USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=22 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 127 SER OG : rot 180:sc= 0.17 USER MOD Set 1.2: A 135 LYS NZ :NH3+ -121:sc= 0.175 (180deg=0) USER MOD Set 2.1: A 66 ASN : amide:sc= -1.42! K(o=-1.3!,f=-1.8) USER MOD Set 2.2: A 78 LYS NZ :NH3+ -145:sc= 0.17 (180deg=0) USER MOD Set 3.1: A 51 THR OG1 : rot 180:sc= 0.545 USER MOD Set 3.2: A 109 SER OG : rot 84:sc= 1.34 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= -0.0528 X(o=-0.053,f=-0.059) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -48:sc= 1.32 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl -145:sc= 0 (180deg=-0.0248) 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= -0.026 K(o=-0.026,f=-0.98) USER MOD Single : A 75 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0.252 K(o=0.25,f=-0.71) USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 107 HIS : no HD1:sc= -0.22 X(o=-0.22,f=-0.27) USER MOD Single : A 108 MET CE :methyl -162:sc= -0.353 (180deg=-0.52) USER MOD Single : A 116 ASN : amide:sc= -0.0235 X(o=-0.024,f=-0.089) USER MOD Single : A 118 SER OG : rot 171:sc= 0.746 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot -5:sc= 1.24 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 137 SER OG : rot 93:sc= 0.0214 USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 0.620 -6.443 9.389 1.00 0.00 N ATOM 49 CA THR A 36 -0.766 -6.388 8.902 1.00 0.00 C ATOM 50 C THR A 36 -0.957 -5.175 7.986 1.00 0.00 C ATOM 51 O THR A 36 -0.149 -4.241 8.004 1.00 0.00 O ATOM 52 CB THR A 36 -1.761 -6.436 10.066 1.00 0.00 C ATOM 53 OG1 THR A 36 -3.067 -6.566 9.549 1.00 0.00 O ATOM 54 CG2 THR A 36 -1.709 -5.207 10.977 1.00 0.00 C ATOM 0 HA THR A 36 -0.972 -7.272 8.299 1.00 0.00 H new ATOM 0 HB THR A 36 -1.481 -7.293 10.679 1.00 0.00 H new ATOM 0 HG1 THR A 36 -3.710 -6.599 10.288 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.442 -5.315 11.776 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.712 -5.116 11.408 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.936 -4.313 10.396 1.00 0.00 H new ATOM 62 N PHE A 37 -2.003 -5.208 7.159 1.00 0.00 N ATOM 63 CA PHE A 37 -2.239 -4.263 6.062 1.00 0.00 C ATOM 64 C PHE A 37 -3.746 -4.048 5.831 1.00 0.00 C ATOM 65 O PHE A 37 -4.488 -5.003 5.599 1.00 0.00 O ATOM 66 CB PHE A 37 -1.524 -4.810 4.810 1.00 0.00 C ATOM 67 CG PHE A 37 -1.456 -3.887 3.607 1.00 0.00 C ATOM 68 CD1 PHE A 37 -0.987 -2.570 3.755 1.00 0.00 C ATOM 69 CD2 PHE A 37 -1.789 -4.362 2.323 1.00 0.00 C ATOM 70 CE1 PHE A 37 -0.866 -1.729 2.638 1.00 0.00 C ATOM 71 CE2 PHE A 37 -1.666 -3.521 1.202 1.00 0.00 C ATOM 72 CZ PHE A 37 -1.210 -2.201 1.360 1.00 0.00 C ATOM 0 H PHE A 37 -2.734 -5.915 7.235 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.834 -3.281 6.307 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -0.506 -5.080 5.090 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.025 -5.729 4.506 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -0.718 -2.203 4.735 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -2.140 -5.376 2.199 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -0.508 -0.718 2.761 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -1.922 -3.890 0.220 1.00 0.00 H new ATOM 0 HZ PHE A 37 -1.124 -1.551 0.502 1.00 0.00 H new ATOM 82 N SER A 38 -4.221 -2.804 5.929 1.00 0.00 N ATOM 83 CA SER A 38 -5.657 -2.459 5.896 1.00 0.00 C ATOM 84 C SER A 38 -5.968 -1.161 5.107 1.00 0.00 C ATOM 85 O SER A 38 -5.067 -0.337 4.918 1.00 0.00 O ATOM 86 CB SER A 38 -6.189 -2.373 7.340 1.00 0.00 C ATOM 87 OG SER A 38 -5.558 -1.351 8.101 1.00 0.00 O ATOM 0 H SER A 38 -3.615 -1.991 6.035 1.00 0.00 H new ATOM 0 HA SER A 38 -6.170 -3.253 5.354 1.00 0.00 H new ATOM 0 HB2 SER A 38 -7.263 -2.191 7.316 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.040 -3.333 7.835 1.00 0.00 H new ATOM 0 HG SER A 38 -5.933 -1.339 9.006 1.00 0.00 H new ATOM 93 N PRO A 39 -7.222 -0.933 4.651 1.00 0.00 N ATOM 94 CA PRO A 39 -8.359 -1.858 4.668 1.00 0.00 C ATOM 95 C PRO A 39 -8.143 -3.030 3.706 1.00 0.00 C ATOM 96 O PRO A 39 -7.319 -2.947 2.801 1.00 0.00 O ATOM 97 CB PRO A 39 -9.569 -1.027 4.225 1.00 0.00 C ATOM 98 CG PRO A 39 -8.949 0.018 3.300 1.00 0.00 C ATOM 99 CD PRO A 39 -7.602 0.296 3.962 1.00 0.00 C ATOM 0 HA PRO A 39 -8.495 -2.293 5.658 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.309 -1.637 3.706 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -10.074 -0.566 5.074 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.831 -0.360 2.284 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.562 0.917 3.236 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.854 0.573 3.219 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.678 1.127 4.663 1.00 0.00 H new ATOM 107 N ALA A 40 -8.911 -4.110 3.880 1.00 0.00 N ATOM 108 CA ALA A 40 -8.895 -5.253 2.959 1.00 0.00 C ATOM 109 C ALA A 40 -9.351 -4.874 1.534 1.00 0.00 C ATOM 110 O ALA A 40 -8.850 -5.440 0.561 1.00 0.00 O ATOM 111 CB ALA A 40 -9.773 -6.361 3.557 1.00 0.00 C ATOM 0 H ALA A 40 -9.559 -4.217 4.660 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.870 -5.606 2.850 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.777 -7.222 2.889 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.375 -6.656 4.528 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.791 -5.992 3.679 1.00 0.00 H new ATOM 117 N LEU A 41 -10.246 -3.885 1.411 1.00 0.00 N ATOM 118 CA LEU A 41 -10.675 -3.270 0.151 1.00 0.00 C ATOM 119 C LEU A 41 -10.708 -1.747 0.323 1.00 0.00 C ATOM 120 O LEU A 41 -11.423 -1.234 1.188 1.00 0.00 O ATOM 121 CB LEU A 41 -12.053 -3.834 -0.266 1.00 0.00 C ATOM 122 CG LEU A 41 -12.764 -3.084 -1.420 1.00 0.00 C ATOM 123 CD1 LEU A 41 -11.984 -3.087 -2.742 1.00 0.00 C ATOM 124 CD2 LEU A 41 -14.149 -3.701 -1.655 1.00 0.00 C ATOM 0 H LEU A 41 -10.710 -3.475 2.222 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.971 -3.508 -0.646 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.925 -4.876 -0.559 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.707 -3.826 0.606 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.840 -2.043 -1.104 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.548 -2.542 -3.499 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -11.017 -2.607 -2.595 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.832 -4.115 -3.073 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.649 -3.173 -2.467 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -14.039 -4.753 -1.919 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.744 -3.616 -0.746 1.00 0.00 H new ATOM 136 N LEU A 42 -9.971 -1.030 -0.527 1.00 0.00 N ATOM 137 CA LEU A 42 -10.035 0.426 -0.658 1.00 0.00 C ATOM 138 C LEU A 42 -10.735 0.788 -1.975 1.00 0.00 C ATOM 139 O LEU A 42 -10.307 0.332 -3.034 1.00 0.00 O ATOM 140 CB LEU A 42 -8.599 0.982 -0.605 1.00 0.00 C ATOM 141 CG LEU A 42 -8.487 2.513 -0.725 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.239 3.253 0.391 1.00 0.00 C ATOM 143 CD2 LEU A 42 -7.007 2.909 -0.674 1.00 0.00 C ATOM 0 H LEU A 42 -9.295 -1.458 -1.160 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.611 0.867 0.156 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.140 0.672 0.334 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.020 0.527 -1.408 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.943 2.800 -1.672 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.125 4.329 0.255 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.297 2.992 0.352 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.830 2.964 1.359 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.917 3.992 -0.758 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.575 2.582 0.272 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.475 2.435 -1.499 1.00 0.00 H new ATOM 155 N VAL A 43 -11.775 1.622 -1.918 1.00 0.00 N ATOM 156 CA VAL A 43 -12.462 2.166 -3.104 1.00 0.00 C ATOM 157 C VAL A 43 -12.156 3.663 -3.212 1.00 0.00 C ATOM 158 O VAL A 43 -12.408 4.414 -2.270 1.00 0.00 O ATOM 159 CB VAL A 43 -13.992 1.927 -3.075 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.628 2.328 -4.418 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.339 0.454 -2.787 1.00 0.00 C ATOM 0 H VAL A 43 -12.174 1.947 -1.037 1.00 0.00 H new ATOM 0 HA VAL A 43 -12.087 1.637 -3.980 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.391 2.545 -2.271 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.703 2.153 -4.378 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.439 3.384 -4.609 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.193 1.731 -5.219 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.422 0.331 -2.776 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.910 -0.179 -3.563 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.931 0.167 -1.818 1.00 0.00 H new ATOM 171 N VAL A 44 -11.622 4.086 -4.360 1.00 0.00 N ATOM 172 CA VAL A 44 -11.380 5.504 -4.710 1.00 0.00 C ATOM 173 C VAL A 44 -11.977 5.867 -6.074 1.00 0.00 C ATOM 174 O VAL A 44 -12.331 4.980 -6.847 1.00 0.00 O ATOM 175 CB VAL A 44 -9.876 5.866 -4.701 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.283 5.680 -3.297 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.072 5.072 -5.747 1.00 0.00 C ATOM 0 H VAL A 44 -11.335 3.442 -5.097 1.00 0.00 H new ATOM 0 HA VAL A 44 -11.881 6.086 -3.936 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.799 6.917 -4.978 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.224 5.940 -3.312 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.806 6.327 -2.593 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.397 4.641 -2.988 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.023 5.364 -5.698 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.161 4.005 -5.542 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.462 5.284 -6.743 1.00 0.00 H new ATOM 187 N THR A 45 -12.052 7.170 -6.379 1.00 0.00 N ATOM 188 CA THR A 45 -12.502 7.700 -7.678 1.00 0.00 C ATOM 189 C THR A 45 -11.305 7.942 -8.601 1.00 0.00 C ATOM 190 O THR A 45 -10.212 8.274 -8.143 1.00 0.00 O ATOM 191 CB THR A 45 -13.313 8.989 -7.476 1.00 0.00 C ATOM 192 OG1 THR A 45 -14.380 8.736 -6.584 1.00 0.00 O ATOM 193 CG2 THR A 45 -13.947 9.494 -8.774 1.00 0.00 C ATOM 0 H THR A 45 -11.796 7.902 -5.717 1.00 0.00 H new ATOM 0 HA THR A 45 -13.149 6.963 -8.153 1.00 0.00 H new ATOM 0 HB THR A 45 -12.616 9.737 -7.097 1.00 0.00 H new ATOM 0 HG1 THR A 45 -14.898 9.557 -6.452 1.00 0.00 H new ATOM 0 HG21 THR A 45 -14.508 10.407 -8.574 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.165 9.702 -9.504 1.00 0.00 H new ATOM 0 HG23 THR A 45 -14.620 8.734 -9.170 1.00 0.00 H new ATOM 201 N GLU A 46 -11.514 7.796 -9.907 1.00 0.00 N ATOM 202 CA GLU A 46 -10.517 8.016 -10.955 1.00 0.00 C ATOM 203 C GLU A 46 -9.873 9.414 -10.859 1.00 0.00 C ATOM 204 O GLU A 46 -10.547 10.443 -10.959 1.00 0.00 O ATOM 205 CB GLU A 46 -11.170 7.777 -12.328 1.00 0.00 C ATOM 206 CG GLU A 46 -10.142 7.538 -13.433 1.00 0.00 C ATOM 207 CD GLU A 46 -10.824 7.465 -14.806 1.00 0.00 C ATOM 208 OE1 GLU A 46 -10.987 8.523 -15.458 1.00 0.00 O1- ATOM 209 OE2 GLU A 46 -11.196 6.350 -15.237 1.00 0.00 O ATOM 0 H GLU A 46 -12.419 7.510 -10.281 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.702 7.305 -10.821 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.837 6.917 -12.265 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.785 8.638 -12.589 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.405 8.341 -13.430 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.603 6.610 -13.240 1.00 0.00 H new ATOM 216 N GLY A 47 -8.551 9.434 -10.665 1.00 0.00 N ATOM 