0.865 3.630 0.237 1.00 0.00 O ATOM 1153 CB MET A 108 1.374 1.907 1.122 1.00 0.00 C ATOM 1154 CG MET A 108 2.475 1.378 2.046 1.00 0.00 C ATOM 1155 SD MET A 108 2.861 -0.375 1.853 1.00 0.00 S ATOM 1156 CE MET A 108 4.534 -0.306 2.532 1.00 0.00 C ATOM 0 H MET A 108 -0.009 3.500 2.808 1.00 0.00 H new ATOM 0 HA MET A 108 2.300 3.816 0.937 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.412 1.480 1.406 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.569 1.598 0.095 1.00 0.00 H new ATOM 0 HG2 MET A 108 3.383 1.955 1.871 1.00 0.00 H new ATOM 0 HG3 MET A 108 2.178 1.557 3.079 1.00 0.00 H new ATOM 0 HE1 MET A 108 5.070 -1.219 2.273 1.00 0.00 H new ATOM 0 HE2 MET A 108 5.060 0.553 2.116 1.00 0.00 H new ATOM 0 HE3 MET A 108 4.483 -0.210 3.617 1.00 0.00 H new ATOM 1166 N SER A 109 0.691 5.059 -0.517 1.00 0.00 N ATOM 1167 CA SER A 109 -0.222 5.934 -1.265 1.00 0.00 C ATOM 1168 C SER A 109 0.018 5.990 -2.786 1.00 0.00 C ATOM 1169 O SER A 109 1.133 6.267 -3.235 1.00 0.00 O ATOM 1170 CB SER A 109 -0.084 7.345 -0.682 1.00 0.00 C ATOM 1171 OG SER A 109 -1.067 8.241 -1.178 1.00 0.00 O ATOM 0 H SER A 109 1.674 5.305 -0.636 1.00 0.00 H new ATOM 0 HA SER A 109 -1.223 5.517 -1.152 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.160 7.294 0.404 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.907 7.734 -0.914 1.00 0.00 H new ATOM 0 HG SER A 109 -1.898 8.128 -0.671 1.00 0.00 H new ATOM 1177 N VAL A 110 -1.040 5.770 -3.579 1.00 0.00 N ATOM 1178 CA VAL A 110 -1.082 6.020 -5.028 1.00 0.00 C ATOM 1179 C VAL A 110 -1.523 7.470 -5.228 1.00 0.00 C ATOM 1180 O VAL A 110 -2.587 7.867 -4.748 1.00 0.00 O ATOM 1181 CB VAL A 110 -2.063 5.109 -5.816 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -1.826 5.255 -7.331 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -1.975 3.623 -5.443 1.00 0.00 C ATOM 0 H VAL A 110 -1.920 5.401 -3.218 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.086 5.805 -5.416 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.061 5.449 -5.540 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.520 4.611 -7.872 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.988 6.292 -7.626 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.802 4.965 -7.569 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.691 3.056 -6.037 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.968 3.257 -5.642 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -2.203 3.499 -4.384 1.00 0.00 H new ATOM 1193 N VAL A 111 -0.725 8.244 -5.957 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.028 9.623 -6.356 1.00 0.00 C ATOM 1195 C VAL A 111 -1.885 9.595 -7.626 1.00 0.00 C ATOM 1196 O VAL A 111 -1.404 9.197 -8.688 1.00 0.00 O ATOM 1197 CB VAL A 111 0.264 10.451 -6.564 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.058 11.894 -6.993 1.00 0.00 C ATOM 1199 CG2 VAL A 111 1.101 10.496 -5.271 1.00 0.00 C ATOM 0 H VAL A 111 0.180 7.923 -6.300 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.585 10.113 -5.557 1.00 0.00 H new ATOM 0 HB VAL A 111 0.833 9.960 -7.354 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.870 12.448 -7.131 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.614 11.879 -7.930 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.658 12.377 -6.222 1.00 0.00 H new ATOM 0 HG21 VAL A 111 2.003 11.083 -5.442 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.515 10.954 -4.474 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.377 9.482 -4.981 1.00 0.00 H new ATOM 1209 N ARG A 112 -3.152 10.021 -7.502 1.00 0.00 N ATOM 1210 CA ARG A 112 -4.125 10.159 -8.601 1.00 0.00 C ATOM 1211 C ARG A 112 -4.288 8.849 -9.380 1.00 0.00 C ATOM 1212 O ARG A 112 -3.827 8.711 -10.515 1.00 0.00 O ATOM 1213 CB ARG A 112 -3.769 11.359 -9.500 1.00 0.00 C ATOM 1214 CG ARG A 112 -3.787 12.657 -8.684 1.00 0.00 C ATOM 1215 CD ARG A 112 -3.622 13.892 -9.578 1.00 0.00 C ATOM 1216 NE ARG A 112 -3.647 15.134 -8.783 1.00 0.00 N ATOM 1217 CZ ARG A 112 -2.620 15.716 -8.171 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -1.400 15.220 -8.217 1.00 0.00 N1+ ATOM 1219 NH2 ARG A 112 -2.813 16.825 -7.490 1.00 0.00 N ATOM 0 H ARG A 112 -3.543 10.290 -6.599 1.00 0.00 H new ATOM 0 HA ARG A 112 -5.103 10.370 -8.169 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -2.783 11.212 -9.941 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -4.480 11.429 -10.324 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -4.726 12.728 -8.135 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -2.986 12.633 -7.945 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.681 13.826 -10.124 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -4.420 13.916 -10.320 1.00 0.00 H new ATOM 0 HE ARG A 112 -4.551 15.597 -8.693 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.218 14.361 -8.735 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -0.638 15.696 -7.734 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -3.746 17.233 -7.434 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.030 17.277 -7.018 1.00 0.00 H new ATOM 1233 N ALA A 113 -4.911 7.859 -8.746 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.056 6.506 -9.278 1.00 0.00 C ATOM 1235 C ALA A 113 -5.942 6.479 -10.541 1.00 0.00 C ATOM 1236 O ALA A 113 -7.054 7.010 -10.533 1.00 0.00 O ATOM 1237 CB ALA A 113 -5.613 5.636 -8.146 1.00 0.00 C ATOM 0 H ALA A 113 -5.339 7.977 -7.828 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.093 6.114 -9.605 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -5.738 4.613 -8.501 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -4.920 5.646 -7.305 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.578 6.029 -7.826 1.00 0.00 H new ATOM 1243 N ARG A 114 -5.453 5.865 -11.624 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.205 5.623 -12.870 1.00 0.00 C ATOM 1245 C ARG A 114 -6.936 4.274 -12.784 1.00 0.00 C ATOM 1246 O ARG A 114 -6.524 3.407 -12.018 1.00 0.00 O ATOM 1247 CB ARG A 114 -5.239 5.617 -14.074 1.00 0.00 C ATOM 1248 CG ARG A 114 -4.798 6.998 -14.586 1.00 0.00 C ATOM 1249 CD ARG A 114 -3.993 7.836 -13.585 1.00 0.00 C ATOM 1250 NE ARG A 114 -3.298 8.943 -14.265 1.00 0.00 N ATOM 1251 CZ ARG A 114 -2.361 9.729 -13.746 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -2.032 9.681 -12.472 1.00 0.00 N1+ ATOM 1253 NH2 ARG A 114 -1.731 10.588 -14.518 1.00 0.00 N ATOM 0 H ARG A 114 -4.497 5.511 -11.664 1.00 0.00 H new ATOM 0 HA ARG A 114 -6.937 6.419 -13.004 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -4.349 5.052 -13.798 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.715 5.081 -14.895 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -4.199 6.860 -15.486 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -5.685 7.561 -14.877 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -4.659 8.235 -12.820 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -3.266 7.203 -13.076 1.00 0.00 H new ATOM 0 HE ARG A 114 -3.563 9.124 -15.233 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -2.502 9.025 -11.848 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -1.307 10.300 -12.109 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -1.963 10.648 -15.509 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -1.011 11.194 -14.125 1.00 0.00 H new ATOM 1267 N ARG A 115 -7.950 4.018 -13.624 1.00 0.00 N ATOM 1268 CA ARG A 115 -8.597 2.685 -13.708 1.00 0.00 C ATOM 1269 C ARG A 115 -7.622 1.548 -14.078 1.00 0.00 C ATOM 1270 O ARG A 115 -7.833 0.401 -13.688 1.00 0.00 O ATOM 1271 CB ARG A 115 -9.807 2.737 -14.650 1.00 0.00 C ATOM 1272 CG ARG A 115 -10.975 3.470 -13.967 1.00 0.00 C ATOM 1273 CD ARG A 115 -12.203 3.567 -14.873 1.00 0.00 C ATOM 1274 NE ARG A 115 -11.939 4.425 -16.037 1.00 0.00 N ATOM 1275 CZ ARG A 115 -12.490 4.346 -17.239 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -13.480 3.520 -17.508 1.00 0.00 N1+ ATOM 1277 NH2 ARG A 115 -12.035 5.128 -18.192 1.00 0.00 N ATOM 0 H ARG A 115 -8.345 4.712 -14.258 1.00 0.00 H new ATOM 0 HA ARG A 115 -8.948 2.440 -12.706 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.537 3.248 -15.574 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -10.110 1.726 -14.922 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -11.243 2.947 -13.049 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -10.656 4.472 -13.681 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -12.489 2.571 -15.210 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -13.045 3.966 -14.307 1.00 0.00 H new ATOM 0 HE ARG A 115 -11.252 5.167 -15.904 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -13.849 2.911 -16.777 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -13.878 3.489 -18.447 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -11.273 5.778 -17.998 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -12.444 5.085 -19.126 1.00 0.00 H new ATOM 1291 N ASN A 116 -6.506 1.884 -14.736 1.00 0.00 N ATOM 1292 CA ASN A 116 -5.347 1.007 -14.958 1.00 0.00 C ATOM 1293 C ASN A 116 -4.765 0.416 -13.651 1.00 0.00 C ATOM 1294 O ASN A 116 -4.156 -0.653 -13.670 1.00 0.00 O ATOM 1295 CB ASN A 116 -4.279 1.859 -15.671 1.00 0.00 C ATOM 1296 CG ASN A 116 -2.962 1.122 -15.908 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -2.789 0.430 -16.904 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -1.998 1.250 -15.009 1.00 0.00 N ATOM 0 H ASN A 116 -6.379 2.810 -15.145 1.00 0.00 H new ATOM 0 HA ASN A 116 -5.661 0.149 -15.553 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -4.675 2.194 -16.630 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.084 2.752 -15.077 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -1.107 0.771 -15.145 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -2.146 1.827 -14.181 1.00 0.00 H new ATOM 1305 N ASP A 117 -4.936 1.107 -12.519 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.278 