217 CA GLY A 47 -7.717 10.630 -10.501 1.00 0.00 C ATOM 218 C GLY A 47 -7.548 11.110 -9.056 1.00 0.00 C ATOM 219 O GLY A 47 -6.834 12.088 -8.838 1.00 0.00 O ATOM 0 H GLY A 47 -8.005 8.574 -10.615 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.731 10.426 -10.918 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.150 11.440 -11.088 1.00 0.00 H new ATOM 223 N ASP A 48 -8.155 10.440 -8.074 1.00 0.00 N ATOM 224 CA ASP A 48 -7.933 10.697 -6.643 1.00 0.00 C ATOM 225 C ASP A 48 -6.719 9.907 -6.116 1.00 0.00 C ATOM 226 O ASP A 48 -6.317 8.897 -6.699 1.00 0.00 O ATOM 227 CB ASP A 48 -9.213 10.347 -5.859 1.00 0.00 C ATOM 228 CG ASP A 48 -9.243 10.880 -4.413 1.00 0.00 C ATOM 229 OD1 ASP A 48 -8.513 11.850 -4.096 1.00 0.00 O1- ATOM 230 OD2 ASP A 48 -10.043 10.345 -3.609 1.00 0.00 O ATOM 0 H ASP A 48 -8.825 9.692 -8.250 1.00 0.00 H new ATOM 0 HA ASP A 48 -7.709 11.754 -6.501 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.074 10.744 -6.397 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.325 9.263 -5.836 1.00 0.00 H new ATOM 235 N ASN A 49 -6.135 10.346 -5.000 1.00 0.00 N ATOM 236 CA ASN A 49 -5.125 9.579 -4.278 1.00 0.00 C ATOM 237 C ASN A 49 -5.769 8.503 -3.380 1.00 0.00 C ATOM 238 O ASN A 49 -6.900 8.641 -2.905 1.00 0.00 O ATOM 239 CB ASN A 49 -4.164 10.505 -3.513 1.00 0.00 C ATOM 240 CG ASN A 49 -4.856 11.396 -2.487 1.00 0.00 C ATOM 241 OD1 ASN A 49 -5.190 10.973 -1.387 1.00 0.00 O ATOM 242 ND2 ASN A 49 -5.080 12.655 -2.820 1.00 0.00 N ATOM 0 H ASN A 49 -6.351 11.246 -4.572 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.520 9.042 -5.008 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -3.415 9.897 -3.006 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -3.634 11.134 -4.228 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -5.535 13.284 -2.159 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -4.798 12.998 -3.738 1.00 0.00 H new ATOM 249 N ALA A 50 -5.031 7.414 -3.170 1.00 0.00 N ATOM 250 CA ALA A 50 -5.462 6.200 -2.473 1.00 0.00 C ATOM 251 C ALA A 50 -4.398 5.752 -1.462 1.00 0.00 C ATOM 252 O ALA A 50 -3.263 5.501 -1.874 1.00 0.00 O ATOM 253 CB ALA A 50 -5.683 5.117 -3.542 1.00 0.00 C ATOM 0 H ALA A 50 -4.067 7.350 -3.497 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.381 6.382 -1.915 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.006 4.193 -3.062 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.449 5.449 -4.243 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.751 4.940 -4.079 1.00 0.00 H new ATOM 259 N THR A 51 -4.744 5.626 -0.171 1.00 0.00 N ATOM 260 CA THR A 51 -3.785 5.274 0.892 1.00 0.00 C ATOM 261 C THR A 51 -4.287 4.117 1.749 1.00 0.00 C ATOM 262 O THR A 51 -5.383 4.174 2.305 1.00 0.00 O ATOM 263 CB THR A 51 -3.438 6.490 1.760 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.033 7.546 0.915 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.279 6.211 2.723 1.00 0.00 C ATOM 0 H THR A 51 -5.696 5.765 0.167 1.00 0.00 H new ATOM 0 HA THR A 51 -2.871 4.943 0.398 1.00 0.00 H new ATOM 0 HB THR A 51 -4.326 6.737 2.342 1.00 0.00 H new ATOM 0 HG1 THR A 51 -2.809 8.331 1.457 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.074 7.104 3.314 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.548 5.390 3.388 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.390 5.941 2.154 1.00 0.00 H new ATOM 273 N PHE A 52 -3.444 3.090 1.875 1.00 0.00 N ATOM 274 CA PHE A 52 -3.583 1.966 2.802 1.00 0.00 C ATOM 275 C PHE A 52 -2.649 2.166 4.008 1.00 0.00 C ATOM 276 O PHE A 52 -1.620 2.842 3.899 1.00 0.00 O ATOM 277 CB PHE A 52 -3.204 0.657 2.094 1.00 0.00 C ATOM 278 CG PHE A 52 -4.068 0.233 0.924 1.00 0.00 C ATOM 279 CD1 PHE A 52 -3.773 0.695 -0.374 1.00 0.00 C ATOM 280 CD2 PHE A 52 -5.114 -0.691 1.118 1.00 0.00 C ATOM 281 CE1 PHE A 52 -4.516 0.230 -1.473 1.00 0.00 C ATOM 282 CE2 PHE A 52 -5.859 -1.151 0.019 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.556 -0.695 -1.275 1.00 0.00 C ATOM 0 H PHE A 52 -2.602 3.017 1.303 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.618 1.916 3.141 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -2.177 0.748 1.741 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -3.218 -0.144 2.833 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -2.975 1.407 -0.525 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -5.343 -1.046 2.112 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.288 0.583 -2.468 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -6.664 -1.855 0.169 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.124 -1.056 -2.120 1.00 0.00 H new ATOM 293 N THR A 53 -2.968 1.526 5.134 1.00 0.00 N ATOM 294 CA THR A 53 -2.153 1.517 6.357 1.00 0.00 C ATOM 295 C THR A 53 -1.482 0.157 6.513 1.00 0.00 C ATOM 296 O THR A 53 -2.164 -0.866 6.555 1.00 0.00 O ATOM 297 CB THR A 53 -3.021 1.823 7.584 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.737 3.024 7.366 1.00 0.00 O ATOM 299 CG2 THR A 53 -2.165 2.010 8.839 1.00 0.00 C ATOM 0 H THR A 53 -3.826 0.982 5.226 1.00 0.00 H new ATOM 0 HA THR A 53 -1.388 2.289 6.278 1.00 0.00 H new ATOM 0 HB THR A 53 -3.697 0.981 7.730 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.293 3.220 8.149 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.810 2.226 9.691 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.600 1.098 9.033 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.474 2.840 8.688 1.00 0.00 H new ATOM 307 N CYS A 54 -0.152 0.143 6.619 1.00 0.00 N ATOM 308 CA CYS A 54 0.642 -1.029 7.005 1.00 0.00 C ATOM 309 C CYS A 54 1.176 -0.846 8.432 1.00 0.00 C ATOM 310 O CYS A 54 1.691 0.219 8.780 1.00 0.00 O ATOM 311 CB CYS A 54 1.792 -1.264 6.012 1.00 0.00 C ATOM 312 SG CYS A 54 2.731 -2.782 6.352 1.00 0.00 S ATOM 0 H CYS A 54 0.419 0.967 6.434 1.00 0.00 H new ATOM 0 HA CYS A 54 0.002 -1.911 6.981 1.00 0.00 H new ATOM 0 HB2 CYS A 54 1.387 -1.314 5.001 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.470 -0.411 6.042 1.00 0.00 H new ATOM 317 N SER A 55 1.075 -1.878 9.262 1.00 0.00 N ATOM 318 CA SER A 55 1.439 -1.819 10.684 1.00 0.00 C ATOM 319 C SER A 55 2.286 -3.038 11.065 1.00 0.00 C ATOM 320 O SER A 55 1.875 -4.173 10.812 1.00 0.00 O ATOM 321 CB SER A 55 0.175 -1.791 11.567 1.00 0.00 C ATOM 322 OG SER A 55 -0.797 -0.843 11.148 1.00 0.00 O ATOM 0 H SER A 55 0.734 -2.793 8.968 1.00 0.00 H new ATOM 0 HA SER A 55 2.013 -0.907 10.848 1.00 0.00 H new ATOM 0 HB2 SER A 55 -0.277 -2.783 11.570 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.466 -1.570 12.594 1.00 0.00 H new ATOM 0 HG SER A 55 -0.363 0.020 10.984 1.00 0.00 H new ATOM 328 N PHE A 56 3.444 -2.821 11.703 1.00 0.00 N ATOM 329 CA PHE A 56 4.301 -3.881 12.249 1.00 0.00 C ATOM 330 C PHE A 56 5.244 -3.342 13.337 1.00 0.00 C ATOM 331 O PHE A 56 5.575 -2.156 13.359 1.00 0.00 O ATOM 332 CB PHE A 56 5.052 -4.635 11.132 1.00 0.00 C ATOM 333 CG PHE A 56 6.339 -4.030 10.600 1.00 0.00 C ATOM 334 CD1 PHE A 56 6.305 -2.904 9.754 1.00 0.00 C ATOM 335 CD2 PHE A 56 7.570 -4.662 10.869 1.00 0.00 C ATOM 336 CE1 PHE A 56 7.494 -2.422 9.179 1.00 0.00 C ATOM 337 CE2 PHE A 56 8.755 -4.192 10.273 1.00 0.00 C ATOM 338 CZ PHE A 56 8.714 -3.079 9.417 1.00 0.00 C ATOM 0 H PHE A 56 3.818 -1.885 11.857 1.00 0.00 H new ATOM 0 HA PHE A 56 3.654 -4.612 12.735 1.00 0.00 H new ATOM 0 HB2 PHE A 56 5.281 -5.635 11.501 1.00 0.00 H new ATOM 0 HB3 PHE A 56 4.368 -4.754 10.292 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.366 -2.411 9.547 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.604 -5.511 11.536 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.470 -1.543 8.552 1.00 0.00 H new ATOM 0 HE2 PHE A 56 9.694 -4.686 10.473 1.00 0.00 H new ATOM 0 HZ PHE A 56 9.619 -2.728 8.942 1.00 0.00 H new ATOM 424 N PHE A 63 16.178 -1.866 8.989 1.00 0.00 N ATOM 425 CA PHE A 63 15.308 -2.332 7.905 1.00 0.00 C ATOM 426 C PHE A 63 14.921 -1.261 6.871 1.00 0.00 C ATOM 427 O PHE A 63 15.098 -0.059 7.082 1.00 0.00 O ATOM 428 CB PHE A 63 14.032 -2.925 8.548 1.00 0.00 C ATOM 429 CG PHE A 63 13.105 -1.876 9.148 1.00 0.00 C ATOM 430 CD1 PHE A 63 13.351 -1.362 10.437 1.00 0.00 C ATOM 431 CD2 PHE A 63 12.032 -1.359 8.392 1.00 0.00 C ATOM 432 CE1 PHE A 63 12.556 -0.324 10.952 1.00 0.00 C ATOM 433 CE2 PHE A 63 11.236 -0.321 8.908 1.00 0.00 C ATOM 434 CZ PHE A 63 11.505 0.204 10.184 1.00 0.00 C ATOM 0 HA PHE A 63 15.874 -3.072 7.339 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.485 -3.492 7.794 1.00 0.00 H new ATOM 0 HB3 PHE A 63 14.322 -3.629 9.328 1.00 0.00 H new ATOM 0 HD1 PHE A 63 14.155 -1.768 11.032 1.00 0.00 H new ATOM 0 HD2 PHE A 63 11.821 -1.762 7.413 1.00 0.00 H new ATOM 0 HE1 PHE A 63 12.753 0.068 11.939 1.00 0.00 H new ATOM 0 HE2 PHE A 63 10.418 0.073 8.324 1.00 0.00 H new ATOM 0 HZ PHE A 63 10.904 1.013 10.573 1.00 0.00 H new ATOM 444 N VAL A 64 14.341 -1.736 5.768 1.00 0.00 N ATOM 445 CA VAL A 64 13.640 -0.971 4.724 1.00 0.00 C ATOM 446 C VAL A 64 12.233 -1.570 4.598 1.00 0.00 C ATOM 447 O VAL A 64 12.093 -2.792 4.570 1.00 0.00 O ATOM 448 CB VAL A 64 14.369 -1.058 3.358 1.00 0.00 C ATOM 449 CG1 VAL A 64 13.641 -0.250 2.271 1.00 0.00 C ATOM 450 CG2 VAL A 64 15.818 -0.554 3.453 1.00 0.00 C ATOM 0 H VAL A 64 14.346 -2.735 5.562 1.00 0.00 H new ATOM 0 HA VAL A 64 13.608 0.083 5.001 1.00 0.00 H new ATOM 0 HB VAL A 64 14.370 -2.113 3.085 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.183 -0.336 1.329 1.00 0.00 H new ATOM 0 HG12 VAL A 64 12.630 -0.638 2.145 1.00 0.00 H new ATOM 0 HG13 VAL A 64 13.593 0.798 2.567 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.295 -0.631 2.476 1.00 0.00 H new ATOM 0 HG22 VAL A 64 15.821 0.487 3.777 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.367 -1.160 4.174 1.00 0.00 H new ATOM 460 N LEU A 65 11.192 -0.736 4.520 1.00 0.00 N ATOM 461 CA LEU A 65 9.821 -1.176 4.239 1.00 0.00 C ATOM 462 C LEU A 65 9.493 -0.949 2.762 1.00 0.00 C ATOM 463 O LEU A 65 9.844 0.086 2.207 1.00 0.00 O ATOM 464 CB LEU A 65 8.831 -0.429 5.151 1.00 0.00 C ATOM 465 CG LEU A 65 7.405 -1.014 5.090 1.00 0.00 C ATOM 466 CD1 LEU A 65 7.378 -2.460 5.604 1.00 0.00 C ATOM 467 CD2 LEU A 65 6.450 -0.146 5.909 1.00 0.00 C ATOM 0 H LEU A 65 11.277 0.272 4.651 1.00 0.00 H new ATOM 0 HA LEU A 65 9.733 -2.242 4.446 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.191 -0.467 6.179 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.800 0.622 4.863 1.00 0.00 H new ATOM 0 HG LEU A 65 7.082 -1.020 4.049 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.360 -2.847 5.549 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.034 -3.077 4.990 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.721 -2.485 6.638 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.445 -0.566 5.861 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.783 -0.119 6.947 1.00 0.00 H new ATOM 0 HD23 LEU A 65 6.440 0.866 5.504 1.00 0.00 H new ATOM 479 N ASN A 66 8.811 -1.906 2.133 1.00 0.00 N ATOM 480 CA ASN A 66 8.537 -1.930 0.694 1.00 0.00 C ATOM 481 C ASN A 66 7.050 -2.203 0.408 1.00 0.00 C ATOM 482 O ASN A 66 6.336 -2.777 1.240 1.00 0.00 O ATOM 483 CB ASN A 66 9.383 -3.024 0.020 1.00 0.00 C ATOM 484 CG ASN A 66 10.844 -3.056 0.460 1.00 0.00 C ATOM 485 OD1 ASN A 66 11.708 -2.406 -0.116 1.00 0.00 O ATOM 486 ND2 ASN A 66 11.154 -3.825 1.488 1.00 0.00 N ATOM 0 H ASN A 66 8.422 -2.711 2.624 1.00 0.00 H new ATOM 0 HA ASN A 66 8.795 -0.950 0.292 1.00 0.00 H new ATOM 0 HB2 ASN A 66 8.933 -3.994 0.229 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.345 -2.881 -1.060 1.00 0.00 H new ATOM 0 HD21 ASN A 66 12.120 -3.882 1.809 1.00 0.00 H new ATOM 0 HD22 ASN A 66 10.427 -4.362 1.961 1.00 0.00 H new ATOM 493 N TRP A 67 