0.824 -11.238 1.00 0.00 C ATOM 1307 C ASP A 117 -5.139 -0.036 -10.289 1.00 0.00 C ATOM 1308 O ASP A 117 -4.685 -0.397 -9.208 1.00 0.00 O ATOM 1309 CB ASP A 117 -3.848 2.157 -10.588 1.00 0.00 C ATOM 1310 CG ASP A 117 -2.994 3.047 -11.510 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -2.285 2.517 -12.398 1.00 0.00 O ATOM 1312 OD2 ASP A 117 -3.006 4.290 -11.340 1.00 0.00 O1- ATOM 0 H ASP A 117 -5.562 1.911 -12.468 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.394 0.218 -11.436 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.739 2.709 -10.288 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.284 1.943 -9.680 1.00 0.00 H new ATOM 1317 N SER A 118 -6.361 -0.417 -10.670 1.00 0.00 N ATOM 1318 CA SER A 118 -7.144 -1.411 -9.916 1.00 0.00 C ATOM 1319 C SER A 118 -6.466 -2.798 -9.928 1.00 0.00 C ATOM 1320 O SER A 118 -5.967 -3.252 -10.965 1.00 0.00 O ATOM 1321 CB SER A 118 -8.566 -1.541 -10.483 1.00 0.00 C ATOM 1322 OG SER A 118 -9.308 -0.329 -10.388 1.00 0.00 O ATOM 0 H SER A 118 -6.834 -0.054 -11.497 1.00 0.00 H new ATOM 0 HA SER A 118 -7.196 -1.054 -8.887 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.510 -1.847 -11.528 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.095 -2.329 -9.948 1.00 0.00 H new ATOM 0 HG SER A 118 -8.693 0.421 -10.246 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.456 -3.501 -8.789 1.00 0.00 N ATOM 1329 CA GLY A 119 -5.867 -4.845 -8.663 1.00 0.00 C ATOM 1330 C GLY A 119 -5.543 -5.238 -7.224 1.00 0.00 C ATOM 1331 O GLY A 119 -5.985 -4.568 -6.290 1.00 0.00 O ATOM 0 H GLY A 119 -6.859 -3.152 -7.920 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.557 -5.576 -9.084 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.954 -4.890 -9.257 1.00 0.00 H new ATOM 1335 N THR A 120 -4.776 -6.321 -7.043 1.00 0.00 N ATOM 1336 CA THR A 120 -4.303 -6.771 -5.720 1.00 0.00 C ATOM 1337 C THR A 120 -2.921 -6.199 -5.439 1.00 0.00 C ATOM 1338 O THR A 120 -2.090 -6.062 -6.336 1.00 0.00 O ATOM 1339 CB THR A 120 -4.284 -8.298 -5.568 1.00 0.00 C ATOM 1340 OG1 THR A 120 -5.416 -8.878 -6.183 1.00 0.00 O ATOM 1341 CG2 THR A 120 -4.328 -8.729 -4.099 1.00 0.00 C ATOM 0 H THR A 120 -4.463 -6.915 -7.811 1.00 0.00 H new ATOM 0 HA THR A 120 -5.019 -6.396 -4.988 1.00 0.00 H new ATOM 0 HB THR A 120 -3.357 -8.631 -6.035 1.00 0.00 H new ATOM 0 HG1 THR A 120 -5.384 -9.852 -6.076 1.00 0.00 H new ATOM 0 HG21 THR A 120 -4.313 -9.817 -4.038 1.00 0.00 H new ATOM 0 HG22 THR A 120 -3.462 -8.324 -3.575 1.00 0.00 H new ATOM 0 HG23 THR A 120 -5.240 -8.353 -3.637 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.676 -5.896 -4.173 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.450 -5.311 -3.633 1.00 0.00 C ATOM 1351 C TYR A 121 -1.090 -5.972 -2.288 1.00 0.00 C ATOM 1352 O TYR A 121 -1.969 -6.515 -1.611 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.662 -3.796 -3.437 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.736 -2.962 -4.709 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.914 -2.916 -5.485 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.622 -2.193 -5.100 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -2.957 -2.157 -6.671 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.674 -1.402 -6.263 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.835 -1.394 -7.062 1.00 0.00 C ATOM 1360 OH TYR A 121 -1.862 -0.653 -8.204 1.00 0.00 O ATOM 0 H TYR A 121 -3.371 -6.062 -3.445 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.629 -5.480 -4.330 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.584 -3.648 -2.875 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.849 -3.412 -2.821 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.788 -3.466 -5.168 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.278 -2.211 -4.503 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -3.848 -2.159 -7.281 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.178 -0.800 -6.544 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.782 -0.602 -8.539 1.00 0.00 H new ATOM 1370 N LEU A 122 0.176 -5.890 -1.862 1.00 0.00 N ATOM 1371 CA LEU A 122 0.621 -6.305 -0.522 1.00 0.00 C ATOM 1372 C LEU A 122 1.866 -5.542 -0.053 1.00 0.00 C ATOM 1373 O LEU A 122 2.532 -4.860 -0.831 1.00 0.00 O ATOM 1374 CB LEU A 122 0.725 -7.847 -0.407 1.00 0.00 C ATOM 1375 CG LEU A 122 1.749 -8.606 -1.273 1.00 0.00 C ATOM 1376 CD1 LEU A 122 3.207 -8.349 -0.863 1.00 0.00 C ATOM 1377 CD2 LEU A 122 1.489 -10.115 -1.141 1.00 0.00 C ATOM 0 H LEU A 122 0.932 -5.529 -2.444 1.00 0.00 H new ATOM 0 HA LEU A 122 -0.152 -6.016 0.190 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.940 -8.083 0.635 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.260 -8.258 -0.630 1.00 0.00 H new ATOM 0 HG LEU A 122 1.620 -8.247 -2.294 1.00 0.00 H new ATOM 0 HD11 LEU A 122 3.873 -8.915 -1.514 1.00 0.00 H new ATOM 0 HD12 LEU A 122 3.428 -7.285 -0.953 1.00 0.00 H new ATOM 0 HD13 LEU A 122 3.356 -8.664 0.170 1.00 0.00 H new ATOM 0 HD21 LEU A 122 2.208 -10.663 -1.750 1.00 0.00 H new ATOM 0 HD22 LEU A 122 1.596 -10.413 -0.098 1.00 0.00 H new ATOM 0 HD23 LEU A 122 0.479 -10.341 -1.481 1.00 0.00 H new ATOM 1389 N CYS A 123 2.173 -5.663 1.237 1.00 0.00 N ATOM 1390 CA CYS A 123 3.298 -5.008 1.914 1.00 0.00 C ATOM 1391 C CYS A 123 4.328 -6.046 2.400 1.00 0.00 C ATOM 1392 O CYS A 123 3.944 -7.144 2.816 1.00 0.00 O ATOM 1393 CB CYS A 123 2.708 -4.217 3.084 1.00 0.00 C ATOM 1394 SG CYS A 123 3.888 -3.262 4.058 1.00 0.00 S ATOM 0 H CYS A 123 1.623 -6.245 1.869 1.00 0.00 H new ATOM 0 HA CYS A 123 3.831 -4.344 1.233 1.00 0.00 H new ATOM 0 HB2 CYS A 123 1.952 -3.536 2.693 1.00 0.00 H new ATOM 0 HB3 CYS A 123 2.197 -4.914 3.748 1.00 0.00 H new ATOM 1399 N GLY A 124 5.625 -5.716 2.366 1.00 0.00 N ATOM 1400 CA GLY A 124 6.710 -6.588 2.846 1.00 0.00 C ATOM 1401 C GLY A 124 7.901 -5.830 3.430 1.00 0.00 C ATOM 1402 O GLY A 124 8.337 -4.824 2.872 1.00 0.00 O ATOM 0 H GLY A 124 5.957 -4.824 2.000 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.313 -7.261 3.605 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.057 -7.209 2.020 1.00 0.00 H new ATOM 1406 N ALA A 125 8.455 -6.332 4.534 1.00 0.00 N ATOM 1407 CA ALA A 125 9.611 -5.755 5.224 1.00 0.00 C ATOM 1408 C ALA A 125 10.873 -6.616 5.071 1.00 0.00 C ATOM 1409 O ALA A 125 10.801 -7.820 4.831 1.00 0.00 O ATOM 1410 CB ALA A 125 9.264 -5.575 6.708 1.00 0.00 C ATOM 0 H ALA A 125 8.102 -7.175 4.986 1.00 0.00 H new ATOM 0 HA ALA A 125 9.834 -4.791 4.768 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.118 -5.146 7.232 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.407 -4.908 6.803 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.020 -6.543 7.145 1.00 0.00 H new ATOM 1416 N ILE A 126 12.038 -6.002 5.275 1.00 0.00 N ATOM 1417 CA ILE A 126 13.343 -6.672 5.399 1.00 0.00 C ATOM 1418 C ILE A 126 14.224 -5.891 6.382 1.00 0.00 C ATOM 1419 O ILE A 126 14.313 -4.665 6.312 1.00 0.00 O ATOM 1420 CB ILE A 126 14.001 -6.870 4.012 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.268 -7.741 4.134 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.337 -5.536 3.325 1.00 0.00 C ATOM 1423 CD1 ILE A 126 15.861 -8.171 2.789 1.00 0.00 C ATOM 0 H ILE A 126 12.107 -4.988 5.362 1.00 0.00 H new ATOM 0 HA ILE A 126 13.208 -7.674 5.806 1.00 0.00 H new ATOM 0 HB ILE A 126 13.271 -7.381 3.385 1.00 0.00 H new ATOM 0 HG12 ILE A 126 16.024 -7.189 4.692 1.00 0.00 H new ATOM 0 HG13 ILE A 126 15.029 -8.632 4.715 1.00 0.00 H new ATOM 0 HG21 ILE A 126 14.796 -5.731 2.356 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.423 -4.959 3.184 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.030 -4.971 3.948 1.00 0.00 H new ATOM 0 HD11 ILE A 126 16.749 -8.780 2.961 1.00 0.00 H new ATOM 0 HD12 ILE A 126 15.124 -8.752 2.236 1.00 0.00 H new ATOM 0 HD13 ILE A 126 16.133 -7.287 2.212 1.00 0.00 H new ATOM 1435 N SER A 127 14.842 -6.582 7.330 1.00 0.00 N ATOM 1436 CA SER A 127 15.686 -5.987 8.377 1.00 0.00 C ATOM 1437 C SER A 127 16.979 -5.377 7.797 1.00 0.00 C ATOM 1438 O SER A 127 17.463 -5.815 6.750 1.00 0.00 O ATOM 1439 CB SER A 127 15.987 -7.033 9.462 1.00 0.00 C ATOM 1440 OG SER A 127 14.884 -7.902 9.697 1.00 0.00 O ATOM 0 H SER A 127 14.774 -7.597 7.401 1.00 0.00 H new ATOM 0 HA SER A 127 15.137 -5.163 8.833 1.00 0.00 H new ATOM 0 HB2 SER A 127 16.854 -7.623 9.164 1.00 0.00 H new ATOM 0 HB3 SER A 127 16.250 -6.525 10.390 1.00 0.00 H new ATOM 0 HG SER A 127 15.121 -8.551 10.392 1.00 0.00 H new ATOM 1446 N LEU A 128 17.555 -4.355 8.448 1.00 0.00 N ATOM 1447 CA LEU A 128 18.673 -3.588 7.868 1.00 0.00 C ATOM 1448 C LEU A 128 20.018 -4.342 7.781 1.00 0.00 C ATOM 1449 O LEU A 128 20.937 -3.866 7.110 1.00 0.00 O ATOM 1450 CB LEU A 128 18.765 -2.201 8.529 1.00 0.00 C ATOM 1451 CG LEU A 128 19.154 -2.138 10.020 1.00 0.00 C ATOM 1452 CD1 LEU A 128 20.647 -2.396 10.282 1.00 0.00 C ATOM 1453 CD2 LEU A 128 18.796 -0.740 10.538 1.00 0.00 C ATOM 0 H LEU A 128 17.267 -4.039 9.374 1.00 0.00 H new ATOM 0 HA LEU A 128 18.436 -3.441 6.814 1.00 0.00 H new ATOM 0 HB2 LEU A 128 19.490 -1.611 7.969 1.00 0.00 H new ATOM 0 HB3 LEU A 128 17.798 -1.711 8.414 1.00 0.00 H new ATOM 0 HG LEU A 128 18.608 -2.928 10.535 1.00 0.00 H new ATOM 0 HD11 LEU A 128 20.844 -2.335 11.352 1.00 0.00 H new ATOM 0 HD12 LEU A 128 20.914 -3.389 9.920 1.00 0.00 H new ATOM 0 HD13 LEU A 128 21.243 -1.647 9.760 1.00 0.00 H new ATOM 0 HD21 LEU A 128 19.060 -0.664 11.593 1.00 0.00 H new ATOM 0 HD22 LEU A 128 19.347 0.010 9.971 1.00 0.00 H new ATOM 0 HD23 LEU A 128 17.726 -0.571 10.419 1.00 0.00 H new ATOM 1465 N ALA A 129 20.152 -5.508 8.426 1.00 0.00 N ATOM 1466 CA ALA A 129 21.341 -6.363 8.329 1.00 0.00 C ATOM 1467 C ALA A 129 21.414 -7.108 6.970 1.00 0.00 C ATOM 1468 O ALA A 129 20.369 -7.491 6.434 1.00 0.00 O ATOM 1469 CB ALA A 129 21.332 -7.344 9.508 1.00 0.00 C ATOM 0 H ALA A 129 19.429 -5.888 