6.601 -1.832 -0.792 1.00 0.00 N ATOM 494 CA TRP A 67 5.234 -2.061 -1.270 1.00 0.00 C ATOM 495 C TRP A 67 5.212 -2.800 -2.616 1.00 0.00 C ATOM 496 O TRP A 67 6.003 -2.490 -3.512 1.00 0.00 O ATOM 497 CB TRP A 67 4.546 -0.697 -1.376 1.00 0.00 C ATOM 498 CG TRP A 67 3.058 -0.684 -1.554 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.194 -1.700 -1.319 1.00 0.00 C ATOM 500 CD2 TRP A 67 2.227 0.450 -1.938 1.00 0.00 C ATOM 501 NE1 TRP A 67 0.903 -1.287 -1.570 1.00 0.00 N ATOM 502 CE2 TRP A 67 0.859 0.040 -1.925 1.00 0.00 C ATOM 503 CE3 TRP A 67 2.493 1.800 -2.246 1.00 0.00 C ATOM 504 CZ2 TRP A 67 -0.194 0.928 -2.180 1.00 0.00 C ATOM 505 CZ3 TRP A 67 1.445 2.701 -2.495 1.00 0.00 C ATOM 506 CH2 TRP A 67 0.106 2.273 -2.444 1.00 0.00 C ATOM 0 H TRP A 67 7.189 -1.354 -1.474 1.00 0.00 H new ATOM 0 HA TRP A 67 4.702 -2.703 -0.567 1.00 0.00 H new ATOM 0 HB2 TRP A 67 4.782 -0.131 -0.475 1.00 0.00 H new ATOM 0 HB3 TRP A 67 4.990 -0.161 -2.215 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.475 -2.688 -0.984 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.083 -1.890 -1.501 1.00 0.00 H new ATOM 0 HE3 TRP A 67 3.515 2.145 -2.291 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -1.218 0.584 -2.174 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 1.669 3.732 -2.728 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -0.693 2.981 -2.608 1.00 0.00 H new ATOM 517 N TYR A 68 4.298 -3.765 -2.764 1.00 0.00 N ATOM 518 CA TYR A 68 4.174 -4.624 -3.943 1.00 0.00 C ATOM 519 C TYR A 68 2.730 -4.710 -4.469 1.00 0.00 C ATOM 520 O TYR A 68 1.774 -4.745 -3.688 1.00 0.00 O ATOM 521 CB TYR A 68 4.674 -6.035 -3.588 1.00 0.00 C ATOM 522 CG TYR A 68 6.061 -6.078 -2.974 1.00 0.00 C ATOM 523 CD1 TYR A 68 7.200 -6.108 -3.800 1.00 0.00 C ATOM 524 CD2 TYR A 68 6.210 -6.065 -1.571 1.00 0.00 C ATOM 525 CE1 TYR A 68 8.488 -6.114 -3.232 1.00 0.00 C ATOM 526 CE2 TYR A 68 7.495 -6.069 -0.997 1.00 0.00 C ATOM 527 CZ TYR A 68 8.639 -6.090 -1.827 1.00 0.00 C ATOM 528 OH TYR A 68 9.883 -6.083 -1.269 1.00 0.00 O ATOM 0 H TYR A 68 3.605 -3.975 -2.045 1.00 0.00 H new ATOM 0 HA TYR A 68 4.778 -4.183 -4.736 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.969 -6.492 -2.893 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.672 -6.645 -4.491 1.00 0.00 H new ATOM 0 HD1 TYR A 68 7.085 -6.126 -4.874 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.336 -6.052 -0.936 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.360 -6.137 -3.869 1.00 0.00 H new ATOM 0 HE2 TYR A 68 7.607 -6.056 0.077 1.00 0.00 H new ATOM 0 HH TYR A 68 9.803 -6.065 -0.292 1.00 0.00 H new ATOM 538 N ARG A 69 2.584 -4.797 -5.797 1.00 0.00 N ATOM 539 CA ARG A 69 1.332 -5.128 -6.499 1.00 0.00 C ATOM 540 C ARG A 69 1.443 -6.552 -7.046 1.00 0.00 C ATOM 541 O ARG A 69 2.519 -6.935 -7.504 1.00 0.00 O ATOM 542 CB ARG A 69 1.094 -4.136 -7.650 1.00 0.00 C ATOM 543 CG ARG A 69 -0.251 -4.359 -8.352 1.00 0.00 C ATOM 544 CD ARG A 69 -0.474 -3.325 -9.457 1.00 0.00 C ATOM 545 NE ARG A 69 -1.810 -3.470 -10.056 1.00 0.00 N ATOM 546 CZ ARG A 69 -2.244 -2.857 -11.149 1.00 0.00 C ATOM 547 NH1 ARG A 69 -1.488 -2.038 -11.849 1.00 0.00 N1+ ATOM 548 NH2 ARG A 69 -3.470 -3.044 -11.579 1.00 0.00 N ATOM 0 H ARG A 69 3.361 -4.633 -6.438 1.00 0.00 H new ATOM 0 HA ARG A 69 0.491 -5.061 -5.809 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.133 -3.118 -7.261 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.900 -4.230 -8.378 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -0.281 -5.362 -8.777 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -1.059 -4.297 -7.624 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.363 -2.321 -9.048 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.288 -3.441 -10.228 1.00 0.00 H new ATOM 0 HE ARG A 69 -2.462 -4.099 -9.588 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -0.528 -1.854 -11.556 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -1.862 -1.587 -12.684 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -4.099 -3.666 -11.071 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -3.793 -2.567 -12.421 1.00 0.00 H new ATOM 562 N MET A 70 0.365 -7.336 -7.028 1.00 0.00 N ATOM 563 CA MET A 70 0.353 -8.686 -7.610 1.00 0.00 C ATOM 564 C MET A 70 0.096 -8.670 -9.123 1.00 0.00 C ATOM 565 O MET A 70 -0.705 -7.883 -9.628 1.00 0.00 O ATOM 566 CB MET A 70 -0.670 -9.585 -6.910 1.00 0.00 C ATOM 567 CG MET A 70 -0.417 -9.671 -5.400 1.00 0.00 C ATOM 568 SD MET A 70 -1.009 -11.203 -4.645 1.00 0.00 S ATOM 569 CE MET A 70 0.332 -12.305 -5.169 1.00 0.00 C ATOM 0 H MET A 70 -0.524 -7.058 -6.612 1.00 0.00 H new ATOM 0 HA MET A 70 1.350 -9.097 -7.450 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.674 -9.200 -7.089 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.631 -10.585 -7.342 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.653 -9.576 -5.215 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.902 -8.826 -4.911 1.00 0.00 H new ATOM 0 HE1 MET A 70 -0.071 -13.297 -5.374 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.797 -11.909 -6.072 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.078 -12.373 -4.377 1.00 0.00 H new ATOM 579 N SER A 71 0.746 -9.580 -9.839 1.00 0.00 N ATOM 580 CA SER A 71 0.589 -9.800 -11.285 1.00 0.00 C ATOM 581 C SER A 71 -0.217 -11.088 -11.567 1.00 0.00 C ATOM 582 O SER A 71 -0.100 -12.052 -10.798 1.00 0.00 O ATOM 583 CB SER A 71 1.974 -9.901 -11.944 1.00 0.00 C ATOM 584 OG SER A 71 2.700 -8.687 -11.805 1.00 0.00 O ATOM 0 H SER A 71 1.426 -10.214 -9.418 1.00 0.00 H new ATOM 0 HA SER A 71 0.041 -8.956 -11.704 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.536 -10.718 -11.491 1.00 0.00 H new ATOM 0 HB3 SER A 71 1.860 -10.140 -13.001 1.00 0.00 H new ATOM 0 HG SER A 71 3.577 -8.780 -12.232 1.00 0.00 H new ATOM 590 N PRO A 72 -0.997 -11.150 -12.671 1.00 0.00 N ATOM 591 CA PRO A 72 -1.913 -12.258 -12.967 1.00 0.00 C ATOM 592 C PRO A 72 -1.206 -13.587 -13.287 1.00 0.00 C ATOM 593 O PRO A 72 -1.828 -14.643 -13.199 1.00 0.00 O ATOM 594 CB PRO A 72 -2.768 -11.776 -14.145 1.00 0.00 C ATOM 595 CG PRO A 72 -1.861 -10.781 -14.861 1.00 0.00 C ATOM 596 CD PRO A 72 -1.110 -10.126 -13.704 1.00 0.00 C ATOM 0 HA PRO A 72 -2.511 -12.492 -12.086 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.053 -12.601 -14.798 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.691 -11.305 -13.805 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.183 -11.277 -15.556 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.432 -10.053 -15.438 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -0.126 -9.782 -14.022 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.648 -9.254 -13.333 1.00 0.00 H new ATOM 604 N SER A 73 0.095 -13.564 -13.590 1.00 0.00 N ATOM 605 CA SER A 73 0.943 -14.760 -13.753 1.00 0.00 C ATOM 606 C SER A 73 1.354 -15.405 -12.406 1.00 0.00 C ATOM 607 O SER A 73 2.217 -16.285 -12.376 1.00 0.00 O ATOM 608 CB SER A 73 2.203 -14.382 -14.556 1.00 0.00 C ATOM 609 OG SER A 73 1.876 -13.731 -15.782 1.00 0.00 O ATOM 0 H SER A 73 0.606 -12.693 -13.734 1.00 0.00 H new ATOM 0 HA SER A 73 0.352 -15.504 -14.287 1.00 0.00 H new ATOM 0 HB2 SER A 73 2.834 -13.728 -13.955 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.783 -15.281 -14.765 1.00 0.00 H new ATOM 0 HG SER A 73 2.700 -13.505 -16.262 1.00 0.00 H new ATOM 615 N ASN A 74 0.775 -14.943 -11.287 1.00 0.00 N ATOM 616 CA ASN A 74 1.040 -15.353 -9.899 1.00 0.00 C ATOM 617 C ASN A 74 2.419 -14.850 -9.414 1.00 0.00 C ATOM 618 O ASN A 74 3.229 -15.597 -8.856 1.00 0.00 O ATOM 619 CB ASN A 74 0.802 -16.866 -9.697 1.00 0.00 C ATOM 620 CG ASN A 74 0.734 -17.278 -8.225 1.00 0.00 C ATOM 621 OD1 ASN A 74 0.482 -16.479 -7.330 1.00 0.00 O ATOM 622 ND2 ASN A 74 0.944 -18.550 -7.933 1.00 0.00 N ATOM 0 H ASN A 74 0.057 -14.220 -11.332 1.00 0.00 H new ATOM 0 HA ASN A 74 0.314 -14.864 -9.250 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -0.128 -17.149 -10.189 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.603 -17.421 -10.186 1.00 0.00 H new ATOM 0 HD21 ASN A 74 0.896 -18.865 -6.964 1.00 0.00 H new ATOM 0 HD22 ASN A 74 1.154 -19.216 -8.677 1.00 0.00 H new ATOM 629 N GLN A 75 2.706 -13.572 -9.687 1.00 0.00 N ATOM 630 CA GLN A 75 3.963 -12.885 -9.353 1.00 0.00 C ATOM 631 C GLN A 75 3.668 -11.532 -8.670 1.00 0.00 C ATOM 632 O GLN A 75 2.510 -11.229 -8.365 1.00 0.00 O ATOM 633 CB GLN A 75 4.815 -12.724 -10.633 1.00 0.00 C ATOM 634 CG GLN A 75 5.220 -14.066 -11.271 1.00 0.00 C ATOM 635 CD GLN A 75 6.120 -13.870 -12.493 1.00 0.00 C ATOM 636 OE1 GLN A 75 5.674 -13.866 -13.635 1.00 0.00 O ATOM 637 NE2 GLN A 75 7.413 -13.682 -12.312 1.00 0.00 N ATOM 0 H GLN A 75 2.044 -12.962 -10.166 1.00 0.00 H new ATOM 0 HA GLN A 75 4.537 -13.480 -8.643 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.255 -12.138 -11.362 1.00 0.00 H new ATOM 0 HB3 GLN A 75 5.715 -12.158 -10.393 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.739 -14.677 -10.532 1.00 0.00 H new ATOM 0 HG3 GLN A 75 4.324 -14.613 -11.564 1.00 0.00 H new ATOM 0 HE21 GLN A 75 7.801 -13.682 -11.369 1.00 0.00 H new ATOM 0 HE22 GLN A 75 8.025 -13.536 -13.115 1.00 0.00 H new ATOM 646 N THR A 76 4.700 -10.711 -8.436 1.00 0.00 N ATOM 647 CA THR A 76 4.633 -9.414 -7.743 1.00 0.00 C ATOM 648 C THR A 76 5.612 -8.429 -8.360 1.00 0.00 C ATOM 649 O THR A 76 6.684 -8.818 -8.827 1.00 0.00 O ATOM 650 CB THR A 76 4.937 -9.523 -6.237 1.00 0.00 C ATOM 651 OG1 THR A 76 5.954 -10.472 -5.985 1.00 0.00 O ATOM 652 CG2 THR A 76 3.702 -9.901 -5.423 1.00 0.00 C ATOM 0 H THR A 76 5.647 -10.941 -8.737 1.00 0.00 H new ATOM 0 HA THR A 76 3.608 -9.063 -7.860 1.00 0.00 H new ATOM 0 HB THR A 76 5.272 -8.533 -5.926 1.00 0.00 H new ATOM 0 HG1 THR A 76 6.127 -10.518 -5.021 1.00 0.00 H new ATOM 0 HG21 THR A 76 3.967 -9.965 -4.368 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.931 -9.142 -5.558 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.324 -10.866 -5.762 1.00 0.00 H new ATOM 660 N ASP A 77 5.260 -7.146 -8.317 1.00 0.00 N ATOM 661 CA ASP A 77 6.087 -6.030 -8.780 1.00 0.00 C ATOM 662 C ASP A 77 6.277 -4.982 -7.677 1.00 0.00 C ATOM 663 O ASP A 77 5.318 -4.590 -7.009 1.00 0.00 O ATOM 664 CB ASP A 77 5.415 -5.393 -9.999 1.00 0.00 C ATOM 665 CG ASP A 77 6.327 -4.392 -10.730 1.00 0.00 C ATOM 666 OD1 ASP A 77 7.500 -4.736 -11.015 1.00 0.00 O ATOM 667 OD2 ASP A 77 5.858 -3.272 -11.042 1.00 0.00 O1- ATOM 0 H ASP A 77 4.360 -6.842 -7.946 1.00 0.00 H new ATOM 0 HA ASP A 77 7.073 -6.408 -9.048 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.115 -6.178 -10.694 1.00 0.00 H new ATOM 0 HB3 ASP A 77 4.505 -4.883 -9.681 1.00 0.00 H new ATOM 672 N LYS A 78 7.515 -4.516 -7.500 1.00 0.00 N ATOM 673 CA LYS A 78 7.878 -3.514 -6.491 1.00 0.00 C ATOM 674 C LYS A 78 7.500 -2.091 -6.946 1.00 0.00 C ATOM 675 O LYS A 78 7.785 -1.686 -8.077 1.00 0.00 O ATOM 676 CB LYS A 78 9.376 -3.640 -6.158 1.00 0.00 C ATOM 677 CG LYS A 78 9.745 -2.831 -4.906 1.00 0.00 C ATOM 678 CD LYS A 78 11.235 -2.965 -4.574 1.00 0.00 C ATOM 679 CE LYS A 78 11.523 -2.236 -3.257 1.00 0.00 C ATOM 680 NZ LYS A 78 12.953 -2.318 -2.874 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.307 -4.828 -8.062 1.00 0.00 H new ATOM 0 HA LYS A 78 7.308 -3.702 -5.581 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.628 -4.689 -6.002 1.00 0.00 H new ATOM 0 HB3 LYS A 78 9.968 -3.293 -7.004 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.499 -1.781 -5.064 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.150 -3.175 -4.060 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.508 -4.017 -4.489 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.839 -2.543 -5.377 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.233 -1.190 -3.352 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.911 -2.666 -2.