9.037 1.00 0.00 H new ATOM 0 HA ALA A 129 22.234 -5.739 8.377 1.00 0.00 H new ATOM 0 HB1 ALA A 129 22.210 -7.988 9.452 1.00 0.00 H new ATOM 0 HB2 ALA A 129 21.350 -6.787 10.445 1.00 0.00 H new ATOM 0 HB3 ALA A 129 20.430 -7.955 9.466 1.00 0.00 H new ATOM 1475 N PRO A 130 22.619 -7.386 6.427 1.00 0.00 N ATOM 1476 CA PRO A 130 22.781 -8.067 5.138 1.00 0.00 C ATOM 1477 C PRO A 130 22.321 -9.536 5.161 1.00 0.00 C ATOM 1478 O PRO A 130 22.048 -10.105 4.106 1.00 0.00 O ATOM 1479 CB PRO A 130 24.273 -7.944 4.803 1.00 0.00 C ATOM 1480 CG PRO A 130 24.941 -7.848 6.174 1.00 0.00 C ATOM 1481 CD PRO A 130 23.922 -7.053 6.989 1.00 0.00 C ATOM 0 HA PRO A 130 22.148 -7.607 4.379 1.00 0.00 H new ATOM 0 HB2 PRO A 130 24.631 -8.807 4.242 1.00 0.00 H new ATOM 0 HB3 PRO A 130 24.476 -7.062 4.195 1.00 0.00 H new ATOM 0 HG2 PRO A 130 25.125 -8.832 6.605 1.00 0.00 H new ATOM 0 HG3 PRO A 130 25.903 -7.339 6.121 1.00 0.00 H new ATOM 0 HD2 PRO A 130 23.972 -7.319 8.045 1.00 0.00 H new ATOM 0 HD3 PRO A 130 24.116 -5.983 6.920 1.00 0.00 H new ATOM 1489 N LYS A 131 22.200 -10.150 6.346 1.00 0.00 N ATOM 1490 CA LYS A 131 21.702 -11.521 6.535 1.00 0.00 C ATOM 1491 C LYS A 131 20.161 -11.647 6.415 1.00 0.00 C ATOM 1492 O LYS A 131 19.629 -12.760 6.378 1.00 0.00 O ATOM 1493 CB LYS A 131 22.242 -11.999 7.900 1.00 0.00 C ATOM 1494 CG LYS A 131 22.129 -13.516 8.126 1.00 0.00 C ATOM 1495 CD LYS A 131 22.843 -13.933 9.418 1.00 0.00 C ATOM 1496 CE LYS A 131 22.714 -15.448 9.625 1.00 0.00 C ATOM 1497 NZ LYS A 131 23.398 -15.896 10.867 1.00 0.00 N1+ ATOM 0 H LYS A 131 22.452 -9.695 7.223 1.00 0.00 H new ATOM 0 HA LYS A 131 22.064 -12.162 5.731 1.00 0.00 H new ATOM 0 HB2 LYS A 131 23.289 -11.707 7.987 1.00 0.00 H new ATOM 0 HB3 LYS A 131 21.701 -11.483 8.693 1.00 0.00 H new ATOM 0 HG2 LYS A 131 21.079 -13.802 8.178 1.00 0.00 H new ATOM 0 HG3 LYS A 131 22.563 -14.047 7.279 1.00 0.00 H new ATOM 0 HD2 LYS A 131 23.895 -13.653 9.368 1.00 0.00 H new ATOM 0 HD3 LYS A 131 22.412 -13.404 10.268 1.00 0.00 H new ATOM 0 HE2 LYS A 131 21.660 -15.720 9.673 1.00 0.00 H new ATOM 0 HE3 LYS A 131 23.139 -15.970 8.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 23.289 -16.925 10.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 24.409 -15.659 10.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 22.975 -15.418 11.688 1.00 0.00 H new ATOM 1511 N ALA A 132 19.429 -10.526 6.367 1.00 0.00 N ATOM 1512 CA ALA A 132 17.962 -10.480 6.357 1.00 0.00 C ATOM 1513 C ALA A 132 17.323 -11.078 5.085 1.00 0.00 C ATOM 1514 O ALA A 132 17.964 -11.215 4.041 1.00 0.00 O ATOM 1515 CB ALA A 132 17.528 -9.025 6.568 1.00 0.00 C ATOM 0 H ALA A 132 19.854 -9.600 6.333 1.00 0.00 H new ATOM 0 HA ALA A 132 17.601 -11.113 7.168 1.00 0.00 H new ATOM 0 HB1 ALA A 132 16.440 -8.966 6.564 1.00 0.00 H new ATOM 0 HB2 ALA A 132 17.908 -8.667 7.525 1.00 0.00 H new ATOM 0 HB3 ALA A 132 17.928 -8.406 5.765 1.00 0.00 H new ATOM 1521 N GLN A 133 16.028 -11.395 5.176 1.00 0.00 N ATOM 1522 CA GLN A 133 15.177 -11.872 4.083 1.00 0.00 C ATOM 1523 C GLN A 133 13.804 -11.181 4.164 1.00 0.00 C ATOM 1524 O GLN A 133 13.405 -10.691 5.226 1.00 0.00 O ATOM 1525 CB GLN A 133 15.010 -13.403 4.165 1.00 0.00 C ATOM 1526 CG GLN A 133 16.324 -14.172 3.944 1.00 0.00 C ATOM 1527 CD GLN A 133 16.103 -15.687 3.914 1.00 0.00 C ATOM 1528 OE1 GLN A 133 16.071 -16.320 2.865 1.00 0.00 O ATOM 1529 NE2 GLN A 133 15.926 -16.328 5.054 1.00 0.00 N ATOM 0 H GLN A 133 15.520 -11.322 6.058 1.00 0.00 H new ATOM 0 HA GLN A 133 15.646 -11.628 3.130 1.00 0.00 H new ATOM 0 HB2 GLN A 133 14.604 -13.665 5.142 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.281 -13.722 3.420 1.00 0.00 H new ATOM 0 HG2 GLN A 133 16.777 -13.853 3.006 1.00 0.00 H new ATOM 0 HG3 GLN A 133 17.028 -13.924 4.739 1.00 0.00 H new ATOM 0 HE21 GLN A 133 15.950 -15.816 5.936 1.00 0.00 H new ATOM 0 HE22 GLN A 133 15.766 -17.335 5.053 1.00 0.00 H new ATOM 1538 N ILE A 134 13.078 -11.133 3.042 1.00 0.00 N ATOM 1539 CA ILE A 134 11.765 -10.468 2.953 1.00 0.00 C ATOM 1540 C ILE A 134 10.684 -11.287 3.677 1.00 0.00 C ATOM 1541 O ILE A 134 10.538 -12.493 3.458 1.00 0.00 O ATOM 1542 CB ILE A 134 11.364 -10.159 1.486 1.00 0.00 C ATOM 1543 CG1 ILE A 134 12.442 -9.291 0.790 1.00 0.00 C ATOM 1544 CG2 ILE A 134 9.990 -9.449 1.438 1.00 0.00 C ATOM 1545 CD1 ILE A 134 12.165 -9.001 -0.691 1.00 0.00 C ATOM 0 H ILE A 134 13.382 -11.555 2.164 1.00 0.00 H new ATOM 0 HA ILE A 134 11.852 -9.507 3.460 1.00 0.00 H new ATOM 0 HB ILE A 134 11.288 -11.105 0.950 1.00 0.00 H new ATOM 0 HG12 ILE A 134 12.528 -8.344 1.323 1.00 0.00 H new ATOM 0 HG13 ILE A 134 13.406 -9.793 0.875 1.00 0.00 H new ATOM 0 HG21 ILE A 134 9.725 -9.240 0.402 1.00 0.00 H new ATOM 0 HG22 ILE A 134 9.232 -10.093 1.884 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.044 -8.513 1.995 1.00 0.00 H new ATOM 0 HD11 ILE A 134 12.969 -8.388 -1.098 1.00 0.00 H new ATOM 0 HD12 ILE A 134 12.110 -9.940 -1.242 1.00 0.00 H new ATOM 0 HD13 ILE A 134 11.219 -8.468 -0.787 1.00 0.00 H new ATOM 1557 N LYS A 135 9.893 -10.599 4.500 1.00 0.00 N ATOM 1558 CA LYS A 135 8.708 -11.102 5.204 1.00 0.00 C ATOM 1559 C LYS A 135 7.472 -10.259 4.830 1.00 0.00 C ATOM 1560 O LYS A 135 7.555 -9.032 4.773 1.00 0.00 O ATOM 1561 CB LYS A 135 8.991 -11.129 6.718 1.00 0.00 C ATOM 1562 CG LYS A 135 9.615 -9.837 7.281 1.00 0.00 C ATOM 1563 CD LYS A 135 9.870 -9.926 8.790 1.00 0.00 C ATOM 1564 CE LYS A 135 10.993 -10.912 9.163 1.00 0.00 C ATOM 1565 NZ LYS A 135 12.346 -10.383 8.841 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.071 -9.616 4.707 1.00 0.00 H new ATOM 0 HA LYS A 135 8.485 -12.124 4.899 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.057 -11.324 7.245 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.659 -11.963 6.934 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.555 -9.636 6.767 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.953 -8.996 7.075 1.00 0.00 H new ATOM 0 HD2 LYS A 135 10.126 -8.936 9.167 1.00 0.00 H new ATOM 0 HD3 LYS A 135 8.950 -10.229 9.289 1.00 0.00 H new ATOM 0 HE2 LYS A 135 10.938 -11.135 10.229 1.00 0.00 H new ATOM 0 HE3 LYS A 135 10.838 -11.852 8.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 13.066 -11.083 9.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 12.411 -10.195 7.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 12.508 -9.500 9.367 1.00 0.00 H new ATOM 1579 N GLU A 136 6.340 -10.906 4.549 1.00 0.00 N ATOM 1580 CA GLU A 136 5.161 -10.279 3.930 1.00 0.00 C ATOM 1581 C GLU A 136 3.945 -10.197 4.869 1.00 0.00 C ATOM 1582 O GLU A 136 3.712 -11.076 5.701 1.00 0.00 O ATOM 1583 CB GLU A 136 4.772 -11.074 2.669 1.00 0.00 C ATOM 1584 CG GLU A 136 5.853 -11.046 1.578 1.00 0.00 C ATOM 1585 CD GLU A 136 5.549 -12.073 0.476 1.00 0.00 C ATOM 1586 OE1 GLU A 136 5.816 -13.280 0.684 1.00 0.00 O ATOM 1587 OE2 GLU A 136 5.058 -11.682 -0.608 1.00 0.00 O1- ATOM 0 H GLU A 136 6.210 -11.898 4.747 1.00 0.00 H new ATOM 0 HA GLU A 136 5.440 -9.254 3.685 1.00 0.00 H new ATOM 0 HB2 GLU A 136 4.572 -12.109 2.947 1.00 0.00 H new ATOM 0 HB3 GLU A 136 3.845 -10.669 2.263 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.911 -10.048 1.144 1.00 0.00 H new ATOM 0 HG3 GLU A 136 6.826 -11.259 2.020 1.00 0.00 H new ATOM 1594 N SER A 137 3.141 -9.150 4.694 1.00 0.00 N ATOM 1595 CA SER A 137 1.812 -8.983 5.305 1.00 0.00 C ATOM 1596 C SER A 137 0.707 -9.684 4.483 1.00 0.00 C ATOM 1597 O SER A 137 0.968 -10.337 3.466 1.00 0.00 O ATOM 1598 CB SER A 137 1.482 -7.483 5.416 1.00 0.00 C ATOM 1599 OG SER A 137 2.375 -6.819 6.287 1.00 0.00 O ATOM 0 H SER A 137 3.402 -8.362 4.101 1.00 0.00 H new ATOM 0 HA SER A 137 1.842 -9.443 6.293 1.00 0.00 H new ATOM 0 HB2 SER A 137 1.528 -7.025 4.428 1.00 0.00 H new ATOM 0 HB3 SER A 137 0.461 -7.360 5.777 1.00 0.00 H new ATOM 0 HG SER A 137 1.966 -6.735 7.173 1.00 0.00 H new ATOM 1605 N LEU A 138 -0.556 -9.516 4.899 1.00 0.00 N ATOM 1606 CA LEU A 138 -1.736 -9.905 4.122 1.00 0.00 C ATOM 1607 C LEU A 138 -1.813 -9.094 2.811 1.00 0.00 C ATOM 1608 O LEU A 138 -1.283 -7.982 2.724 1.00 0.00 O ATOM 1609 CB LEU A 138 -3.018 -9.694 4.962 1.00 0.00 C ATOM 1610 CG LEU A 138 -3.209 -10.535 6.245 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -2.999 -12.037 5.996 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -2.346 -10.069 7.430 1.00 0.00 C ATOM 0 H LEU A 138 -0.788 -9.099 5.800 1.00 0.00 H new ATOM 0 HA LEU A 138 -1.653 -10.961 3.867 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -3.058 -8.643 5.247 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -3.873 -9.881 4.313 1.00 0.00 H new ATOM 0 HG LEU A 138 -4.249 -10.370 6.526 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.144 -12.584 6.928 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.717 -12.387 5.254 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -1.987 -12.207 5.630 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -2.536 -10.708 8.292 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -1.292 -10.130 7.159 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -2.597 -9.038 7.680 1.00 0.00 H new ATOM 1624 N ARG A 139 -2.507 -9.634 1.802 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.809 -8.939 0.543 1.00 0.00 C ATOM 1626 C ARG A 139 -4.184 -8.249 0.592 1.00 0.00 C ATOM 1627 O ARG A 139 -5.067 -8.659 1.351 1.00 0.00 O ATOM 1628 CB ARG A 139 -2.640 -9.916 -0.639 1.00 0.00 C ATOM 1629 CG ARG A 139 -3.822 -10.884 -0.804 1.00 0.00 C ATOM 1630 CD ARG A 139 -3.486 -12.208 -1.508 1.00 0.00 C ATOM 1631 NE ARG A 139 -3.104 -12.028 -2.919 1.00 0.00 N ATOM 1632 CZ ARG A 139 -3.096 -12.962 -3.865 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -3.430 -14.214 -3.630 1.00 0.00 N1+ ATOM 1634 NH2 ARG A 139 -2.738 -12.653 -5.091 1.00 0.00 N ATOM 0 H ARG A 139 -2.881 -10.582 1.837 1.00 0.00 H new ATOM 0 HA ARG A 139 -2.096 -8.128 0.392 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -2.517 -9.344 -1.559 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -1.725 -10.492 -0.497 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -4.229 -11.108 0.182 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -4.608 -10.381 -1.366 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -2.671 -12.699 -0.976 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -4.349 -12.872 -1.453 1.00 0.00 H new ATOM 0 HE ARG A 139 -2.816 -11.090 -3.199 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -3.709 -14.500 -2.692 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -3.410 -14.898 -4.386 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -2.466 -11.696 -5.317 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -2.732 -13.370 -5.817 1.00 0.00 H new ATOM 1648 N ALA A 140 -4.371 -7.210 -0.222 1.00 0.00 N ATOM 1649 CA ALA A 140 -5.575 -6.376 -0.262 1.00 0.00 C ATOM 1650 C ALA A 140 -5.867 -5.841 -1.673 1.00 0.00 C ATOM 1651 O ALA A 140 -4.981 -5.796 -2.522 1.00 0.00 O ATOM 1652 CB ALA A 140 -5.398 -5.217 0.723 1.00 0.00 C ATOM 0 H ALA A 140 -3.664 -6.915 -0.896 1.00 0.00 H new ATOM 0 HA ALA A 140 -6.430 -6.989 0.021 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -6.286 -4.586 0.706 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -5.254 -5.613 1.728 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -4.528 -4.626 0.437 1.00 0.00 H new ATOM 1658 N GLU A 141 -7.110 -5.434 -1.917 1.00 0.00 N ATOM 1659 CA GLU A 141 -7.606 -4.993 -3.221 1.00 0.00 C ATOM 1660 C GLU A 141 -7.749 -3.465 -3.297 1.00 0.00 C ATOM 1661 O GLU A 141 -8.250 -2.825 -2.371 1.00 0.00 O ATOM 1662 CB GLU A 141 -8.966 -5.652 -3.504 1.00 0.00 C ATOM 1663 CG GLU A 141 -8.896 -7.184 -3.514 1.00 0.00 C ATOM 1664 CD GLU A 141 -10.230 -7.794 -3.973 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -10.469 -7.884 -5.200 1.00 0.00 O1- ATOM 1666 OE2 GLU A 141 -11.045 -8.200 -3.110 1.00 0.00 O ATOM 0 H GLU A 141 -7.824 -5.400 -1.190 1.00 0.00 H new ATOM 0 HA GLU A 141 -6.876 -5.295 -3.972 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -9.684 -5.331 -2.749 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -9.339 -5.304 -4.467 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -8.095 -7.511 -4.178 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -8.651 -7.547 -2.516 1.00 0.00 H new ATOM 1673 N LEU A 142 -7.351 -2.894 -4.434 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.589 -1.506 -4.828 1.00 0.00 C ATOM 1675 C LEU A 142 -8.598 -1.489 -5.979 1.00 0.00 C ATOM 1676 O LEU A 142 -8.383 -2.134 -7.008 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.249 -0.870 -5.248 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.348 0.575 -5.782 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -7.015 1.541 -4.793 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -4.939 1.081 -6.108 1.00 0.00 C ATOM 0 H LEU A 142 -6.828 -3.413 -5.140 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.998 -0.929 -3.999 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.576 -0.878 -4.390 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.794 -1.494 -6.017 1.00 0.00 H new ATOM 0 HG LEU A 142 -6.977 0.548 -6.672 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.053 2.539 -5.229 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -8.028 1.200 -4.578 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.438 1.571 -3.869 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -4.997 2.102 -6.486 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.328 1.063 -5.206 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.488 0.439 -6.864 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.670 -0.713 -5.813 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.714 -0.467 -6.806 1.00 0.00 C ATOM 1694 C ARG A 143 -10.753 1.025 -7.152 1.00 0.00 C ATOM 1695 O ARG A 143 -11.015 1.866 -6.290 1.00 0.00 O ATOM 1696 CB ARG A 143 -12.052 -0.960 -6.226 1.00 0.00 C ATOM 1697 CG ARG A 143 -13.223 -0.808 -7.206 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.538 -1.266 -6.568 1.00 0.00 C ATOM 1699 NE ARG A 143 -15.670 -1.066 -7.492 1.00 0.00 N ATOM 1700 CZ ARG A 143 -16.958 -1.017 -7.169 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -17.376 -1.168 -5.930 1.00 0.00 N1+ ATOM 1702 NH2 ARG A 143 -17.856 -0.813 -8.107 1.00 0.00 N ATOM 0 H ARG A 143 -9.841 -0.215 -4.939 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.513 -1.008 -7.731 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.955 -2.008 -5.944 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.273 -0.404 -5.315 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.309 0.233 -7.516 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -13.028 -1.393 -8.105 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.467 -2.319 -6.296 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.713 -0.710 -5.647 1.00 0.00 H new ATOM 0 HE ARG A 143 -15.441 -0.954 -8.480 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.703 -1.329 -5.181 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.373 -1.124 -5.719 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.563 -0.693 -9.077 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -18.846 -0.774 -7.865 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.521 1.361 -8.417 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.716 2.709 -8.965 1.00 0.00 C ATOM 1718 C VAL A 144 -12.005 2.717 -9.796 1.00 0.00 C ATOM 1719 O VAL A 144 -12.123 1.962 -10.762 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.506 3.153 -9.813 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -9.694 4.600 -10.289 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.186 3.048 -9.028 1.00 0.00 C ATOM 0 H VAL A 144 -10.184 0.692 -9.110 1.00 0.00 H new ATOM 0 HA VAL A 144 -10.803 3.422 -8.145 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.450 2.482 -10.670 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -8.833 4.901 -10.886 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.598 4.669 -10.894 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -9.784 5.258 -9.425 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.359 3.370 -9.661 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.236 3.685 -8.145 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -8.027 2.014 -8.721 1.00 0.00 H new ATOM 1732 N THR A 145 -12.966 3.566 -9.415 1.00 0.00 N ATOM 1733 CA THR A 145 -14.235 3.795 -10.132 1.00 0.00 C ATOM 1734 C THR A 145 -14.125 5.057 -10.984 1.00 0.00 C ATOM 1735 O THR A 145 -13.397 5.971 -10.613 1.00 0.00 O ATOM 1736 CB THR A 145 -15.406 3.891 -9.138 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.205 4.946 -8.225 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.567 2.600 -8.334 1.00 0.00 C ATOM 0 H THR A 145 -12.883 4.134 -8.572 1.00 0.00 H new ATOM 0 HA THR A 145 -14.432 2.950 -10.792 1.00 0.00 H new ATOM 0 HB THR A 145 -16.303 4.069 -9.731 1.00 0.00 H new ATOM 0 HG1 THR A 145 -15.962 4.990 -7.604 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.403 2.704 -7.642 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.759 1.770 -9.014 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.654 2.405 -7.772 1.00 0.00 H new ATOM 1746 N GLU A 146 -14.837 5.132 -12.110 1.00 0.00 N ATOM 1747 CA GLU A 146 -14.805 6.260 -13.055 1.00 0.00 C ATOM 1748 C GLU A 146 -15.012 7.622 -12.368 1.00 0.00 C ATOM 1749 O GLU A 146 -15.723 7.731 -11.367 1.00 0.00 O ATOM 1750 CB GLU A 146 -15.912 6.095 -14.119 1.00 0.00 C ATOM 1751 CG GLU A 146 -15.679 5.014 -15.183 1.00 0.00 C ATOM 1752 CD GLU A 146 -15.731 3.556 -14.694 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -16.298 3.273 -13.612 1.00 0.00 O ATOM 1754 OE2 GLU A 146 -15.186 2.682 -15.409 1.00 0.00 O1- ATOM 0 H GLU A 146 -15.472 4.389 -12.402 1.00 0.00 H new ATOM 0 HA GLU A 146 -13.814 6.247 -13.508 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -16.848 5.874 -13.607 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -16.044 7.051 -14.626 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -16.426 5.139 -15.967 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -14.705 5.187 -15.640 1.00 0.00 H new ATOM 1761 N ARG A 147 -14.429 8.681 -12.940 1.00 0.00 N ATOM 1762 CA ARG A 147 -14.483 10.044 -12.408 1.00 0.00 C ATOM 1763 C ARG A 147 -15.932 10.532 -12.401 1.00 0.00 C ATOM 1764 O ARG A 147 -16.622 10.452 -13.423 1.00 0.00 O ATOM 1765 CB ARG A 147 -13.553 10.961 -13.219 1.00 0.00 C ATOM 1766 CG ARG A 147 -13.402 12.344 -12.563 1.00 0.00 C ATOM 1767 CD ARG A 147 -12.341 13.205 -13.262 1.00 0.00 C ATOM 1768 NE ARG A 147 -12.746 13.579 -14.631 1.00 0.00 N ATOM 1769 CZ ARG A 147 -11.976 14.151 -15.550 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -10.715 14.457 -15.317 1.00 0.00 N1+ ATOM 1771 NH2 ARG A 147 -12.472 14.427 -16.737 1.00 0.00 N ATOM 0 H ARG A 147 -13.894 8.611 -13.806 1.00 0.00 H new ATOM 0 HA ARG A 147 -14.127 10.062 -11.378 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -12.573 10.494 -13.312 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -13.948 11.078 -14.228 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -14.361 12.862 -12.587 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -13.133 12.219 -11.514 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -12.164 14.108 -12.677 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -11.398 12.659 -13.299 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.710 13.379 -14.897 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -10.301 14.255 -14.407 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -10.153 14.896 -16.047 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -13.444 14.202 -16.948 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -11.884 14.866 -17.446 1.00 0.00 H new