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.032 -2.380 -1.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.380 -3.162 -3.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.451 -1.469 -3.209 1.00 0.00 H new ATOM 694 N LEU A 79 6.864 -1.335 -6.048 1.00 0.00 N ATOM 695 CA LEU A 79 6.229 -0.044 -6.340 1.00 0.00 C ATOM 696 C LEU A 79 7.008 1.143 -5.762 1.00 0.00 C ATOM 697 O LEU A 79 7.234 2.134 -6.459 1.00 0.00 O ATOM 698 CB LEU A 79 4.816 -0.080 -5.733 1.00 0.00 C ATOM 699 CG LEU A 79 3.925 -1.243 -6.211 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.676 -1.239 -5.329 1.00 0.00 C ATOM 701 CD2 LEU A 79 3.567 -1.114 -7.698 1.00 0.00 C ATOM 0 H LEU A 79 6.773 -1.610 -5.070 1.00 0.00 H new ATOM 0 HA LEU A 79 6.204 0.099 -7.420 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.905 -0.134 -4.648 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.314 0.860 -5.965 1.00 0.00 H new ATOM 0 HG LEU A 79 4.456 -2.190 -6.119 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.013 -2.049 -5.633 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.966 -1.378 -4.287 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.157 -0.286 -5.437 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.938 -1.953 -7.995 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.028 -0.181 -7.863 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.480 -1.116 -8.294 1.00 0.00 H new ATOM 713 N ALA A 80 7.410 1.029 -4.492 1.00 0.00 N ATOM 714 CA ALA A 80 8.026 2.074 -3.671 1.00 0.00 C ATOM 715 C ALA A 80 8.572 1.477 -2.358 1.00 0.00 C ATOM 716 O ALA A 80 8.273 0.326 -2.018 1.00 0.00 O ATOM 717 CB ALA A 80 6.990 3.186 -3.414 1.00 0.00 C ATOM 0 H ALA A 80 7.308 0.153 -3.980 1.00 0.00 H new ATOM 0 HA ALA A 80 8.875 2.510 -4.197 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.440 3.969 -2.803 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.667 3.609 -4.365 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.130 2.768 -2.892 1.00 0.00 H new ATOM 723 N ALA A 81 9.350 2.273 -1.615 1.00 0.00 N ATOM 724 CA ALA A 81 9.975 1.887 -0.349 1.00 0.00 C ATOM 725 C ALA A 81 10.330 3.093 0.545 1.00 0.00 C ATOM 726 O ALA A 81 10.422 4.226 0.066 1.00 0.00 O ATOM 727 CB ALA A 81 11.216 1.034 -0.656 1.00 0.00 C ATOM 0 H ALA A 81 9.567 3.231 -1.888 1.00 0.00 H new ATOM 0 HA ALA A 81 9.253 1.307 0.225 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.694 0.738 0.278 1.00 0.00 H new ATOM 0 HB2 ALA A 81 10.918 0.144 -1.209 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.918 1.615 -1.254 1.00 0.00 H new ATOM 733 N PHE A 82 10.550 2.829 1.838 1.00 0.00 N ATOM 734 CA PHE A 82 11.005 3.783 2.854 1.00 0.00 C ATOM 735 C PHE A 82 12.032 3.109 3.794 1.00 0.00 C ATOM 736 O PHE A 82 11.676 2.111 4.429 1.00 0.00 O ATOM 737 CB PHE A 82 9.795 4.289 3.652 1.00 0.00 C ATOM 738 CG PHE A 82 10.118 5.389 4.643 1.00 0.00 C ATOM 739 CD1 PHE A 82 10.496 5.071 5.962 1.00 0.00 C ATOM 740 CD2 PHE A 82 10.046 6.737 4.243 1.00 0.00 C ATOM 741 CE1 PHE A 82 10.808 6.097 6.871 1.00 0.00 C ATOM 742 CE2 PHE A 82 10.341 7.762 5.159 1.00 0.00 C ATOM 743 CZ PHE A 82 10.724 7.442 6.473 1.00 0.00 C ATOM 0 H PHE A 82 10.408 1.895 2.223 1.00 0.00 H new ATOM 0 HA PHE A 82 11.491 4.629 2.368 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.041 4.654 2.954 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.352 3.450 4.189 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.546 4.039 6.275 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.764 6.984 3.230 1.00 0.00 H new ATOM 0 HE1 PHE A 82 11.113 5.851 7.877 1.00 0.00 H new ATOM 0 HE2 PHE A 82 10.273 8.796 4.853 1.00 0.00 H new ATOM 0 HZ PHE A 82 10.953 8.229 7.176 1.00 0.00 H new ATOM 753 N PRO A 83 13.271 3.626 3.941 1.00 0.00 N ATOM 754 CA PRO A 83 13.885 4.723 3.187 1.00 0.00 C ATOM 755 C PRO A 83 13.852 4.521 1.666 1.00 0.00 C ATOM 756 O PRO A 83 13.717 3.398 1.181 1.00 0.00 O ATOM 757 CB PRO A 83 15.329 4.822 3.696 1.00 0.00 C ATOM 758 CG PRO A 83 15.246 4.255 5.110 1.00 0.00 C ATOM 759 CD PRO A 83 14.199 3.153 4.959 1.00 0.00 C ATOM 0 HA PRO A 83 13.321 5.641 3.350 1.00 0.00 H new ATOM 0 HB2 PRO A 83 16.015 4.248 3.073 1.00 0.00 H new ATOM 0 HB3 PRO A 83 15.685 5.852 3.697 1.00 0.00 H new ATOM 0 HG2 PRO A 83 16.205 3.861 5.447 1.00 0.00 H new ATOM 0 HG3 PRO A 83 14.940 5.010 5.834 1.00 0.00 H new ATOM 0 HD2 PRO A 83 14.661 2.212 4.660 1.00 0.00 H new ATOM 0 HD3 PRO A 83 13.685 2.970 5.902 1.00 0.00 H new ATOM 907 N ARG A 94 4.416 7.363 -8.732 1.00 0.00 N ATOM 908 CA ARG A 94 3.219 7.861 -8.056 1.00 0.00 C ATOM 909 C ARG A 94 2.901 7.135 -6.744 1.00 0.00 C ATOM 910 O ARG A 94 2.238 7.700 -5.870 1.00 0.00 O ATOM 911 CB ARG A 94 2.001 7.771 -8.946 1.00 0.00 C ATOM 912 CG ARG A 94 2.098 8.369 -10.355 1.00 0.00 C ATOM 913 CD ARG A 94 0.847 7.940 -11.123 1.00 0.00 C ATOM 914 NE ARG A 94 0.884 6.503 -11.447 1.00 0.00 N ATOM 915 CZ ARG A 94 -0.125 5.643 -11.383 1.00 0.00 C ATOM 916 NH1 ARG A 94 -1.360 6.004 -11.105 1.00 0.00 N ATOM 917 NH2 ARG A 94 0.104 4.368 -11.598 1.00 0.00 N1+ ATOM 0 HA ARG A 94 3.451 8.900 -7.824 1.00 0.00 H new ATOM 0 HB2 ARG A 94 1.737 6.718 -9.047 1.00 0.00 H new ATOM 0 HB3 ARG A 94 1.174 8.259 -8.431 1.00 0.00 H new ATOM 0 HG2 ARG A 94 2.164 9.456 -10.307 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.998 8.017 -10.860 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.040 8.158 -10.528 1.00 0.00 H new ATOM 0 HD3 ARG A 94 0.765 8.520 -12.042 1.00 0.00 H new ATOM 0 HE ARG A 94 1.782 6.129 -11.754 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -1.577 6.985 -10.927 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -2.100 5.303 -11.068 1.00 0.00 H new ATOM 0 HH21 ARG A 94 1.049 4.048 -11.811 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -0.663 3.697 -11.552 1.00 0.00 H new ATOM 931 N PHE A 95 3.323 5.879 -6.632 1.00 0.00 N ATOM 932 CA PHE A 95 3.331 5.089 -5.396 1.00 0.00 C ATOM 933 C PHE A 95 4.345 5.661 -4.381 1.00 0.00 C ATOM 934 O PHE A 95 5.431 6.104 -4.762 1.00 0.00 O ATOM 935 CB PHE A 95 3.659 3.623 -5.727 1.00 0.00 C ATOM 936 CG PHE A 95 2.698 2.963 -6.701 1.00 0.00 C ATOM 937 CD1 PHE A 95 1.489 2.415 -6.240 1.00 0.00 C ATOM 938 CD2 PHE A 95 3.010 2.896 -8.071 1.00 0.00 C ATOM 939 CE1 PHE A 95 0.576 1.844 -7.145 1.00 0.00 C ATOM 940 CE2 PHE A 95 2.099 2.323 -8.979 1.00 0.00 C ATOM 941 CZ PHE A 95 0.877 1.804 -8.517 1.00 0.00 C ATOM 0 H PHE A 95 3.685 5.358 -7.431 1.00 0.00 H new ATOM 0 HA PHE A 95 2.343 5.139 -4.938 1.00 0.00 H new ATOM 0 HB2 PHE A 95 4.666 3.575 -6.142 1.00 0.00 H new ATOM 0 HB3 PHE A 95 3.668 3.049 -4.801 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.259 2.432 -5.185 1.00 0.00 H new ATOM 0 HD2 PHE A 95 3.952 3.286 -8.428 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -0.357 1.436 -6.785 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.339 2.282 -10.031 1.00 0.00 H new ATOM 0 HZ PHE A 95 0.172 1.376 -9.214 1.00 0.00 H new ATOM 951 N ARG A 96 3.993 5.642 -3.090 1.00 0.00 N ATOM 952 CA ARG A 96 4.757 6.230 -1.975 1.00 0.00 C ATOM 953 C ARG A 96 4.648 5.368 -0.709 1.00 0.00 C ATOM 954 O ARG A 96 3.598 4.775 -0.461 1.00 0.00 O ATOM 955 CB ARG A 96 4.213 7.633 -1.636 1.00 0.00 C ATOM 956 CG ARG A 96 4.196 8.621 -2.814 1.00 0.00 C ATOM 957 CD ARG A 96 3.710 10.010 -2.383 1.00 0.00 C ATOM 958 NE ARG A 96 2.304 9.992 -1.934 1.00 0.00 N ATOM 959 CZ ARG A 96 1.634 11.016 -1.416 1.00 0.00 C ATOM 960 NH1 ARG A 96 2.184 12.202 -1.258 1.00 0.00 N ATOM 961 NH2 ARG A 96 0.383 10.858 -1.048 1.00 0.00 N1+ ATOM 0 H ARG A 96 3.130 5.197 -2.776 1.00 0.00 H new ATOM 0 HA ARG A 96 5.798 6.286 -2.293 1.00 0.00 H new ATOM 0 HB2 ARG A 96 3.198 7.530 -1.252 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.817 8.057 -0.833 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.198 8.701 -3.236 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.548 8.237 -3.602 1.00 0.00 H new ATOM 0 HD2 ARG A 96 4.343 10.381 -1.577 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.815 10.705 -3.216 1.00 0.00 H new ATOM 0 HE ARG A 96 1.799 9.111 -2.030 1.00 0.00 H new ATOM 0 HH11 ARG A 96 3.153 12.356 -1.537 1.00 0.00 H new ATOM 0 HH12 ARG A 96 1.641 12.967 -0.857 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -0.071 9.952 -1.160 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -0.134 11.642 -0.650 1.00 0.00 H new ATOM 975 N VAL A 97 5.695 5.364 0.118 1.00 0.00 N ATOM 976 CA VAL A 97 5.724 4.748 1.462 1.00 0.00 C ATOM 977 C VAL A 97 6.189 5.808 2.473 1.00 0.00 C ATOM 978 O VAL A 97 7.238 6.417 2.259 1.00 0.00 O ATOM 979 CB VAL A 97 6.678 3.529 1.512 1.00 0.00 C ATOM 980 CG1 VAL A 97 6.610 2.822 2.879 1.00 0.00 C ATOM 981 CG2 VAL A 97 6.406 2.540 0.366 1.00 0.00 C ATOM 0 H VAL A 97 6.581 5.803 -0.131 1.00 0.00 H new ATOM 0 HA VAL A 97 4.723 4.393 1.706 1.00 0.00 H new ATOM 0 HB VAL A 97 7.691 3.910 1.379 1.00 0.00 H new ATOM 0 HG11 VAL A 97 7.291 1.971 2.883 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.898 3.520 3.665 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.593 2.474 3.058 1.00 0.00 H new ATOM 0 HG21 VAL A 97 7.097 1.700 0.439 1.00 0.00 H new ATOM 0 HG22 VAL A 97 5.382 2.174 0.436 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.546 3.044 -0.590 1.00 0.00 H new ATOM 991 N THR A 98 5.422 6.042 3.549 1.00 0.00 N ATOM 992 CA THR A 98 5.759 7.016 4.612 1.00 0.00 C ATOM 993 C THR A 98 5.626 6.384 5.995 1.00 0.00 C ATOM 994 O THR A 98 4.584 5.809 6.293 1.00 0.00 O ATOM 995 CB THR A 98 4.837 8.242 4.507 1.00 0.00 C ATOM 996 OG1 THR A 98 4.992 8.834 3.234 1.00 0.00 O ATOM 997 CG2 THR A 98 5.163 9.324 5.539 1.00 0.00 C ATOM 0 H THR A 98 4.539 5.557 3.712 1.00 0.00 H new ATOM 0 HA THR A 98 6.795 7.327 4.476 1.00 0.00 H new ATOM 0 HB THR A 98 3.823 7.881 4.681 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.404 9.615 3.163 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.479 10.163 5.415 1.00 0.00 H new ATOM 0 HG22 THR A 98 5.055 8.914 6.543 1.00 0.00 H new ATOM 0 HG23 THR A 98 6.188 9.667 5.395 1.00 0.00 H new ATOM 1005 N GLN A 99 6.635 6.520 6.862 1.00 0.00 N ATOM 1006 CA GLN A 99 6.530 6.152 8.284 1.00 0.00 C ATOM 1007 C GLN A 99 5.877 7.295 9.077 1.00 0.00 C ATOM 1008 O GLN A 99 6.224 8.465 8.901 1.00 0.00 O ATOM 1009 CB GLN A 99 7.915 5.800 8.851 1.00 0.00 C ATOM 1010 CG GLN A 99 7.848 5.220 10.280 1.00 0.00 C ATOM 1011 CD GLN A 99 9.196 4.699 10.798 1.00 0.00 C ATOM 1012 OE1 GLN A 99 10.259 4.923 10.229 1.00 0.00 O ATOM 1013 NE2 GLN A 99 9.228 3.984 11.905 1.00 0.00 N ATOM 0 H GLN A 99 7.550 6.888 6.601 1.00 0.00 H new ATOM 0 HA GLN A 99 5.898 5.269 8.377 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.399 5.078 8.193 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.538 6.694 8.856 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.481 5.990 10.958 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.123 4.407 10.299 1.00 0.00 H new ATOM 0 HE21 GLN A 99 8.363 3.778 12.404 1.00 0.00 H new ATOM 0 HE22 GLN A 99 10.118 3.636 12.262 1.00 0.00 H new ATOM 1022 N LEU A 100 4.927 6.957 9.956 1.00 0.00 N ATOM 1023 CA LEU A 100 4.100 7.924 10.686 1.00 0.00 C ATOM 1024 C LEU A 100 4.713 8.303 12.050 1.00 0.00 C ATOM 1025 O LEU A 100 5.477 7.508 12.611 1.00 0.00 O ATOM 1026 CB LEU A 100 2.680 7.336 10.847 1.00 0.00 C ATOM 1027 CG LEU A 100 2.019 6.882 9.528 1.00 0.00 C ATOM 1028 CD1 LEU A 100 0.564 6.474 9.781 1.00 0.00 C ATOM 1029 CD2 LEU A 100 2.060 7.950 8.426 1.00 0.00 C ATOM 0 H LEU A 100 4.708 5.987 10.184 1.00 0.00 H new ATOM 0 HA LEU A 100 4.051 8.850 10.114 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.728 6.484 11.526 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.043 8.084 11.319 1.00 0.00 H new ATOM 0 HG LEU A 100 2.601 6.031 9.173 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.107 6.156 8.844 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.536 5.652 10.496 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.012 7.324 10.183 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.578 7.564 7.527 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.534 8.843 8.765 1.00 0.00 H new ATOM 0 HD23 LEU A 100 3.097 8.202 8.202 1.00 0.00 H new ATOM 1041 N PRO A 101 4.330 9.461 12.637 1.00 0.00 N ATOM 1042 CA PRO A 101 4.754 9.870 13.979 1.00 0.00 C ATOM 1043 C PRO A 101 4.259 8.940 15.104 1.00 0.00 C ATOM 1044 O PRO A 101 4.696 9.096 16.244 1.00 0.00 O ATOM 1045 CB PRO A 101 4.252 11.309 14.154 1.00 0.00 C ATOM 1046 CG PRO A 101 3.055 11.388 13.214 1.00 0.00 C ATOM 1047 CD PRO A 101 3.494 10.504 12.050 1.00 0.00 C ATOM 0 HA PRO A 101 5.839 9.806 14.062 1.00 0.00 H new ATOM 0 HB2 PRO A 101 3.965 11.511 15.186 1.00 0.00 H new ATOM 0 HB3 PRO A 101 5.019 12.036 13.888 1.00 0.00 H new ATOM 0 HG2 PRO A 101 2.144 11.018 13.684 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.856 12.411 12.895 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.633 10.074 11.539 1.00 0.00 H new ATOM 0 HD3 PRO A 101 4.049 11.080 11.309 1.00 0.00 H new ATOM 1055 N ASN A 102 3.397 7.952 14.813 1.00 0.00 N ATOM 1056 CA ASN A 102 3.058 6.880 15.761 1.00 0.00 C ATOM 1057 C ASN A 102 4.287 6.005 16.118 1.00 0.00 C ATOM 1058 O ASN A 102 4.349 5.415 17.200 1.00 0.00 O ATOM 1059 CB ASN A 102 1.944 6.030 15.131 1.00 0.00 C ATOM 1060 CG ASN A 102 1.494 4.898 16.052 1.00 0.00 C ATOM 1061 OD1 ASN A 102 1.996 3.784 15.983 1.00 0.00 O ATOM 1062 ND2 ASN A 102 0.561 5.158 16.952 1.00 0.00 N ATOM 0 H ASN A 102 2.917 7.875 13.916 1.00 0.00 H new ATOM 0 HA ASN A 102 2.719 7.322 16.698 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.091 6.667 14.897 1.00 0.00 H new ATOM 0 HB3 ASN A 102 2.297 5.611 14.189 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.255 4.428 17.595 1.00 0.00 H new ATOM 0 HD22 ASN A 102 0.147 6.089 17.003 1.00 0.00 H new ATOM 1069 N GLY A 103 5.276 5.933 15.215 1.00 0.00 N ATOM 1070 CA GLY A 103 6.568 5.251 15.379 1.00 0.00 C ATOM 1071 C GLY A 103 6.566 3.795 14.907 1.00 0.00 C ATOM 1072 O GLY A 103 7.563 3.361 14.330 1.00 0.00 O ATOM 0 H GLY A 103 5.191 6.374 14.299 1.00 0.00 H new ATOM 0 HA2 GLY A 103 7.330 5.800 14.827 1.00 0.00 H new ATOM 0 HA3 GLY A 103 6.853 5.281 16.431 1.00 0.00 H new ATOM 1076 N ARG A 104 5.446 3.076 15.062 1.00 0.00 N ATOM 1077 CA ARG A 104 5.223 1.733 14.503 1.00 0.00 C ATOM 1078 C ARG A 104 3.915 1.724 13.698 1.00 0.00 C ATOM 1079 O ARG A 104 2.914 1.122 14.096 1.00 0.00 O ATOM 1080 CB ARG A 104 5.177 0.705 15.652 1.00 0.00 C ATOM 1081 CG ARG A 104 6.545 0.407 16.284 1.00 0.00 C ATOM 1082 CD ARG A 104 6.365 -0.507 17.505 1.00 0.00 C ATOM 1083 NE ARG A 104 7.628 -1.152 17.905 1.00 0.00 N ATOM 1084 CZ ARG A 104 7.774 -2.040 18.883 1.00 0.00 C ATOM 1085 NH1 ARG A 104 6.765 -2.433 19.634 1.00 0.00 N ATOM 1086 NH2 ARG A 104 8.958 -2.557 19.113 1.00 0.00 N1+ ATOM 0 H ARG A 104 4.647 3.421 15.594 1.00 0.00 H new ATOM 0 HA ARG A 104 6.039 1.465 13.832 1.00 0.00 H new ATOM 0 HB2 ARG A 104 4.504 1.072 16.426 1.00 0.00 H new ATOM 0 HB3 ARG A 104 4.753 -0.226 15.275 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.197 -0.071 15.553 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.029 1.337 16.582 1.00 0.00 H new ATOM 0 HD2 ARG A 104 5.976 0.076 18.340 1.00 0.00 H new ATOM 0 HD3 ARG A 104 5.623 -1.273 17.278 1.00 0.00 H new ATOM 0 HE ARG A 104 8.466 -0.894 17.384 1.00 0.00 H new ATOM 0 HH11 ARG A 104 5.832 -2.053 19.474 1.00 0.00 H new ATOM 0 HH12 ARG A 104 6.917 -3.117 20.375 1.00 0.00 H new ATOM 0 HH21 ARG A 104 9.756 -2.277 18.543 1.00 0.00 H new ATOM 0 HH22 ARG A 104 9.080 -3.239 19.861 1.00 0.00 H new ATOM 1100 N ASP A 105 3.957 2.350 12.521 1.00 0.00 N ATOM 1101 CA ASP A 105 2.833 2.531 11.587 1.00 0.00 C ATOM 1102 C ASP A 105 3.291 3.269 10.322 1.00 0.00 C ATOM 1103 O ASP A 105 4.172 4.134 10.382 1.00 0.00 O ATOM 1104 CB ASP A 105 1.658 3.293 12.241 1.00 0.00 C ATOM 1105 CG ASP A 105 0.269 2.828 11.768 1.00 0.00 C ATOM 1106 OD1 ASP A 105 0.101 1.624 11.464 1.00 0.00 O ATOM 1107 OD2 ASP A 105 -0.664 3.663 11.764 1.00 0.00 O1- ATOM 0 H ASP A 105 4.819 2.768 12.171 1.00 0.00 H new ATOM 0 HA ASP A 105 2.480 1.536 11.315 1.00 0.00 H new ATOM 0 HB2 ASP A 105 1.720 3.176 13.323 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.765 4.357 12.029 1.00 0.00 H new ATOM 1112 N PHE A 106 2.694 2.920 9.182 1.00 0.00 N ATOM 1113 CA PHE A 106 3.133 3.364 7.858 1.00 0.00 C ATOM 1114 C PHE A 106 1.946 3.562 6.900 1.00 0.00 C ATOM 1115 O PHE A 106 1.033 2.739 6.849 1.00 0.00 O ATOM 1116 CB PHE A 106 4.119 2.341 7.261 1.00 0.00 C ATOM 1117 CG PHE A 106 5.362 2.042 8.086 1.00 0.00 C ATOM 1118 CD1 PHE A 106 5.301 1.125 9.156 1.00 0.00 C ATOM 1119 CD2 PHE A 106 6.599 2.625 7.746 1.00 0.00 C ATOM 1120 CE1 PHE A 106 6.449 0.834 9.911 1.00 0.00 C ATOM 1121 CE2 PHE A 106 7.759 2.298 8.475 1.00 0.00 C ATOM 1122 CZ PHE A 106 7.680 1.419 9.569 1.00 0.00 C ATOM 0 H PHE A 106 1.877 2.310 9.152 1.00 0.00 H new ATOM 0 HA PHE A 106 3.629 4.327 7.979 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.584 1.406 7.097 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.436 2.702 6.283 1.00 0.00 H new ATOM 0 HD1 PHE A 106 4.365 0.643 9.396 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.658 3.324 6.925 1.00 0.00 H new ATOM 0 HE1 PHE A 106 6.386 0.161 10.754 1.00 0.00 H new ATOM 0 HE2 PHE A 106 8.711 2.723 8.193 1.00 0.00 H new ATOM 0 HZ PHE A 106 8.565 1.193 10.146 1.00 0.00 H new ATOM 1132 N HIS A 107 1.990 4.620 6.089 1.00 0.00 N ATOM 1133 CA HIS A 107 1.064 4.849 4.974 1.00 0.00 C ATOM 1134 C HIS A 107 1.676 4.428 3.625 1.00 0.00 C ATOM 1135 O HIS A 107 2.788 4.832 3.278 1.00 0.00 O ATOM 1136 CB HIS A 107 0.638 6.327 4.939 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.501 6.678 5.864 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.429 5.783 6.403 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -0.841 7.943 6.248 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.290 6.529 7.114 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -1.960 7.831 7.042 1.00 0.00 N ATOM 0 H HIS A 107 2.685 5.359 6.190 1.00 0.00 H new ATOM 0 HA HIS A 107 0.184 4.227 5.137 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.499 6.945 5.194 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.352 6.584 3.919 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -0.330 8.856 5.980 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -3.131 6.138 7.667 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -2.452 8.600 7.496 1.00 0.00 H new ATOM 1149 N MET A 108 0.910 3.655 2.857 1.00 0.00 N ATOM 1150 CA MET A 108 1.198 3.207 1.490 1.00 0.00 C ATOM 1151 C MET A 108 0.249 3.949 0.547 1.00 0.00 C ATOM 1152 O MET A 108 -0.938 3.637 0.504 1.00 0.00 O ATOM 1153 CB MET A 108 0.964 1.690 1.414 1.00 0.00 C ATOM 1154 CG MET A 108 1.905 0.887 2.314 1.00 0.00 C ATOM 1155 SD MET A 108 3.631 0.998 1.834 1.00 0.00 S ATOM 1156 CE MET A 108 4.322 -0.300 2.875 1.00 0.00 C ATOM 0 H MET A 108 0.014 3.301 3.192 1.00 0.00 H new ATOM 0 HA MET A 108 2.230 3.416 1.207 1.00 0.00 H new ATOM 0 HB2 MET A 108 -0.067 1.474 1.693 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.090 1.361 0.383 1.00 0.00 H new ATOM 0 HG2 MET A 108 1.799 1.238 3.341 1.00 0.00 H new ATOM 0 HG3 MET A 108 1.600 -0.159 2.302 1.00 0.00 H new ATOM 0 HE1 MET A 108 5.401 -0.167 2.954 1.00 0.00 H new ATOM 0 HE2 MET A 108 3.876 -0.246 3.868 1.00 0.00 H new ATOM 0 HE3 MET A 108 4.107 -1.273 2.434 1.00 0.00 H new ATOM 1166 N SER A 109 0.735 4.965 -0.164 1.00 0.00 N ATOM 1167 CA SER A 109 -0.116 5.920 -0.898 1.00 0.00 C ATOM 1168 C SER A 109 0.153 5.997 -2.413 1.00 0.00 C ATOM 1169 O SER A 109 1.275 6.273 -2.830 1.00 0.00 O ATOM 1170 CB SER A 109 0.065 7.313 -0.279 1.00 0.00 C ATOM 1171 OG SER A 109 -0.838 8.248 -0.846 1.00 0.00 O ATOM 0 H SER A 109 1.733 5.156 -0.252 1.00 0.00 H new ATOM 0 HA SER A 109 -1.139 5.556 -0.801 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.093 7.258 0.798 1.00 0.00 H new ATOM 0 HB3 SER A 109 1.089 7.652 -0.434 1.00 0.00 H new ATOM 0 HG SER A 109 -1.701 8.190 -0.386 1.00 0.00 H new ATOM 1177 N VAL A 110 -0.881 5.809 -3.243 1.00 0.00 N ATOM 1178 CA VAL A 110 -0.866 6.071 -4.693 1.00 0.00 C ATOM 1179 C VAL A 110 -1.359 7.499 -4.926 1.00 0.00 C ATOM 1180 O VAL A 110 -2.478 7.823 -4.536 1.00 0.00 O ATOM 1181 CB VAL A 110 -1.797 5.132 -5.514 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -1.424 5.194 -7.006 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -1.780 3.676 -5.044 1.00 0.00 C ATOM 0 H VAL A 110 -1.782 5.459 -2.916 1.00 0.00 H new ATOM 0 HA VAL A 110 0.158 5.903 -5.027 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.811 5.499 -5.354 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.080 4.534 -7.573 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.537 6.216 -7.367 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.390 4.876 -7.136 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.453 3.085 -5.665 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.768 3.279 -5.126 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -2.106 3.625 -4.005 1.00 0.00 H new ATOM 1193 N VAL A 111 -0.564 8.338 -5.587 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.026 9.651 -6.080 1.00 0.00 C ATOM 1195 C VAL A 111 -1.742 9.458 -7.426 1.00 0.00 C ATOM 1196 O VAL A 111 -1.180 8.847 -8.332 1.00 0.00 O ATOM 1197 CB VAL A 111 0.137 10.662 -6.216 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.341 12.022 -6.756 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.823 10.889 -4.860 1.00 0.00 C ATOM 0 H VAL A 111 0.413 8.137 -5.799 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.719 10.069 -5.350 1.00 0.00 H new ATOM 0 HB VAL A 111 0.842 10.229 -6.926 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.508 12.701 -6.835 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.790 11.885 -7.740 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.081 12.444 -6.076 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.638 11.603 -4.979 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.098 11.281 -4.147 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.221 9.944 -4.491 1.00 0.00 H new ATOM 1209 N ARG A 112 -2.968 9.989 -7.565 1.00 0.00 N ATOM 1210 CA ARG A 112 -3.715 10.063 -8.837 1.00 0.00 C ATOM 1211 C ARG A 112 -3.901 8.675 -9.481 1.00 0.00 C ATOM 1212 O ARG A 112 -3.284 8.338 -10.496 1.00 0.00 O ATOM 1213 CB ARG A 112 -3.037 11.106 -9.749 1.00 0.00 C ATOM 1214 CG ARG A 112 -3.906 11.526 -10.943 1.00 0.00 C ATOM 1215 CD ARG A 112 -3.353 12.812 -11.573 1.00 0.00 C ATOM 1216 NE ARG A 112 -4.209 13.323 -12.660 1.00 0.00 N ATOM 1217 CZ ARG A 112 -5.367 13.965 -12.535 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -5.981 14.102 -11.377 1.00 0.00 N ATOM 1219 NH2 ARG A 112 -5.934 14.493 -13.598 1.00 0.00 N1+ ATOM 0 H ARG A 112 -3.481 10.389 -6.779 1.00 0.00 H new ATOM 0 HA ARG A 112 -4.735 10.402 -8.654 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -2.791 11.989 -9.159 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -2.096 10.698 -10.119 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -3.927 10.728 -11.685 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -4.934 11.685 -10.616 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -3.255 13.577 -10.803 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -2.353 12.621 -11.962 1.00 0.00 H new ATOM 0 HE ARG A 112 -3.877 13.167 -13.612 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -5.569 13.708 -10.531 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -6.868 14.602 -11.326 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -5.486 14.409 -14.510 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -6.822 14.987 -13.510 1.00 0.00 H new ATOM 1233 N ALA A 113 -4.730 7.839 -8.853 1.00 0.00 N ATOM 1234 CA ALA A 113 -4.993 6.464 -9.275 1.00 0.00 C ATOM 1235 C ALA A 113 -5.894 6.419 -10.524 1.00 0.00 C ATOM 1236 O ALA A 113 -6.899 7.126 -10.605 1.00 0.00 O ATOM 1237 CB ALA A 113 -5.602 5.700 -8.091 1.00 0.00 C ATOM 0 H ALA A 113 -5.249 8.107 -8.017 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.059 5.982 -9.565 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -5.805 4.671 -8.388 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -4.902 5.705 -7.256 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -6.532 6.180 -7.788 1.00 0.00 H new ATOM 1243 N ARG A 114 -5.528 5.589 -11.503 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.290 5.309 -12.731 1.00 0.00 C ATOM 1245 C ARG A 114 -6.869 3.890 -12.667 1.00 0.00 C ATOM 1246 O ARG A 114 -6.391 3.056 -11.902 1.00 0.00 O ATOM 1247 CB ARG A 114 -5.368 5.464 -13.958 1.00 0.00 C ATOM 1248 CG ARG A 114 -5.303 6.896 -14.513 1.00 0.00 C ATOM 1249 CD ARG A 114 -4.678 7.939 -13.575 1.00 0.00 C ATOM 1250 NE ARG A 114 -4.592 9.249 -14.246 1.00 0.00 N ATOM 1251 CZ ARG A 114 -5.573 10.133 -14.392 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -6.747 9.983 -13.814 1.00 0.00 N ATOM 1253 NH2 ARG A 114 -5.384 11.194 -15.147 1.00 0.00 N1+ ATOM 0 H ARG A 114 -4.652 5.067 -11.463 1.00 0.00 H new ATOM 0 HA ARG A 114 -7.114 6.017 -12.821 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -4.362 5.144 -13.687 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.713 4.795 -14.746 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -4.734 6.882 -15.443 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -6.314 7.217 -14.763 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -5.276 8.027 -12.668 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -3.683 7.614 -13.270 1.00 0.00 H new ATOM 0 HE ARG A 114 -3.686 9.503 -14.639 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -6.927 9.166 -13.230 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -7.476 10.684 -13.950 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -4.489 11.334 -15.616 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -6.133 11.877 -15.264 1.00 0.00 H new ATOM 1267 N ARG A 115 -7.861 3.568 -13.506 1.00 0.00 N ATOM 1268 CA ARG A 115 -8.481 2.227 -13.546 1.00 0.00 C ATOM 1269 C ARG A 115 -7.479 1.089 -13.804 1.00 0.00 C ATOM 1270 O ARG A 115 -7.649 -0.011 -13.275 1.00 0.00 O ATOM 1271 CB ARG A 115 -9.653 2.217 -14.536 1.00 0.00 C ATOM 1272 CG ARG A 115 -10.835 2.952 -13.884 1.00 0.00 C ATOM 1273 CD ARG A 115 -12.077 3.047 -14.769 1.00 0.00 C ATOM 1274 NE ARG A 115 -12.589 1.737 -15.219 1.00 0.00 N ATOM 1275 CZ ARG A 115 -13.222 0.817 -14.497 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -13.388 0.923 -13.194 1.00 0.00 N1+ ATOM 1277 NH2 ARG A 115 -13.706 -0.251 -15.094 1.00 0.00 N ATOM 0 H ARG A 115 -8.260 4.224 -14.177 1.00 0.00 H new ATOM 0 HA ARG A 115 -8.871 2.023 -12.549 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.368 2.706 -15.468 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -9.932 1.193 -14.785 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -11.100 2.441 -12.958 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -10.518 3.959 -13.613 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -12.864 3.565 -14.221 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -11.844 3.655 -15.643 1.00 0.00 H new ATOM 0 HE ARG A 115 -12.439 1.511 -16.202 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -13.024 1.736 -12.698 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -13.881 0.192 -12.681 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -13.594 -0.367 -16.101 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -14.193 -0.963 -14.550 1.00 0.00 H new ATOM 1291 N ASN A 116 -6.378 1.383 -14.502 1.00 0.00 N ATOM 1292 CA ASN A 116 -5.231 0.486 -14.696 1.00 0.00 C ATOM 1293 C ASN A 116 -4.507 0.073 -13.391 1.00 0.00 C ATOM 1294 O ASN A 116 -3.755 -0.903 -13.411 1.00 0.00 O ATOM 1295 CB ASN A 116 -4.235 1.168 -15.650 1.00 0.00 C ATOM 1296 CG ASN A 116 -4.850 1.492 -17.008 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -5.341 2.591 -17.236 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -4.869 0.546 -17.931 1.00 0.00 N ATOM 0 H ASN A 116 -6.255 2.284 -14.965 1.00 0.00 H new ATOM 0 HA ASN A 116 -5.624 -0.441 -15.114 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -3.870 2.087 -15.192 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -3.371 0.519 -15.792 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -5.294 0.729 -18.840 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -4.458 -0.367 -17.734 1.00 0.00 H new ATOM 1305 N ASP A 117 -4.712 0.773 -12.267 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.107 0.474 -10.958 1.00 0.00 C ATOM 1307 C ASP A 117 -4.947 -0.489 -10.094 1.00 0.00 C ATOM 1308 O ASP A 117 -4.441 -1.005 -9.101 1.00 0.00 O ATOM 1309 CB ASP A 117 -3.869 1.779 -10.176 1.00 0.00 C ATOM 1310 CG ASP A 117 -2.922 2.754 -10.887 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -1.828 2.337 -11.330 1.00 0.00 O ATOM 1312 OD2 ASP A 117 -3.252 3.960 -10.967 1.00 0.00 O1- ATOM 0 H ASP A 117 -5.323 1.590 -12.241 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.163 -0.028 -11.169 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.826 2.272 -10.008 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.459 1.536 -9.196 1.00 0.00 H new ATOM 1317 N SER A 118 -6.210 -0.761 -10.439 1.00 0.00 N ATOM 1318 CA SER A 118 -7.069 -1.643 -9.627 1.00 0.00 C ATOM 1319 C SER A 118 -6.544 -3.095 -9.592 1.00 0.00 C ATOM 1320 O SER A 118 -6.105 -3.638 -10.612 1.00 0.00 O ATOM 1321 CB SER A 118 -8.528 -1.619 -10.111 1.00 0.00 C ATOM 1322 OG SER A 118 -9.083 -0.307 -10.088 1.00 0.00 O ATOM 0 H SER A 118 -6.663 -0.386 -11.272 1.00 0.00 H new ATOM 0 HA SER A 118 -7.037 -1.249 -8.611 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.579 -2.015 -11.125 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.128 -2.276 -9.482 1.00 0.00 H new ATOM 0 HG SER A 118 -9.954 -0.313 -10.536 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.582 -3.736 -8.418 1.00 0.00 N ATOM 1329 CA GLY A 119 -6.057 -5.096 -8.201 1.00 0.00 C ATOM 1330 C GLY A 119 -5.530 -5.330 -6.784 1.00 0.00 C ATOM 1331 O GLY A 119 -5.824 -4.546 -5.882 1.00 0.00 O ATOM 0 H GLY A 119 -6.984 -3.321 -7.577 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.846 -5.819 -8.410 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -5.254 -5.285 -8.914 1.00 0.00 H new ATOM 1335 N THR A 120 -4.779 -6.421 -6.586 1.00 0.00 N ATOM 1336 CA THR A 120 -4.269 -6.877 -5.276 1.00 0.00 C ATOM 1337 C THR A 120 -2.890 -6.297 -4.987 1.00 0.00 C ATOM 1338 O THR A 120 -2.041 -6.208 -5.872 1.00 0.00 O ATOM 1339 CB THR A 120 -4.193 -8.409 -5.199 1.00 0.00 C ATOM 1340 OG1 THR A 120 -5.338 -8.972 -5.805 1.00 0.00 O ATOM 1341 CG2 THR A 120 -4.129 -8.929 -3.758 1.00 0.00 C ATOM 0 H THR A 120 -4.498 -7.033 -7.353 1.00 0.00 H new ATOM 0 HA THR A 120 -4.975 -6.520 -4.527 1.00 0.00 H new ATOM 0 HB THR A 120 -3.278 -8.700 -5.714 1.00 0.00 H new ATOM 0 HG1 THR A 120 -5.287 -9.949 -5.756 1.00 0.00 H new ATOM 0 HG21 THR A 120 -4.077 -10.018 -3.766 1.00 0.00 H new ATOM 0 HG22 THR A 120 -3.244 -8.527 -3.265 1.00 0.00 H new ATOM 0 HG23 THR A 120 -5.021 -8.613 -3.217 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.658 -5.959 -3.723 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.439 -5.353 -3.191 1.00 0.00 C ATOM 1351 C TYR A 121 -1.042 -5.966 -1.833 1.00 0.00 C ATOM 1352 O TYR A 121 -1.886 -6.524 -1.124 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.668 -3.840 -3.008 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.787 -3.024 -4.282 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.993 -2.995 -5.010 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.691 -2.260 -4.725 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -3.093 -2.245 -6.197 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.798 -1.476 -5.888 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.995 -1.471 -6.633 1.00 0.00 C ATOM 1360 OH TYR A 121 -2.074 -0.721 -7.765 1.00 0.00 O ATOM 0 H TYR A 121 -3.358 -6.109 -2.997 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.632 -5.542 -3.899 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.577 -3.699 -2.424 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.845 -3.437 -2.418 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.847 -3.552 -4.655 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.235 -2.276 -4.170 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -4.007 -2.261 -6.773 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.040 -0.876 -6.211 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.932 -0.888 -8.209 1.00 0.00 H new ATOM 1370 N LEU A 122 0.226 -5.798 -1.434 1.00 0.00 N ATOM 1371 CA LEU A 122 0.745 -6.191 -0.118 1.00 0.00 C ATOM 1372 C LEU A 122 1.996 -5.408 0.301 1.00 0.00 C ATOM 1373 O LEU A 122 2.839 -5.040 -0.516 1.00 0.00 O ATOM 1374 CB LEU A 122 0.948 -7.719 0.005 1.00 0.00 C ATOM 1375 CG LEU A 122 2.082 -8.363 -0.827 1.00 0.00 C ATOM 1376 CD1 LEU A 122 2.326 -9.788 -0.313 1.00 0.00 C ATOM 1377 CD2 LEU A 122 1.755 -8.432 -2.329 1.00 0.00 C ATOM 0 H LEU A 122 0.936 -5.375 -2.032 1.00 0.00 H new ATOM 0 HA LEU A 122 -0.033 -5.916 0.595 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.130 -7.950 1.055 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.012 -8.205 -0.271 1.00 0.00 H new ATOM 0 HG LEU A 122 2.966 -7.736 -0.711 1.00 0.00 H new ATOM 0 HD11 LEU A 122 3.124 -10.252 -0.893 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.615 -9.751 0.737 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.413 -10.374 -0.418 1.00 0.00 H new ATOM 0 HD21 LEU A 122 2.587 -8.893 -2.862 1.00 0.00 H new ATOM 0 HD22 LEU A 122 0.854 -9.027 -2.478 1.00 0.00 H new ATOM 0 HD23 LEU A 122 1.592 -7.425 -2.713 1.00 0.00 H new ATOM 1389 N CYS A 123 2.108 -5.188 1.608 1.00 0.00 N ATOM 1390 CA CYS A 123 3.261 -4.595 2.294 1.00 0.00 C ATOM 1391 C CYS A 123 4.331 -5.669 2.592 1.00 0.00 C ATOM 1392 O CYS A 123 3.987 -6.837 2.795 1.00 0.00 O ATOM 1393 CB CYS A 123 2.697 -3.961 3.576 1.00 0.00 C ATOM 1394 SG CYS A 123 3.855 -3.132 4.686 1.00 0.00 S ATOM 0 H CYS A 123 1.358 -5.430 2.256 1.00 0.00 H new ATOM 0 HA CYS A 123 3.764 -3.845 1.684 1.00 0.00 H new ATOM 0 HB2 CYS A 123 1.936 -3.237 3.285 1.00 0.00 H new ATOM 0 HB3 CYS A 123 2.192 -4.744 4.142 1.00 0.00 H new ATOM 1399 N GLY A 124 5.619 -5.307 2.642 1.00 0.00 N ATOM 1400 CA GLY A 124 6.691 -6.236 3.041 1.00 0.00 C ATOM 1401 C GLY A 124 7.991 -5.555 3.464 1.00 0.00 C ATOM 1402 O GLY A 124 8.522 -4.716 2.738 1.00 0.00 O ATOM 0 H GLY A 124 5.949 -4.370 2.410 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.333 -6.852 3.866 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.901 -6.908 2.209 1.00 0.00 H new ATOM 1406 N ALA A 125 8.527 -5.928 4.628 1.00 0.00 N ATOM 1407 CA ALA A 125 9.785 -5.394 5.165 1.00 0.00 C ATOM 1408 C ALA A 125 11.004 -6.226 4.727 1.00 0.00 C ATOM 1409 O ALA A 125 10.872 -7.393 4.372 1.00 0.00 O ATOM 1410 CB ALA A 125 9.670 -5.302 6.694 1.00 0.00 C ATOM 0 H ALA A 125 8.093 -6.622 5.236 1.00 0.00 H new ATOM 0 HA ALA A 125 9.950 -4.397 4.757 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.599 -4.907 7.106 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.845 -4.640 6.958 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.484 -6.294 7.105 1.00 0.00 H new ATOM 1416 N ILE A 126 12.203 -5.648 4.774 1.00 0.00 N ATOM 1417 CA ILE A 126 13.483 -6.354 4.584 1.00 0.00 C ATOM 1418 C ILE A 126 14.565 -5.712 5.461 1.00 0.00 C ATOM 1419 O ILE A 126 14.619 -4.488 5.591 1.00 0.00 O ATOM 1420 CB ILE A 126 13.866 -6.399 3.083 1.00 0.00 C ATOM 1421 CG1 ILE A 126 14.982 -7.433 2.825 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.296 -5.023 2.549 1.00 0.00 C ATOM 1423 CD1 ILE A 126 15.244 -7.691 1.337 1.00 0.00 C ATOM 0 H ILE A 126 12.322 -4.650 4.949 1.00 0.00 H new ATOM 0 HA ILE A 126 13.382 -7.391 4.904 1.00 0.00 H new ATOM 0 HB ILE A 126 12.968 -6.701 2.544 1.00 0.00 H new ATOM 0 HG12 ILE A 126 15.903 -7.086 3.293 1.00 0.00 H new ATOM 0 HG13 ILE A 126 14.714 -8.373 3.307 1.00 0.00 H new ATOM 0 HG21 ILE A 126 14.554 -5.107 1.493 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.476 -4.315 2.667 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.163 -4.671 3.108 1.00 0.00 H new ATOM 0 HD11 ILE A 126 16.040 -8.428 1.230 1.00 0.00 H new ATOM 0 HD12 ILE A 126 14.335 -8.068 0.868 1.00 0.00 H new ATOM 0 HD13 ILE A 126 15.543 -6.761 0.854 1.00 0.00 H new ATOM 1435 N SER A 127 15.408 -6.520 6.089 1.00 0.00 N ATOM 1436 CA SER A 127 16.500 -6.049 6.956 1.00 0.00 C ATOM 1437 C SER A 127 17.745 -5.612 6.150 1.00 0.00 C ATOM 1438 O SER A 127 17.915 -5.997 4.990 1.00 0.00 O ATOM 1439 CB SER A 127 16.853 -7.132 7.987 1.00 0.00 C ATOM 1440 OG SER A 127 15.672 -7.639 8.595 1.00 0.00 O ATOM 0 H SER A 127 15.359 -7.536 6.015 1.00 0.00 H new ATOM 0 HA SER A 127 16.149 -5.161 7.482 1.00 0.00 H new ATOM 0 HB2 SER A 127 17.397 -7.942 7.501 1.00 0.00 H new ATOM 0 HB3 SER A 127 17.513 -6.717 8.749 1.00 0.00 H new ATOM 0 HG SER A 127 15.911 -8.329 9.248 1.00 0.00 H new ATOM 1446 N LEU A 128 18.647 -4.826 6.755 1.00 0.00 N ATOM 1447 CA LEU A 128 19.893 -4.379 6.101 1.00 0.00 C ATOM 1448 C LEU A 128 21.007 -5.446 6.071 1.00 0.00 C ATOM 1449 O LEU A 128 21.997 -5.275 5.355 1.00 0.00 O ATOM 1450 CB LEU A 128 20.399 -3.080 6.766 1.00 0.00 C ATOM 1451 CG LEU A 128 19.470 -1.853 6.642 1.00 0.00 C ATOM 1452 CD1 LEU A 128 20.185 -0.622 7.219 1.00 0.00 C ATOM 1453 CD2 LEU A 128 19.063 -1.550 5.193 1.00 0.00 C ATOM 0 H LEU A 128 18.537 -4.481 7.709 1.00 0.00 H new ATOM 0 HA LEU A 128 19.642 -4.192 5.057 1.00 0.00 H new ATOM 0 HB2 LEU A 128 20.568 -3.278 7.824 1.00 0.00 H new ATOM 0 HB3 LEU A 128 21.366 -2.825 6.332 1.00 0.00 H new ATOM 0 HG LEU A 128 18.560 -2.085 7.196 1.00 0.00 H new ATOM 0 HD11 LEU A 128 19.535 0.249 7.135 1.00 0.00 H new ATOM 0 HD12 LEU A 128 20.422 -0.798 8.268 1.00 0.00 H new ATOM 0 HD13 LEU A 128 21.106 -0.443 6.664 1.00 0.00 H new ATOM 0 HD21 LEU A 128 18.411 -0.677 5.173 1.00 0.00 H new ATOM 0 HD22 LEU A 128 19.955 -1.350 4.599 1.00 0.00 H new ATOM 0 HD23 LEU A 128 18.534 -2.407 4.777 1.00 0.00 H new ATOM 1465 N ALA A 129 20.871 -6.541 6.827 1.00 0.00 N ATOM 1466 CA ALA A 129 21.847 -7.636 6.873 1.00 0.00 C ATOM 1467 C ALA A 129 21.932 -8.414 5.532 1.00 0.00 C ATOM 1468 O ALA A 129 20.901 -8.575 4.870 1.00 0.00 O ATOM 1469 CB ALA A 129 21.472 -8.565 8.038 1.00 0.00 C ATOM 0 H ALA A 129 20.066 -6.694 7.434 1.00 0.00 H new ATOM 0 HA ALA A 129 22.841 -7.218 7.032 1.00 0.00 H new ATOM 0 HB1 ALA A 129 22.185 -9.388 8.091 1.00 0.00 H new ATOM 0 HB2 ALA A 129 21.494 -8.004 8.972 1.00 0.00 H new ATOM 0 HB3 ALA A 129 20.470 -8.963 7.878 1.00 0.00 H new ATOM 1475 N PRO A 130 23.108 -8.962 5.150 1.00 0.00 N ATOM 1476 CA PRO A 130 23.268 -9.784 3.942 1.00 0.00 C ATOM 1477 C PRO A 130 22.334 -11.003 3.869 1.00 0.00 C ATOM 1478 O PRO A 130 21.966 -11.430 2.775 1.00 0.00 O ATOM 1479 CB PRO A 130 24.732 -10.240 3.945 1.00 0.00 C ATOM 1480 CG PRO A 130 25.446 -9.150 4.738 1.00 0.00 C ATOM 1481 CD PRO A 130 24.405 -8.759 5.784 1.00 0.00 C ATOM 0 HA PRO A 130 23.000 -9.187 3.070 1.00 0.00 H new ATOM 0 HB2 PRO A 130 24.846 -11.217 4.414 1.00 0.00 H new ATOM 0 HB3 PRO A 130 25.128 -10.324 2.933 1.00 0.00 H new ATOM 0 HG2 PRO A 130 26.363 -9.519 5.198 1.00 0.00 H new ATOM 0 HG3 PRO A 130 25.723 -8.306 4.107 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.502 -9.372 6.680 1.00 0.00 H new ATOM 0 HD3 PRO A 130 24.531 -7.721 6.092 1.00 0.00 H new ATOM 1489 N LYS A 131 21.933 -11.554 5.022 1.00 0.00 N ATOM 1490 CA LYS A 131 21.057 -12.734 5.129 1.00 0.00 C ATOM 1491 C LYS A 131 19.543 -12.410 5.064 1.00 0.00 C ATOM 1492 O LYS A 131 18.715 -13.307 5.257 1.00 0.00 O ATOM 1493 CB LYS A 131 21.422 -13.498 6.421 1.00 0.00 C ATOM 1494 CG LYS A 131 22.871 -14.023 6.413 1.00 0.00 C ATOM 1495 CD LYS A 131 23.156 -14.995 7.570 1.00 0.00 C ATOM 1496 CE LYS A 131 23.000 -14.387 8.974 1.00 0.00 C ATOM 1497 NZ LYS A 131 24.063 -13.394 9.289 1.00 0.00 N1+ ATOM 0 H LYS A 131 22.214 -11.184 5.930 1.00 0.00 H new ATOM 0 HA LYS A 131 21.234 -13.359 4.254 1.00 0.00 H new ATOM 0 HB2 LYS A 131 21.283 -12.840 7.279 1.00 0.00 H new ATOM 0 HB3 LYS A 131 20.737 -14.336 6.548 1.00 0.00 H new ATOM 0 HG2 LYS A 131 23.066 -14.525 5.465 1.00 0.00 H new ATOM 0 HG3 LYS A 131 23.559 -13.180 6.474 1.00 0.00 H new ATOM 0 HD2 LYS A 131 22.485 -15.849 7.482 1.00 0.00 H new ATOM 0 HD3 LYS A 131 24.172 -15.376 7.465 1.00 0.00 H new ATOM 0 HE2 LYS A 131 22.025 -13.907 9.052 1.00 0.00 H new ATOM 0 HE3 LYS A 131 23.022 -15.185 9.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 23.912 -13.015 10.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 24.994 -13.855 9.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 24.027 -12.617 8.599 1.00 0.00 H new ATOM 1511 N ALA A 132 19.161 -11.148 4.832 1.00 0.00 N ATOM 1512 CA ALA A 132 17.765 -10.694 4.814 1.00 0.00 C ATOM 1513 C ALA A 132 16.909 -11.340 3.703 1.00 0.00 C ATOM 1514 O ALA A 132 17.413 -11.807 2.678 1.00 0.00 O ATOM 1515 CB ALA A 132 17.744 -9.162 4.706 1.00 0.00 C ATOM 0 H ALA A 132 19.828 -10.398 4.648 1.00 0.00 H new ATOM 0 HA ALA A 132 17.305 -11.018 5.748 1.00 0.00 H new ATOM 0 HB1 ALA A 132 16.712 -8.812 4.692 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.262 -8.730 5.562 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.244 -8.855 3.787 1.00 0.00 H new ATOM 1521 N GLN A 133 15.591 -11.306 3.904 1.00 0.00 N ATOM 1522 CA GLN A 133 14.552 -11.735 2.968 1.00 0.00 C ATOM 1523 C GLN A 133 13.280 -10.906 3.217 1.00 0.00 C ATOM 1524 O GLN A 133 13.173 -10.230 4.244 1.00 0.00 O ATOM 1525 CB GLN A 133 14.288 -13.248 3.113 1.00 0.00 C ATOM 1526 CG GLN A 133 13.787 -13.673 4.506 1.00 0.00 C ATOM 1527 CD GLN A 133 13.440 -15.163 4.554 1.00 0.00 C ATOM 1528 OE1 GLN A 133 14.221 -16.002 4.988 1.00 0.00 O ATOM 1529 NE2 GLN A 133 12.266 -15.557 4.100 1.00 0.00 N ATOM 0 H GLN A 133 15.197 -10.957 4.778 1.00 0.00 H new ATOM 0 HA GLN A 133 14.881 -11.565 1.943 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.552 -13.550 2.367 1.00 0.00 H new ATOM 0 HB3 GLN A 133 15.208 -13.789 2.890 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.553 -13.454 5.250 1.00 0.00 H new ATOM 0 HG3 GLN A 133 12.908 -13.086 4.771 1.00 0.00 H new ATOM 0 HE21 GLN A 133 11.604 -14.872 3.735 1.00 0.00 H new ATOM 0 HE22 GLN A 133 12.020 -16.547 4.114 1.00 0.00 H new ATOM 1538 N ILE A 134 12.311 -10.948 2.298 1.00 0.00 N ATOM 1539 CA ILE A 134 11.073 -10.159 2.426 1.00 0.00 C ATOM 1540 C ILE A 134 10.173 -10.769 3.514 1.00 0.00 C ATOM 1541 O ILE A 134 9.634 -11.868 3.365 1.00 0.00 O ATOM 1542 CB ILE A 134 10.327 -9.996 1.077 1.00 0.00 C ATOM 1543 CG1 ILE A 134 11.253 -9.455 -0.042 1.00 0.00 C ATOM 1544 CG2 ILE A 134 9.130 -9.036 1.271 1.00 0.00 C ATOM 1545 CD1 ILE A 134 10.627 -9.508 -1.442 1.00 0.00 C ATOM 0 H ILE A 134 12.356 -11.520 1.454 1.00 0.00 H new ATOM 0 HA ILE A 134 11.349 -9.150 2.731 1.00 0.00 H new ATOM 0 HB ILE A 134 9.980 -10.981 0.765 1.00 0.00 H new ATOM 0 HG12 ILE A 134 11.521 -8.424 0.188 1.00 0.00 H new ATOM 0 HG13 ILE A 134 12.178 -10.031 -0.046 1.00 0.00 H new ATOM 0 HG21 ILE A 134 8.602 -8.918 0.325 1.00 0.00 H new ATOM 0 HG22 ILE A 134 8.451 -9.448 2.017 1.00 0.00 H new ATOM 0 HG23 ILE A 134 9.493 -8.065 1.608 1.00 0.00 H new ATOM 0 HD11 ILE A 134 11.334 -9.113 -2.172 1.00 0.00 H new ATOM 0 HD12 ILE A 134 10.385 -10.541 -1.693 1.00 0.00 H new ATOM 0 HD13 ILE A 134 9.717 -8.908 -1.457 1.00 0.00 H new ATOM 1557 N LYS A 135 9.975 -10.023 4.599 1.00 0.00 N ATOM 1558 CA LYS A 135 9.004 -10.289 5.659 1.00 0.00 C ATOM 1559 C LYS A 135 7.628 -9.777 5.182 1.00 0.00 C ATOM 1560 O LYS A 135 7.284 -8.607 5.378 1.00 0.00 O ATOM 1561 CB LYS A 135 9.482 -9.589 6.952 1.00 0.00 C ATOM 1562 CG LYS A 135 10.883 -10.021 7.431 1.00 0.00 C ATOM 1563 CD LYS A 135 11.321 -9.206 8.658 1.00 0.00 C ATOM 1564 CE LYS A 135 12.761 -9.559 9.068 1.00 0.00 C ATOM 1565 NZ LYS A 135 13.223 -8.741 10.220 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.514 -9.174 4.771 1.00 0.00 H new ATOM 0 HA LYS A 135 8.914 -11.353 5.877 1.00 0.00 H new ATOM 0 HB2 LYS A 135 9.484 -8.511 6.788 1.00 0.00 H new ATOM 0 HB3 LYS A 135 8.762 -9.789 7.746 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.875 -11.082 7.679 1.00 0.00 H new ATOM 0 HG3 LYS A 135 11.604 -9.887 6.625 1.00 0.00 H new ATOM 0 HD2 LYS A 135 11.253 -8.141 8.435 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.644 -9.401 9.490 1.00 0.00 H new ATOM 0 HE2 LYS A 135 12.816 -10.616 9.327 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.429 -9.403 8.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 14.071 -8.204 9.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 12.470 -8.080 10.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 13.451 -9.365 11.020 1.00 0.00 H new ATOM 1579 N GLU A 136 6.874 -10.632 4.488 1.00 0.00 N ATOM 1580 CA GLU A 136 5.630 -10.263 3.800 1.00 0.00 C ATOM 1581 C GLU A 136 4.458 -10.070 4.775 1.00 0.00 C ATOM 1582 O GLU A 136 4.289 -10.827 5.734 1.00 0.00 O ATOM 1583 CB GLU A 136 5.251 -11.332 2.759 1.00 0.00 C ATOM 1584 CG GLU A 136 6.214 -11.381 1.567 1.00 0.00 C ATOM 1585 CD GLU A 136 5.872 -12.544 0.623 1.00 0.00 C ATOM 1586 OE1 GLU A 136 6.137 -13.717 0.981 1.00 0.00 O1- ATOM 1587 OE2 GLU A 136 5.350 -12.296 -0.489 1.00 0.00 O ATOM 0 H GLU A 136 7.113 -11.618 4.385 1.00 0.00 H new ATOM 0 HA GLU A 136 5.818 -9.311 3.304 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.230 -12.309 3.242 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.243 -11.135 2.395 1.00 0.00 H new ATOM 0 HG2 GLU A 136 6.168 -10.439 1.020 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.237 -11.490 1.927 1.00 0.00 H new ATOM 1594 N SER A 137 3.616 -9.076 4.502 1.00 0.00 N ATOM 1595 CA SER A 137 2.326 -8.866 5.166 1.00 0.00 C ATOM 1596 C SER A 137 1.174 -9.571 4.419 1.00 0.00 C ATOM 1597 O SER A 137 1.370 -10.194 3.369 1.00 0.00 O ATOM 1598 CB SER A 137 2.066 -7.359 5.285 1.00 0.00 C ATOM 1599 OG SER A 137 1.055 -7.092 6.241 1.00 0.00 O ATOM 0 H SER A 137 3.816 -8.372 3.792 1.00 0.00 H new ATOM 0 HA SER A 137 2.368 -9.309 6.161 1.00 0.00 H new ATOM 0 HB2 SER A 137 2.986 -6.849 5.571 1.00 0.00 H new ATOM 0 HB3 SER A 137 1.769 -6.960 4.315 1.00 0.00 H new ATOM 0 HG SER A 137 1.467 -6.923 7.114 1.00 0.00 H new ATOM 1605 N LEU A 138 -0.048 -9.469 4.954 1.00 0.00 N ATOM 1606 CA LEU A 138 -1.266 -9.974 4.312 1.00 0.00 C ATOM 1607 C LEU A 138 -1.738 -9.059 3.166 1.00 0.00 C ATOM 1608 O LEU A 138 -1.367 -7.885 3.090 1.00 0.00 O ATOM 1609 CB LEU A 138 -2.330 -10.289 5.386 1.00 0.00 C ATOM 1610 CG LEU A 138 -2.848 -9.114 6.247 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -3.929 -8.289 5.533 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -3.447 -9.674 7.545 1.00 0.00 C ATOM 0 H LEU A 138 -0.221 -9.027 5.857 1.00 0.00 H new ATOM 0 HA LEU A 138 -1.054 -10.919 3.811 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -3.186 -10.743 4.887 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -1.917 -11.041 6.058 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.000 -8.458 6.444 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -4.256 -7.478 6.183 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.520 -7.873 4.612 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.779 -8.930 5.296 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.815 -8.853 8.160 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -4.271 -10.346 7.305 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -2.680 -10.222 8.093 1.00 0.00 H new ATOM 1624 N ARG A 139 -2.545 -9.612 2.255 1.00 0.00 N ATOM 1625 CA ARG A 139 -3.005 -8.933 1.039 1.00 0.00 C ATOM 1626 C ARG A 139 -4.230 -8.039 1.277 1.00 0.00 C ATOM 1627 O ARG A 139 -5.089 -8.333 2.111 1.00 0.00 O ATOM 1628 CB ARG A 139 -3.304 -9.980 -0.046 1.00 0.00 C ATOM 1629 CG ARG A 139 -2.030 -10.730 -0.472 1.00 0.00 C ATOM 1630 CD ARG A 139 -2.302 -11.803 -1.527 1.00 0.00 C ATOM 1631 NE ARG A 139 -3.114 -12.921 -1.011 1.00 0.00 N ATOM 1632 CZ ARG A 139 -3.605 -13.922 -1.737 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -3.396 -14.009 -3.035 1.00 0.00 N1+ ATOM 1634 NH2 ARG A 139 -4.320 -14.861 -1.157 1.00 0.00 N ATOM 0 H ARG A 139 -2.904 -10.563 2.344 1.00 0.00 H new ATOM 0 HA ARG A 139 -2.204 -8.270 0.711 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -4.039 -10.693 0.327 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -3.747 -9.490 -0.913 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -1.307 -10.015 -0.865 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -1.576 -11.194 0.404 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -2.814 -11.350 -2.376 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -1.353 -12.190 -1.897 1.00 0.00 H new ATOM 0 HE ARG A 139 -3.317 -12.927 -0.011 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -2.844 -13.296 -3.512 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -3.786 -14.789 -3.563 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -4.497 -14.821 -0.153 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -4.698 -15.630 -1.711 1.00 0.00 H new ATOM 1648 N ALA A 140 -4.330 -6.983 0.473 1.00 0.00 N ATOM 1649 CA ALA A 140 -5.479 -6.085 0.330 1.00 0.00 C ATOM 1650 C ALA A 140 -5.720 -5.784 -1.161 1.00 0.00 C ATOM 1651 O ALA A 140 -4.878 -6.122 -1.991 1.00 0.00 O ATOM 1652 CB ALA A 140 -5.197 -4.800 1.116 1.00 0.00 C ATOM 0 H ALA A 140 -3.560 -6.712 -0.138 1.00 0.00 H new ATOM 0 HA ALA A 140 -6.380 -6.552 0.727 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -6.044 -4.121 1.019 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -5.045 -5.043 2.168 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -4.301 -4.321 0.721 1.00 0.00 H new ATOM 1658 N GLU A 141 -6.841 -5.157 -1.521 1.00 0.00 N ATOM 1659 CA GLU A 141 -7.136 -4.778 -2.908 1.00 0.00 C ATOM 1660 C GLU A 141 -7.627 -3.330 -3.061 1.00 0.00 C ATOM 1661 O GLU A 141 -8.289 -2.769 -2.186 1.00 0.00 O ATOM 1662 CB GLU A 141 -8.086 -5.790 -3.574 1.00 0.00 C ATOM 1663 CG GLU A 141 -9.395 -6.045 -2.816 1.00 0.00 C ATOM 1664 CD GLU A 141 -10.308 -6.998 -3.603 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -10.966 -6.555 -4.574 1.00 0.00 O1- ATOM 1666 OE2 GLU A 141 -10.378 -8.201 -3.255 1.00 0.00 O ATOM 0 H GLU A 141 -7.572 -4.896 -0.860 1.00 0.00 H new ATOM 0 HA GLU A 141 -6.186 -4.813 -3.441 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -8.327 -5.435 -4.576 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -7.560 -6.738 -3.690 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -9.176 -6.471 -1.837 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -9.911 -5.100 -2.644 1.00 0.00 H new ATOM 1673 N LEU A 142 -7.275 -2.733 -4.203 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.634 -1.385 -4.637 1.00 0.00 C ATOM 1675 C LEU A 142 -8.670 -1.457 -5.765 1.00 0.00 C ATOM 1676 O LEU A 142 -8.478 -2.195 -6.737 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.352 -0.687 -5.137 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.539 0.750 -5.668 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -7.013 1.717 -4.574 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.213 1.241 -6.259 1.00 0.00 C ATOM 0 H LEU A 142 -6.694 -3.211 -4.892 1.00 0.00 H new ATOM 0 HA LEU A 142 -8.069 -0.824 -3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.631 -0.662 -4.320 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.915 -1.294 -5.930 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.313 0.728 -6.435 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.130 2.715 -4.996 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.969 1.377 -4.177 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.277 1.747 -3.771 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.337 2.256 -6.637 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.445 1.233 -5.486 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.913 0.584 -7.076 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.712 -0.630 -5.664 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.724 -0.394 -6.694 1.00 0.00 C ATOM 1694 C ARG A 143 -10.772 1.098 -7.046 1.00 0.00 C ATOM 1695 O ARG A 143 -11.044 1.940 -6.187 1.00 0.00 O ATOM 1696 CB ARG A 143 -12.079 -0.892 -6.162 1.00 0.00 C ATOM 1697 CG ARG A 143 -13.215 -0.752 -7.187 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.547 -1.227 -6.598 1.00 0.00 C ATOM 1699 NE ARG A 143 -15.643 -1.076 -7.573 1.00 0.00 N ATOM 1700 CZ ARG A 143 -16.943 -1.028 -7.303 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -17.410 -1.130 -6.074 1.00 0.00 N1+ ATOM 1702 NH2 ARG A 143 -17.807 -0.876 -8.283 1.00 0.00 N ATOM 0 H ARG A 143 -9.881 -0.081 -4.821 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.479 -0.937 -7.607 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.986 -1.938 -5.871 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.338 -0.333 -5.263 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.302 0.289 -7.499 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -12.979 -1.334 -8.078 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.464 -2.272 -6.299 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.775 -0.655 -5.699 1.00 0.00 H new ATOM 0 HE ARG A 143 -15.376 -1.001 -8.555 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.766 -1.250 -5.292 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.415 -1.089 -5.905 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.478 -0.796 -9.245 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -18.806 -0.839 -8.081 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.544 1.423 -8.314 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.737 2.766 -8.882 1.00 0.00 C ATOM 1718 C VAL A 144 -12.036 2.777 -9.698 1.00 0.00 C ATOM 1719 O VAL A 144 -12.160 2.043 -10.680 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.530 3.199 -9.743 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -9.707 4.639 -10.247 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.207 3.101 -8.962 1.00 0.00 C ATOM 0 H VAL A 144 -10.210 0.746 -9.000 1.00 0.00 H new ATOM 0 HA VAL A 144 -10.813 3.489 -8.070 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.487 2.516 -10.591 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -8.845 4.922 -10.851 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.611 4.704 -10.852 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -9.791 5.315 -9.396 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.382 3.414 -9.602 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.253 3.749 -8.086 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -8.048 2.071 -8.643 1.00 0.00 H new ATOM 1732 N THR A 145 -13.007 3.598 -9.287 1.00 0.00 N ATOM 1733 CA THR A 145 -14.307 3.790 -9.954 1.00 0.00 C ATOM 1734 C THR A 145 -14.259 5.018 -10.862 1.00 0.00 C ATOM 1735 O THR A 145 -13.499 5.950 -10.609 1.00 0.00 O ATOM 1736 CB THR A 145 -15.437 3.914 -8.918 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.180 4.991 -8.044 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.574 2.637 -8.086 1.00 0.00 C ATOM 0 H THR A 145 -12.910 4.171 -8.449 1.00 0.00 H new ATOM 0 HA THR A 145 -14.514 2.916 -10.571 1.00 0.00 H new ATOM 0 HB THR A 145 -16.364 4.084 -9.466 1.00 0.00 H new ATOM 0 HG1 THR A 145 -15.906 5.062 -7.390 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.381 2.758 -7.364 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.798 1.797 -8.743 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.640 2.445 -7.558 1.00 0.00 H new ATOM 1746 N GLU A 146 -15.047 5.026 -11.938 1.00 0.00 N ATOM 1747 CA GLU A 146 -15.069 6.136 -12.903 1.00 0.00 C ATOM 1748 C GLU A 146 -15.568 7.442 -12.262 1.00 0.00 C ATOM 1749 O GLU A 146 -16.498 7.444 -11.449 1.00 0.00 O ATOM 1750 CB GLU A 146 -15.958 5.794 -14.112 1.00 0.00 C ATOM 1751 CG GLU A 146 -15.340 4.718 -15.007 1.00 0.00 C ATOM 1752 CD GLU A 146 -16.251 4.405 -16.203 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -17.121 3.509 -16.087 1.00 0.00 O1- ATOM 1754 OE2 GLU A 146 -16.105 5.051 -17.268 1.00 0.00 O ATOM 0 H GLU A 146 -15.688 4.267 -12.168 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.042 6.284 -13.236 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -16.931 5.453 -13.759 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -16.130 6.696 -14.699 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.367 5.053 -15.365 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.171 3.811 -14.427 1.00 0.00 H new ATOM 1761 N ARG A 147 -14.969 8.569 -12.668 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.325 9.904 -12.177 1.00 0.00 C ATOM 1763 C ARG A 147 -16.607 10.395 -12.863 1.00 0.00 C ATOM 1764 O ARG A 147 -16.635 10.578 -14.083 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.143 10.867 -12.383 1.00 0.00 C ATOM 1766 CG ARG A 147 -14.382 12.222 -11.695 1.00 0.00 C ATOM 1767 CD ARG A 147 -13.184 13.169 -11.840 1.00 0.00 C ATOM 1768 NE ARG A 147 -13.016 13.637 -13.229 1.00 0.00 N ATOM 1769 CZ ARG A 147 -12.107 14.504 -13.660 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -11.218 15.045 -12.852 1.00 0.00 N1+ ATOM 1771 NH2 ARG A 147 -12.082 14.845 -14.931 1.00 0.00 N ATOM 0 H ARG A 147 -14.215 8.578 -13.355 1.00 0.00 H new ATOM 0 HA ARG A 147 -15.530 9.863 -11.107 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.233 10.415 -11.989 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -13.984 11.024 -13.450 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -15.268 12.692 -12.122 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -14.587 12.058 -10.637 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -13.318 14.027 -11.182 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -12.277 12.658 -11.517 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.659 13.259 -13.924 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.214 14.801 -11.862 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -10.534 15.708 -13.217 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -12.759 14.444 -15.580 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -11.386 15.511 -15.267 1.00 0.00 H new